A0A077Z2N1_TRITR Loading...

26S proteasome non-ATPase regulatory subunit 1

Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A077Z2N1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 957 aa.

						>A0A077Z2N1_TRITR|A0A077Z2N1
MTAILSASGIIALLGEDSPKMKIYALRKLDRLVNIFWHEIANVIANIESLFEDRTFPERKLAALVASKIYFHLTAYDDALLFAIGAEELFDVDANSEYVNTVVARAIDTYALSRKEGAEPVPFLQEKKMASRLQDLINRIFEGCFARKEYKAIVGVAIETRRLDVLQRALDETDEKLELITYCIKAVIEFVQHRGFRNQVLVDMIKRLGSTKNSDYNGICQALKYLEDPECVAEILVHLISESDDAAAVAYQLALDIHDSSPQSFMKGIGKALQARLEGPNEDDDSKSKVASASDQEQKGPSTVSEPSQSVSESEEKTMSEEDENESRVKSHVAALNRIVRGDLQTELYLQFYMKNNHSDILILKTIKDYVRNSVCHSATVISNALMHHGTTSDEFLRTNLEWVSKASNWAKFTAVASLGVIHKGHEAEAMRVLENYLPKESASSSSGYLEAGGLYALGLIFSNRGSAEVISYLKKQMMASSNTVMRHGGCLGLGLATLGTHRWDVYDCLRGVLFYDDAVSGEAAALAMGLVMAGSNNSRSVRELIAYGMDTRHEKILRGICVGLGVIACGCLEEPEPWIKKLLKDKNPLLRRAGVYALAMAYCGTGNSTTAGRLLFISVEDVNDDVRRAAVSCLGFVMVKNPTSCAQLVSQLTESYNPHVRYGAAISLGIACAGTALPEAIYLLEPMLNDAVNFVRQGALIALGMVYMQHSEAMTPKVKDFRASLIKTICDKHEDSLAKFGAIIAHGILDAGGRNVTIGLLARMNYVSTTAAIGLLVFLQTWYWFPLSHFLSLAFQPTCLIGINTKLQMPQVDFISNSNPSLYAYPPPMEEKRTKQLEKLPAVVLSFKSKRRDREKQGKQEQENKTEKADDEPASVSEAISEPEAKKDDAEPNLKVMTMPEDCRYEPVKSLKSGGIIVLRDKEENKEEELVEIVKPVIDGEEANEPEPPEPFDYTE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	62.8	Low	244 Å²	244	83 Å²	83	100%	1.202	50%	0.5	S	S	*	.				0	111	0	-78.5	179	-128	0	0	107	A3	M1-A3 PolarHBondContact O-N 3.49Å; M1-A3 VanDerWaalsContact O-N 3.11Å
2	T	46.2	Very low	63.7	Low	135 Å²	135	81.8 Å²	81.8	83%	0.828	51%	0.506	S	S	*	.			trans	-57.3	114.8	166.8	40.7	0	0	0	0	107.2	I4	T2-I4 PolarHBondContact O-N 3.49Å
3	A	53.5	Low	64.6	Low	78 Å²	78	78.3 Å²	78.3	65%	0.645	48%	0.482	S	S	*	.			trans	-55.6	114	168.2	0	0	0	0	0	106.1	M1 L5	M1-A3 PolarHBondContact O-N 3.49Å; M1-A3 VanDerWaalsContact O-N 3.11Å; A3-L5 PolarHBondContact O-N 3.26Å
4	I	56.8	Low	65	Low	92 Å²	92	73.1 Å²	73.1	47%	0.472	45%	0.45	S	S	.	.			trans	-62.5	112.8	170.6	-62.7	169.8	0	0	0	103.7	T2 S6 L32 F36	T2-I4 PolarHBondContact O-N 3.49Å; I4-S6 WeakPolarHBondContact CG2-O 3.44Å; I4-L32 HydrophobicContact CD1-CD1 4.49Å; I4-L32 HydrophobicContact CD1-CD2 4.35Å; I4-F36 HydrophobicContact CG2-CE2 4.34Å; I4-F36 WeakPolarHBondContact O-CZ 3.44Å
5	L	63.4	Low	65.2	Low	158 Å²	158	72.2 Å²	72.2	83%	0.827	46%	0.46	S	S	*	.			trans	-87.5	-16.3	-174.3	-76.1	160	0	0	0	112.4	A3	A3-L5 PolarHBondContact O-N 3.26Å
6	S	71.3	Confident	65.8	Low	40 Å²	40	72.9 Å²	72.9	28%	0.28	46%	0.456	S	S	.	.			trans	-157.5	147.3	-179.8	177	0	0	0	0	110.5	I4 S8 E39	I4-S6 WeakPolarHBondContact CG2-O 3.44Å; S6-S8 WeakPolarHBondContact OG-CB 3.3Å; S6-S8 PolarHBondContact OG-N 2.89Å; S6-S8 VanDerWaalsContact OG-N 3.15Å; S6-S8 PolarHBondContact OG-OG 2.86Å; S6-E39 WeakPolarHBondContact CB-OE1 3.36Å; S6-E39 VanDerWaalsContact OG-CD 3.27Å; S6-E39 PolarHBondContact OG-OE1 2.93Å; S6-E39 PolarHBondContact OG-OE2 3.22Å
7	A	69.5	Low	65.9	Low	0 Å²	0	77.9 Å²	77.9	0%	0	48%	0.479	C	S	.	.	S	Bend	trans	-87.9	-6.8	172.3	0	0	0	0	0	112.9	G9 I10 I11 F36 E39 I40	A7-G9 VanDerWaalsContact C-N 3.28Å; A7-G9 PolarHBondContact O-N 2.78Å; A7-G9 VanDerWaalsContact O-N 3.12Å; A7-I10 WeakPolarHBondContact O-CA 3.35Å; A7-I10 WeakPolarHBondContact O-CB 3.01Å; A7-I10 PolarHBondContact O-N 3.29Å; A7-I11 HydrophobicContact CB-CD1 4.23Å; A7-I11 HydrophobicContact CB-CG1 4.46Å; A7-I11 WeakPolarHBondContact O-CG1 3.44Å; A7-I11 PolarHBondContact O-N 3.22Å; A7-F36 HydrophobicContact CB-CB 3.77Å; A7-F36 HydrophobicContact CB-CD2 4.43Å; A7-F36 HydrophobicContact CB-CG 4.03Å; A7-E39 WeakPolarHBondContact CA-OE2 3.11Å; A7-E39 WeakPolarHBondContact CB-OE2 3.42Å; A7-E39 PolarHBondContact N-OE2 3.48Å; A7-I40 HydrophobicContact CB-CG1 4.41Å
8	S	70.7	Confident	66.4	Low	70 Å²	70	76.2 Å²	76.2	49%	0.49	47%	0.47	S	S	.	.	H	α-helix	trans	-44.6	-44.1	-179.8	52.4	0	0	0	0	115	S6 I10 I11 A12 E39	S6-S8 WeakPolarHBondContact OG-CB 3.3Å; S6-S8 PolarHBondContact OG-N 2.89Å; S6-S8 VanDerWaalsContact OG-N 3.15Å; S6-S8 PolarHBondContact OG-OG 2.86Å; S8-I10 VanDerWaalsContact C-N 3.29Å; S8-I10 PolarHBondContact O-N 2.88Å; S8-I11 PolarHBondContact O-N 2.78Å; S8-A12 PolarHBondContact O-N 3.28Å; S8-E39 PolarHBondContact N-OE2 3.36Å
9	G	72	Confident	66.7	Low	52 Å²	52	75.9 Å²	75.9	54%	0.536	47%	0.47	S	S	.	.	H	α-helix	trans	-65.8	-28.4	177.7	0	0	0	0	0	114.2	A7	A7-G9 VanDerWaalsContact C-N 3.28Å; A7-G9 PolarHBondContact O-N 2.78Å; A7-G9 VanDerWaalsContact O-N 3.12Å
10	I	74.5	Confident	67.2	Low	18 Å²	18	80.9 Å²	80.9	9%	0.092	48%	0.484	C	S	.	.	H	α-helix	trans	-82.8	-36.4	175.6	-58.5	163.6	0	0	0	109.9	A7 S8 A12 L13 A25 K28 L29 L32	A7-I10 WeakPolarHBondContact O-CA 3.35Å; A7-I10 WeakPolarHBondContact O-CB 3.01Å; A7-I10 PolarHBondContact O-N 3.29Å; S8-I10 VanDerWaalsContact C-N 3.29Å; S8-I10 PolarHBondContact O-N 2.88Å; I10-A12 VanDerWaalsContact C-N 3.28Å; I10-A12 PolarHBondContact O-N 2.67Å; I10-L13 WeakPolarHBondContact O-CB 3.29Å; I10-L13 PolarHBondContact O-N 2.8Å; I10-L13 VanDerWaalsContact O-N 3.14Å; I10-A25 HydrophobicContact CG2-CB 4.14Å; I10-K28 HydrophobicContact CD1-CB 4.18Å; I10-K28 HydrophobicContact CD1-CD 4.09Å; I10-K28 HydrophobicContact CG1-CD 4.26Å; I10-K28 HydrophobicContact CG2-CB 3.98Å; I10-L29 HydrophobicContact CB-CD2 4.27Å; I10-L29 HydrophobicContact CG2-CD1 4.49Å; I10-L29 HydrophobicContact CG2-CD2 3.77Å; I10-L29 HydrophobicContact CG2-CG 3.75Å; I10-L32 HydrophobicContact CD1-CD1 3.37Å
11	I	70.8	Confident	67.7	Low	26 Å²	26	80.7 Å²	80.7	13%	0.133	48%	0.479	C	S	.	.	H	α-helix	trans	-61	-39.4	174.4	-66.8	171	0	0	0	110.5	A7 S8 L13 L14 L29 E39 I40 V43	A7-I11 HydrophobicContact CB-CD1 4.23Å; A7-I11 HydrophobicContact CB-CG1 4.46Å; A7-I11 WeakPolarHBondContact O-CG1 3.44Å; A7-I11 PolarHBondContact O-N 3.22Å; S8-I11 PolarHBondContact O-N 2.78Å; I11-L13 PolarHBondContact O-N 2.74Å; I11-L14 WeakPolarHBondContact O-CB 3.49Å; I11-L14 PolarHBondContact O-N 2.77Å; I11-L29 HydrophobicContact CG1-CD2 4.26Å; I11-E39 HydrophobicContact CD1-CB 3.96Å; I11-I40 HydrophobicContact CD1-CG1 4.29Å; I11-V43 HydrophobicContact CG2-CB 4.02Å; I11-V43 HydrophobicContact CG2-CG1 4.06Å; I11-V43 HydrophobicContact CG2-CG2 3.43Å; I11-V43 VanDerWaalsContact CG2-CG2 3.43Å
12	A	73.2	Confident	69.4	Low	69 Å²	69	71.2 Å²	71.2	57%	0.57	43%	0.431	S	S	*	.	H	α-helix	trans	-58.6	-32.9	175.4	0	0	0	0	0	113.2	S8 I10 L14 G15	S8-A12 PolarHBondContact O-N 3.28Å; I10-A12 VanDerWaalsContact C-N 3.28Å; I10-A12 PolarHBondContact O-N 2.67Å; A12-L14 VanDerWaalsContact C-N 3.26Å; A12-L14 PolarHBondContact O-N 2.77Å; A12-G15 PolarHBondContact O-N 2.69Å; A12-G15 VanDerWaalsContact O-N 3.12Å
13	L	75.7	Confident	70.9	Confident	36 Å²	36	66.1 Å²	66.1	19%	0.188	40%	0.399	C	S	.	.	H	α-helix	trans	-69.6	-20	177.4	-65.9	167.5	0	0	0	113.2	I10 I11 G15 E16 M21 Y24 A25	I10-L13 WeakPolarHBondContact O-CB 3.29Å; I10-L13 PolarHBondContact O-N 2.8Å; I10-L13 VanDerWaalsContact O-N 3.14Å; I11-L13 PolarHBondContact O-N 2.74Å; L13-G15 PolarHBondContact O-N 3.25Å; L13-E16 PolarHBondContact O-N 2.65Å; L13-M21 HydrophobicContact CD2-CE 4.48Å; L13-M21 HydrophobicContact CD2-SD 4.23Å; L13-Y24 HydrophobicContact CD1-CD1 4.29Å; L13-A25 HydrophobicContact CB-CB 3.82Å
14	L	69.9	Low	72.1	Confident	6 Å²	6	68.1 Å²	68.1	3%	0.031	39%	0.391	C	S	.	.	H	α-helix	trans	-68.2	-27	171.8	-73	168.3	0	0	0	111.9	I11 A12 K22 A25 L26 L29 V43 I47 L50	I11-L14 WeakPolarHBondContact O-CB 3.49Å; I11-L14 PolarHBondContact O-N 2.77Å; A12-L14 VanDerWaalsContact C-N 3.26Å; A12-L14 PolarHBondContact O-N 2.77Å; L14-K22 WeakPolarHBondContact O-CE 3.42Å; L14-A25 HydrophobicContact CD2-CB 4.1Å; L14-A25 HydrophobicContact CG-CB 4.08Å; L14-L26 HydrophobicContact CD2-CD2 3.96Å; L14-L26 HydrophobicContact CD2-CG 4.1Å; L14-L29 HydrophobicContact CD1-CD1 3.5Å; L14-L29 VanDerWaalsContact CD1-CD1 3.5Å; L14-L29 HydrophobicContact CD2-CD1 4.28Å; L14-L29 HydrophobicContact CG-CD1 4.01Å; L14-V43 HydrophobicContact CD1-CG1 4.13Å; L14-I47 HydrophobicContact CD1-CD1 4.44Å; L14-I47 HydrophobicContact CD1-CG1 4.1Å; L14-L50 HydrophobicContact CD2-CD1 3.83Å
15	G	68.6	Low	73.2	Confident	59 Å²	59	63.8 Å²	63.8	61%	0.608	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.8	179.4	0	0	0	0	0	114.6	A12 L13	A12-G15 PolarHBondContact O-N 2.69Å; A12-G15 VanDerWaalsContact O-N 3.12Å; L13-G15 PolarHBondContact O-N 3.25Å
16	E	74.7	Confident	74	Confident	83 Å²	83	56.2 Å²	56.2	39%	0.388	33%	0.329	S	S	.	.	S	Bend	trans	-75	143.1	178.3	-72.4	-163.1	-179.5	0	0	112.4	L13 S18 M21 K22	L13-E16 PolarHBondContact O-N 2.65Å; E16-S18 PolarHBondContact O-N 3.49Å; E16-M21 HydrophobicContact CB-CB 4.48Å; E16-M21 VanDerWaalsContact OE2-CG 3.31Å; E16-M21 WeakPolarHBondContact OE2-CG 3.47Å; E16-K22 WeakPolarHBondContact O-CE 3.29Å
17	D	67.6	Low	74.5	Confident	159 Å²	159	61 Å²	61	85%	0.85	34%	0.341	S	S	*	.	S	Bend	trans	-64.7	-22.9	-179	-70	-36.7	0	0	0	114.1	P19	D17-P19 WeakPolarHBondContact O-CD 3.39Å
18	S	75.6	Confident	75.1	Confident	46 Å²	46	64.9 Å²	64.9	32%	0.322	36%	0.358	S	S	.	.			trans	-75.3	124.2	-173.3	84.7	0	0	0	0	111.9	E16 K20 M21 K22	E16-S18 PolarHBondContact O-N 3.49Å; S18-K20 PolarHBondContact O-N 3.09Å; S18-M21 PolarHBondContact O-N 3.06Å; S18-M21 VanDerWaalsContact OG-CB 3.26Å; S18-M21 WeakPolarHBondContact OG-CB 3.03Å; S18-M21 WeakPolarHBondContact OG-CG 3.44Å; S18-M21 PolarHBondContact OG-N 3.34Å; S18-K22 PolarHBondContact O-N 2.86Å
19	P	71.6	Confident	75.6	Confident	71 Å²	71	61.6 Å²	61.6	46%	0.461	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-30.8	-177.6	22.8	-32.7	0	0	0	112.1	D17 K22 I23 F56	D17-P19 WeakPolarHBondContact O-CD 3.39Å; P19-K22 PolarHBondContact O-N 2.69Å; P19-I23 WeakPolarHBondContact O-CD1 3.48Å; P19-I23 WeakPolarHBondContact O-CG1 3.47Å; P19-I23 PolarHBondContact O-N 2.9Å; P19-F56 HydrophobicContact CB-CE2 4.42Å
20	K	77.4	Confident	76	Confident	175 Å²	175	60.8 Å²	60.8	76%	0.761	32%	0.318	S	S	*	.	H	α-helix	trans	-63.9	-40.8	178	-68.3	-177	-179.6	178.2	0	112.6	S18 I23 Y24	S18-K20 PolarHBondContact O-N 3.09Å; K20-I23 PolarHBondContact O-N 2.66Å; K20-Y24 PolarHBondContact O-N 2.67Å
21	M	77.4	Confident	76.3	Confident	77 Å²	77	70 Å²	70	38%	0.379	35%	0.351	S	S	.	.	H	α-helix	trans	-70.6	-40.2	178.6	-68.1	-75.2	-135.9	0	0	111	L13 E16 S18 I23 Y24 A25	L13-M21 HydrophobicContact CD2-CE 4.48Å; L13-M21 HydrophobicContact CD2-SD 4.23Å; E16-M21 HydrophobicContact CB-CB 4.48Å; E16-M21 VanDerWaalsContact OE2-CG 3.31Å; E16-M21 WeakPolarHBondContact OE2-CG 3.47Å; S18-M21 PolarHBondContact O-N 3.06Å; S18-M21 VanDerWaalsContact OG-CB 3.26Å; S18-M21 WeakPolarHBondContact OG-CB 3.03Å; S18-M21 WeakPolarHBondContact OG-CG 3.44Å; S18-M21 PolarHBondContact OG-N 3.34Å; M21-I23 PolarHBondContact O-N 2.97Å; M21-Y24 PolarHBondContact O-N 3.02Å; M21-A25 WeakPolarHBondContact O-CB 3.14Å; M21-A25 PolarHBondContact O-N 2.74Å
22	K	77.8	Confident	76.8	Confident	45 Å²	45	69.9 Å²	69.9	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-43.8	173.1	-61.6	-166.9	-173.2	-175.7	0	112.3	L14 E16 S18 P19 A25 L26 L50 F56	L14-K22 WeakPolarHBondContact O-CE 3.42Å; E16-K22 WeakPolarHBondContact O-CE 3.29Å; S18-K22 PolarHBondContact O-N 2.86Å; P19-K22 PolarHBondContact O-N 2.69Å; K22-A25 WeakPolarHBondContact O-CB 3.36Å; K22-A25 PolarHBondContact O-N 3.38Å; K22-L26 WeakPolarHBondContact O-CG 3.43Å; K22-L26 PolarHBondContact O-N 3.04Å; K22-L50 HydrophobicContact CD-CD1 4.3Å; K22-L50 HydrophobicContact CD-CD2 3.56Å; K22-F56 HydrophobicContact CB-CE2 4Å; K22-F56 HydrophobicContact CB-CZ 4.19Å
23	I	77.6	Confident	77.1	Confident	28 Å²	28	66.6 Å²	66.6	14%	0.144	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-44.4	175.8	-66	164.3	0	0	0	111.2	P19 K20 M21 A25 L26 R27 F56 P57 E58	P19-I23 WeakPolarHBondContact O-CD1 3.48Å; P19-I23 WeakPolarHBondContact O-CG1 3.47Å; P19-I23 PolarHBondContact O-N 2.9Å; K20-I23 PolarHBondContact O-N 2.66Å; M21-I23 PolarHBondContact O-N 2.97Å; I23-A25 VanDerWaalsContact C-N 3.32Å; I23-A25 PolarHBondContact O-N 3.14Å; I23-L26 PolarHBondContact O-N 2.76Å; I23-R27 WeakPolarHBondContact O-CG 3.35Å; I23-R27 PolarHBondContact O-N 3.33Å; I23-F56 HydrophobicContact CG1-CE1 4.46Å; I23-F56 HydrophobicContact CG1-CE2 4.04Å; I23-F56 HydrophobicContact CG1-CZ 3.62Å; I23-P57 HydrophobicContact CD1-CG 4.17Å; I23-E58 HydrophobicContact CD1-CB 4.41Å; I23-E58 HydrophobicContact CD1-CG 3.93Å; I23-E58 HydrophobicContact CG1-CB 3.96Å; I23-E58 HydrophobicContact CG1-CG 3.88Å; I23-E58 HydrophobicContact CG2-CB 4.5Å; I23-E58 HydrophobicContact CG2-CG 3.93Å
24	Y	78.2	Confident	77.2	Confident	121 Å²	121	70 Å²	70	48%	0.475	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-40.5	177.1	-179	-100.2	0	0	0	112	L13 K20 M21 K28	L13-Y24 HydrophobicContact CD1-CD1 4.29Å; K20-Y24 PolarHBondContact O-N 2.67Å; M21-Y24 PolarHBondContact O-N 3.02Å; Y24-K28 HydrophobicContact CD1-CD 4.36Å; Y24-K28 HydrophobicContact CE1-CD 3.66Å; Y24-K28 VanDerWaalsContact CZ-CE 3.48Å; Y24-K28 PolarHBondContact O-N 2.77Å; Y24-K28 WeakPolarHBondContact OH-CE 3.05Å; Y24-K28 PolarHBondContact OH-NZ 3.31Å
25	A	79.3	Confident	77.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-59.9	-52.5	174.1	0	0	0	0	0	110.6	I10 L13 L14 M21 K22 I23 R27 K28 L29	I10-A25 HydrophobicContact CG2-CB 4.14Å; L13-A25 HydrophobicContact CB-CB 3.82Å; L14-A25 HydrophobicContact CD2-CB 4.1Å; L14-A25 HydrophobicContact CG-CB 4.08Å; M21-A25 WeakPolarHBondContact O-CB 3.14Å; M21-A25 PolarHBondContact O-N 2.74Å; K22-A25 WeakPolarHBondContact O-CB 3.36Å; K22-A25 PolarHBondContact O-N 3.38Å; I23-A25 VanDerWaalsContact C-N 3.32Å; I23-A25 PolarHBondContact O-N 3.14Å; A25-R27 PolarHBondContact O-N 2.96Å; A25-K28 PolarHBondContact O-N 3.29Å; A25-K28 VanDerWaalsContact O-N 3.09Å; A25-L29 WeakPolarHBondContact O-CB 3.43Å; A25-L29 VanDerWaalsContact O-CG 3.25Å; A25-L29 WeakPolarHBondContact O-CG 3.31Å; A25-L29 PolarHBondContact O-N 3.15Å
26	L	80.4	Confident	78.3	Confident	0 Å²	0	73 Å²	73	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-56.3	-45.3	179.3	-72.1	173	0	0	0	112.9	L14 K22 I23 K28 L29 D30 I47 F56 L61 A62 V65	L14-L26 HydrophobicContact CD2-CD2 3.96Å; L14-L26 HydrophobicContact CD2-CG 4.1Å; K22-L26 WeakPolarHBondContact O-CG 3.43Å; K22-L26 PolarHBondContact O-N 3.04Å; I23-L26 PolarHBondContact O-N 2.76Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.46Å; L26-L29 PolarHBondContact O-N 3.05Å; L26-D30 WeakPolarHBondContact O-CB 3.31Å; L26-D30 PolarHBondContact O-N 3.43Å; L26-I47 HydrophobicContact CD2-CG2 4.28Å; L26-F56 HydrophobicContact CD1-CE1 3.73Å; L26-F56 HydrophobicContact CD1-CZ 3.86Å; L26-L61 HydrophobicContact CB-CD2 3.66Å; L26-L61 HydrophobicContact CB-CG 4.05Å; L26-A62 HydrophobicContact CD1-CB 3.93Å; L26-A62 HydrophobicContact CD2-CB 4.34Å; L26-V65 HydrophobicContact CD2-CG2 4.46Å
27	R	83.3	Confident	78.6	Confident	141 Å²	141	73.2 Å²	73.2	53%	0.532	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-34.3	178.3	-71	-177.2	-177.5	179.7	0.9	112.9	I23 A25 E58 L61	I23-R27 WeakPolarHBondContact O-CG 3.35Å; I23-R27 PolarHBondContact O-N 3.33Å; A25-R27 PolarHBondContact O-N 2.96Å; R27-E58 IonicContact CZ-OE1 3.95Å; R27-E58 IonicContact NE-OE1 2.85Å; R27-E58 IonicContact NH2-OE1 3.77Å; R27-E58 PolarHBondContact NH2-OE1 3.49Å; R27-L61 HydrophobicContact CB-CD2 4.37Å; R27-L61 HydrophobicContact CG-CD2 3.42Å; R27-L61 VanDerWaalsContact CG-CD2 3.42Å
28	K	80.8	Confident	79.1	Confident	81 Å²	81	70.2 Å²	70.2	35%	0.352	32%	0.32	S	S	.	.	H	α-helix	trans	-75.2	-40.8	174.5	-91.2	-175.3	164.1	176.3	0	111.9	I10 Y24 A25 L26 D30 R31 L32	I10-K28 HydrophobicContact CD1-CB 4.18Å; I10-K28 HydrophobicContact CD1-CD 4.09Å; I10-K28 HydrophobicContact CG1-CD 4.26Å; I10-K28 HydrophobicContact CG2-CB 3.98Å; Y24-K28 HydrophobicContact CD1-CD 4.36Å; Y24-K28 HydrophobicContact CE1-CD 3.66Å; Y24-K28 VanDerWaalsContact CZ-CE 3.48Å; Y24-K28 PolarHBondContact O-N 2.77Å; Y24-K28 WeakPolarHBondContact OH-CE 3.05Å; Y24-K28 PolarHBondContact OH-NZ 3.31Å; A25-K28 PolarHBondContact O-N 3.29Å; A25-K28 VanDerWaalsContact O-N 3.09Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.46Å; K28-D30 VanDerWaalsContact C-N 3.34Å; K28-R31 PolarHBondContact O-N 2.97Å; K28-L32 WeakPolarHBondContact O-CG 3.43Å; K28-L32 PolarHBondContact O-N 3.44Å
29	L	80.9	Confident	79.4	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-44.7	177.6	-70.1	172.9	0	0	0	110.5	I10 I11 L14 A25 L26 R31 L32 V33 I40 V65	I10-L29 HydrophobicContact CB-CD2 4.27Å; I10-L29 HydrophobicContact CG2-CD1 4.49Å; I10-L29 HydrophobicContact CG2-CD2 3.77Å; I10-L29 HydrophobicContact CG2-CG 3.75Å; I11-L29 HydrophobicContact CG1-CD2 4.26Å; L14-L29 HydrophobicContact CD1-CD1 3.5Å; L14-L29 VanDerWaalsContact CD1-CD1 3.5Å; L14-L29 HydrophobicContact CD2-CD1 4.28Å; L14-L29 HydrophobicContact CG-CD1 4.01Å; A25-L29 WeakPolarHBondContact O-CB 3.43Å; A25-L29 VanDerWaalsContact O-CG 3.25Å; A25-L29 WeakPolarHBondContact O-CG 3.31Å; A25-L29 PolarHBondContact O-N 3.15Å; L26-L29 PolarHBondContact O-N 3.05Å; L29-R31 PolarHBondContact O-N 3Å; L29-R31 VanDerWaalsContact O-N 3.11Å; L29-L32 CarbonylContact O-C 3.57Å; L29-L32 WeakPolarHBondContact O-CA 3.48Å; L29-L32 PolarHBondContact O-N 3.09Å; L29-V33 WeakPolarHBondContact O-CG2 3.47Å; L29-V33 PolarHBondContact O-N 3.19Å; L29-I40 HydrophobicContact CB-CD1 4.46Å; L29-I40 HydrophobicContact CD2-CD1 3.7Å; L29-I40 HydrophobicContact CD2-CG1 3.81Å; L29-I40 HydrophobicContact CD2-CG2 4.37Å; L29-V65 HydrophobicContact CB-CG1 4.26Å
30	D	81.1	Confident	79.7	Confident	36 Å²	36	66.7 Å²	66.7	19%	0.193	29%	0.293	C	S	.	.	H	α-helix	trans	-51.5	-37.6	177.4	-173.6	54.5	0	0	0	113.6	L26 K28 V65 K68	L26-D30 WeakPolarHBondContact O-CB 3.31Å; L26-D30 PolarHBondContact O-N 3.43Å; K28-D30 VanDerWaalsContact C-N 3.34Å; D30-V65 HydrophobicContact CB-CG2 3.78Å; D30-K68 WeakPolarHBondContact OD1-CE 3.3Å; D30-K68 IonicContact OD1-NZ 3.77Å; D30-K68 PolarHBondContact OD1-NZ 2.63Å; D30-K68 IonicContact OD2-NZ 3.18Å; D30-K68 PolarHBondContact OD2-NZ 3.01Å
31	R	81.4	Confident	79.9	Confident	211 Å²	211	59.2 Å²	59.2	80%	0.796	26%	0.263	S	S	*	.	H	α-helix	trans	-78.1	-23.4	177.4	-63.6	-179.2	-179.5	-173.8	-0.8	113.7	K28 L29	K28-R31 PolarHBondContact O-N 2.97Å; L29-R31 PolarHBondContact O-N 3Å; L29-R31 VanDerWaalsContact O-N 3.11Å
32	L	81	Confident	80	Confident	23 Å²	23	62.2 Å²	62.2	12%	0.12	28%	0.281	C	S	.	.	H	α-helix	trans	-103.5	-9.8	-174.3	-70	176.7	0	0	0	113.2	I4 I10 K28 L29 N34 I35 F36	I4-L32 HydrophobicContact CD1-CD1 4.49Å; I4-L32 HydrophobicContact CD1-CD2 4.35Å; I10-L32 HydrophobicContact CD1-CD1 3.37Å; K28-L32 WeakPolarHBondContact O-CG 3.43Å; K28-L32 PolarHBondContact O-N 3.44Å; L29-L32 CarbonylContact O-C 3.57Å; L29-L32 WeakPolarHBondContact O-CA 3.48Å; L29-L32 PolarHBondContact O-N 3.09Å; L32-N34 VanDerWaalsContact C-N 3.27Å; L32-N34 PolarHBondContact O-N 3.2Å; L32-I35 PolarHBondContact O-N 3.34Å; L32-F36 HydrophobicContact CB-CD2 4.17Å; L32-F36 HydrophobicContact CD2-CD2 4.19Å; L32-F36 HydrophobicContact CD2-CE2 4.23Å; L32-F36 PolarHBondContact O-N 3.04Å
33	V	79.5	Confident	80.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-52	-46.9	-176.8	-176.7	0	0	0	0	111	L29 I35 F36 W37 I40 V65 K68 I69	L29-V33 WeakPolarHBondContact O-CG2 3.47Å; L29-V33 PolarHBondContact O-N 3.19Å; V33-I35 PolarHBondContact O-N 3.47Å; V33-F36 PolarHBondContact O-N 3.36Å; V33-W37 HydrophobicContact CG1-CB 4.24Å; V33-W37 VanDerWaalsContact O-CA 3.32Å; V33-W37 WeakPolarHBondContact O-CA 3.15Å; V33-W37 WeakPolarHBondContact O-CB 3.45Å; V33-W37 PolarHBondContact O-N 3.47Å; V33-I40 HydrophobicContact CG2-CD1 4.33Å; V33-V65 HydrophobicContact CG2-CG1 4.07Å; V33-K68 HydrophobicContact CB-CB 4.4Å; V33-K68 HydrophobicContact CG1-CB 3.84Å; V33-I69 HydrophobicContact CG1-CG1 3.86Å
34	N	76.7	Confident	80.3	Confident	107 Å²	107	61 Å²	61	57%	0.572	28%	0.277	S	S	*	.	H	α-helix	trans	-60.6	-22.9	-176.4	-65.5	-18.3	0	0	0	114.2	L32 H72	L32-N34 VanDerWaalsContact C-N 3.27Å; L32-N34 PolarHBondContact O-N 3.2Å; N34-H72 PolarHBondContact OD1-NE2 2.97Å
35	I	80.8	Confident	80.4	Confident	110 Å²	110	58 Å²	58	56%	0.564	28%	0.278	S	S	*	.	H	α-helix	trans	-101.2	-44.4	-178.5	-55.8	170.8	0	0	0	110.7	L32 V33 H38	L32-I35 PolarHBondContact O-N 3.34Å; V33-I35 PolarHBondContact O-N 3.47Å; I35-H38 PolarHBondContact O-CE1 3.39Å
36	F	82.2	Confident	80.5	Confident	19 Å²	19	62 Å²	62	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-110.8	21.4	-171.1	-62.7	-73.1	0	0	0	113.6	I4 A7 L32 V33 H38 E39 I40	I4-F36 HydrophobicContact CG2-CE2 4.34Å; I4-F36 WeakPolarHBondContact O-CZ 3.44Å; A7-F36 HydrophobicContact CB-CB 3.77Å; A7-F36 HydrophobicContact CB-CD2 4.43Å; A7-F36 HydrophobicContact CB-CG 4.03Å; L32-F36 HydrophobicContact CB-CD2 4.17Å; L32-F36 HydrophobicContact CD2-CD2 4.19Å; L32-F36 HydrophobicContact CD2-CE2 4.23Å; L32-F36 PolarHBondContact O-N 3.04Å; V33-F36 PolarHBondContact O-N 3.36Å; F36-H38 PolarHBondContact O-N 3.36Å; F36-H38 VanDerWaalsContact O-N 3.08Å; F36-E39 PolarHBondContact O-N 3.43Å; F36-I40 HydrophobicContact CB-CD1 4.4Å; F36-I40 WeakPolarHBondContact O-CG1 3.35Å; F36-I40 PolarHBondContact O-N 3.28Å; F36-I40 VanDerWaalsContact O-N 3.14Å
37	W	80.9	Confident	80.5	Confident	88 Å²	88	62 Å²	62	33%	0.333	30%	0.299	S	S	.	.	H	α-helix	trans	-50.7	-37.6	-179.1	63	-92.7	0	0	0	112.5	V33 E39 I40 A41 H72 L73	V33-W37 HydrophobicContact CG1-CB 4.24Å; V33-W37 VanDerWaalsContact O-CA 3.32Å; V33-W37 WeakPolarHBondContact O-CA 3.15Å; V33-W37 WeakPolarHBondContact O-CB 3.45Å; V33-W37 PolarHBondContact O-N 3.47Å; W37-E39 VanDerWaalsContact C-N 3.34Å; W37-E39 PolarHBondContact O-N 2.95Å; W37-I40 PolarHBondContact O-N 3.18Å; W37-A41 WeakPolarHBondContact O-CB 3.44Å; W37-A41 PolarHBondContact O-N 2.94Å; W37-H72 HydrophobicContact CB-CB 3.99Å; W37-H72 HydrophobicContact CD2-CB 3.79Å; W37-H72 HydrophobicContact CE3-CB 4.01Å; W37-H72 HydrophobicContact CG-CB 3.78Å; W37-H72 AromaticContact CG-CG 3.86Å; W37-L73 HydrophobicContact CE3-CD2 4.39Å; W37-L73 HydrophobicContact CZ3-CD2 4.02Å
38	H	78.2	Confident	80.4	Confident	95 Å²	95	57.3 Å²	57.3	44%	0.44	28%	0.283	S	S	.	.	H	α-helix	trans	-65.1	-31.9	-180	55.9	-84.9	0	0	0	113.4	I35 F36	I35-H38 PolarHBondContact O-CE1 3.39Å; F36-H38 PolarHBondContact O-N 3.36Å; F36-H38 VanDerWaalsContact O-N 3.08Å
39	E	81	Confident	80.4	Confident	44 Å²	44	56.2 Å²	56.2	21%	0.206	29%	0.286	C	S	.	.	H	α-helix	trans	-78.2	-40.5	173.4	-65.6	-170.4	176.3	0	0	111.3	S6 A7 S8 I11 F36 W37 N42	S6-E39 WeakPolarHBondContact CB-OE1 3.36Å; S6-E39 VanDerWaalsContact OG-CD 3.27Å; S6-E39 PolarHBondContact OG-OE1 2.93Å; S6-E39 PolarHBondContact OG-OE2 3.22Å; A7-E39 WeakPolarHBondContact CA-OE2 3.11Å; A7-E39 WeakPolarHBondContact CB-OE2 3.42Å; A7-E39 PolarHBondContact N-OE2 3.48Å; S8-E39 PolarHBondContact N-OE2 3.36Å; I11-E39 HydrophobicContact CD1-CB 3.96Å; F36-E39 PolarHBondContact O-N 3.43Å; W37-E39 VanDerWaalsContact C-N 3.34Å; W37-E39 PolarHBondContact O-N 2.95Å; E39-N42 PolarHBondContact O-N 3.19Å
40	I	78.6	Confident	80.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-72.9	-32	-176	-52.5	166.8	0	0	0	110.9	A7 I11 L29 V33 F36 W37 N42 V43 I44 I47 I69	A7-I40 HydrophobicContact CB-CG1 4.41Å; I11-I40 HydrophobicContact CD1-CG1 4.29Å; L29-I40 HydrophobicContact CB-CD1 4.46Å; L29-I40 HydrophobicContact CD2-CD1 3.7Å; L29-I40 HydrophobicContact CD2-CG1 3.81Å; L29-I40 HydrophobicContact CD2-CG2 4.37Å; V33-I40 HydrophobicContact CG2-CD1 4.33Å; F36-I40 HydrophobicContact CB-CD1 4.4Å; F36-I40 WeakPolarHBondContact O-CG1 3.35Å; F36-I40 PolarHBondContact O-N 3.28Å; F36-I40 VanDerWaalsContact O-N 3.14Å; W37-I40 PolarHBondContact O-N 3.18Å; I40-N42 PolarHBondContact O-N 3.45Å; I40-V43 CarbonylContact O-C 3.58Å; I40-V43 PolarHBondContact O-N 2.88Å; I40-I44 PolarHBondContact O-N 3.28Å; I40-I47 HydrophobicContact CG2-CD1 3.8Å; I40-I69 HydrophobicContact CB-CD1 4.21Å; I40-I69 HydrophobicContact CG2-CD1 3.44Å; I40-I69 VanDerWaalsContact CG2-CD1 3.44Å; I40-I69 HydrophobicContact CG2-CG1 4.26Å
41	A	80	Confident	80.2	Confident	17 Å²	17	56 Å²	56	14%	0.14	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-56.4	-33.3	176.9	0	0	0	0	0	112.7	W37 V43 I44 I69 L73	W37-A41 WeakPolarHBondContact O-CB 3.44Å; W37-A41 PolarHBondContact O-N 2.94Å; A41-V43 PolarHBondContact O-N 3.32Å; A41-V43 VanDerWaalsContact O-N 3.11Å; A41-I44 WeakPolarHBondContact O-CB 3.31Å; A41-I44 VanDerWaalsContact O-CG2 3.31Å; A41-I44 WeakPolarHBondContact O-CG2 3.44Å; A41-I44 PolarHBondContact O-N 3.02Å; A41-I69 HydrophobicContact CB-CG2 3.94Å; A41-L73 HydrophobicContact CB-CD1 4.34Å; A41-L73 HydrophobicContact CB-CD2 4.17Å
42	N	81.4	Confident	79.9	Confident	140 Å²	140	52.8 Å²	52.8	75%	0.749	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-63.1	-18.8	175.9	-66.1	-35.8	0	0	0	113.3	E39 I40	E39-N42 PolarHBondContact O-N 3.19Å; I40-N42 PolarHBondContact O-N 3.45Å
43	V	80.3	Confident	79.8	Confident	25 Å²	25	54.9 Å²	54.9	15%	0.152	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-117.4	14.4	-175.1	-171.1	0	0	0	0	111.1	I11 L14 I40 A41 A45 N46 I47	I11-V43 HydrophobicContact CG2-CB 4.02Å; I11-V43 HydrophobicContact CG2-CG1 4.06Å; I11-V43 HydrophobicContact CG2-CG2 3.43Å; I11-V43 VanDerWaalsContact CG2-CG2 3.43Å; L14-V43 HydrophobicContact CD1-CG1 4.13Å; I40-V43 CarbonylContact O-C 3.58Å; I40-V43 PolarHBondContact O-N 2.88Å; A41-V43 PolarHBondContact O-N 3.32Å; A41-V43 VanDerWaalsContact O-N 3.11Å; V43-A45 VanDerWaalsContact C-N 3.28Å; V43-A45 PolarHBondContact O-N 3.36Å; V43-N46 HydrophobicContact CG1-CB 3.7Å; V43-N46 WeakPolarHBondContact CG1-ND2 3.36Å; V43-N46 WeakPolarHBondContact O-CB 3.26Å; V43-N46 PolarHBondContact O-N 2.84Å; V43-I47 PolarHBondContact O-N 3.18Å
44	I	81	Confident	79.4	Confident	22 Å²	22	65 Å²	65	11%	0.113	33%	0.327	C	S	.	.	H	α-helix	trans	-57.2	-40.5	-179.6	-159.9	167.4	0	0	0	112	I40 A41 N46 I47 E48 I69 Y70 L73	I40-I44 PolarHBondContact O-N 3.28Å; A41-I44 WeakPolarHBondContact O-CB 3.31Å; A41-I44 VanDerWaalsContact O-CG2 3.31Å; A41-I44 WeakPolarHBondContact O-CG2 3.44Å; A41-I44 PolarHBondContact O-N 3.02Å; I44-N46 PolarHBondContact O-N 3.47Å; I44-I47 CarbonylContact O-C 3.57Å; I44-I47 WeakPolarHBondContact O-CA 3.34Å; I44-I47 WeakPolarHBondContact O-CB 3.45Å; I44-I47 PolarHBondContact O-N 2.82Å; I44-E48 WeakPolarHBondContact O-CG 2.85Å; I44-E48 PolarHBondContact O-N 3.2Å; I44-I69 HydrophobicContact CD1-CB 4.08Å; I44-I69 HydrophobicContact CD1-CG2 3.66Å; I44-I69 HydrophobicContact CG1-CG2 4.44Å; I44-Y70 HydrophobicContact CD1-CD1 4.13Å; I44-Y70 HydrophobicContact CD1-CD2 3.66Å; I44-Y70 HydrophobicContact CD1-CE1 3.88Å; I44-Y70 HydrophobicContact CD1-CE2 3.32Å; I44-Y70 HydrophobicContact CD1-CG 4.05Å; I44-Y70 VanDerWaalsContact CD1-CZ 3.48Å; I44-Y70 HydrophobicContact CG1-CE2 3.99Å; I44-L73 HydrophobicContact CD1-CD1 4.13Å
45	A	80.6	Confident	79.3	Confident	60 Å²	60	65.6 Å²	65.6	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-58	-34.1	177.2	0	0	0	0	0	113.1	V43 S49	V43-A45 VanDerWaalsContact C-N 3.28Å; V43-A45 PolarHBondContact O-N 3.36Å; A45-S49 PolarHBondContact O-N 3.13Å
46	N	81.1	Confident	79.1	Confident	83 Å²	83	61 Å²	61	44%	0.444	31%	0.311	S	S	.	.	H	α-helix	trans	-72.4	-36.8	175.2	-67.5	-9	0	0	0	110.8	V43 I44 S49 L50	V43-N46 HydrophobicContact CG1-CB 3.7Å; V43-N46 WeakPolarHBondContact CG1-ND2 3.36Å; V43-N46 WeakPolarHBondContact O-CB 3.26Å; V43-N46 PolarHBondContact O-N 2.84Å; I44-N46 PolarHBondContact O-N 3.47Å; N46-S49 PolarHBondContact O-N 2.85Å; N46-S49 PolarHBondContact O-OG 2.97Å; N46-L50 WeakPolarHBondContact O-CG 3.45Å; N46-L50 PolarHBondContact O-N 2.72Å; N46-L50 VanDerWaalsContact O-N 3.16Å
47	I	80	Confident	78.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.9	-39.9	176	-59	173.2	0	0	0	110.3	L14 L26 I40 V43 I44 L50 F51 A62 V65 A66 I69	L14-I47 HydrophobicContact CD1-CD1 4.44Å; L14-I47 HydrophobicContact CD1-CG1 4.1Å; L26-I47 HydrophobicContact CD2-CG2 4.28Å; I40-I47 HydrophobicContact CG2-CD1 3.8Å; V43-I47 PolarHBondContact O-N 3.18Å; I44-I47 CarbonylContact O-C 3.57Å; I44-I47 WeakPolarHBondContact O-CA 3.34Å; I44-I47 WeakPolarHBondContact O-CB 3.45Å; I44-I47 PolarHBondContact O-N 2.82Å; I47-L50 WeakPolarHBondContact O-CB 3.48Å; I47-L50 PolarHBondContact O-N 3.24Å; I47-F51 PolarHBondContact O-N 3.13Å; I47-F51 VanDerWaalsContact O-N 3.08Å; I47-A62 HydrophobicContact CG2-CB 4.19Å; I47-A62 VanDerWaalsContact CG2-O 3.26Å; I47-A62 WeakPolarHBondContact CG2-O 3.43Å; I47-V65 HydrophobicContact CD1-CG1 3.97Å; I47-A66 HydrophobicContact CG2-CB 4.06Å; I47-I69 HydrophobicContact CD1-CD1 3.78Å
48	E	80.8	Confident	78.7	Confident	42 Å²	42	63 Å²	63	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-59.8	-47.4	173.1	-67.8	178.4	154.1	0	0	111.4	I44 L50 F51 E52 Y70 F82	I44-E48 WeakPolarHBondContact O-CG 2.85Å; I44-E48 PolarHBondContact O-N 3.2Å; E48-L50 PolarHBondContact O-N 2.86Å; E48-F51 CarbonylContact O-C 3.58Å; E48-F51 WeakPolarHBondContact O-CA 3.42Å; E48-F51 WeakPolarHBondContact O-CB 3.46Å; E48-F51 PolarHBondContact O-N 3.32Å; E48-E52 WeakPolarHBondContact O-CG 3.1Å; E48-E52 PolarHBondContact O-N 3.37Å; E48-Y70 WeakPolarHBondContact OE1-CE2 3.16Å; E48-Y70 VanDerWaalsContact OE1-CZ 3.29Å; E48-Y70 PolarHBondContact OE1-OH 3.38Å; E48-F82 HydrophobicContact CG-CE1 4.15Å; E48-F82 HydrophobicContact CG-CZ 3.73Å
49	S	81.4	Confident	78.8	Confident	58 Å²	58	62.1 Å²	62.1	41%	0.406	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-33.7	177	77.5	0	0	0	0	112.7	A45 N46 E52 D53	A45-S49 PolarHBondContact O-N 3.13Å; N46-S49 PolarHBondContact O-N 2.85Å; N46-S49 PolarHBondContact O-OG 2.97Å; S49-E52 PolarHBondContact O-N 3.17Å; S49-D53 WeakPolarHBondContact O-CB 3.42Å; S49-D53 PolarHBondContact O-N 3.36Å
50	L	79.5	Confident	78.9	Confident	8 Å²	8	63.1 Å²	63.1	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-72.8	-29.2	175.3	-66.7	170.9	0	0	0	112.9	L14 K22 N46 I47 E48 F56 A62	L14-L50 HydrophobicContact CD2-CD1 3.83Å; K22-L50 HydrophobicContact CD-CD1 4.3Å; K22-L50 HydrophobicContact CD-CD2 3.56Å; N46-L50 WeakPolarHBondContact O-CG 3.45Å; N46-L50 PolarHBondContact O-N 2.72Å; N46-L50 VanDerWaalsContact O-N 3.16Å; I47-L50 WeakPolarHBondContact O-CB 3.48Å; I47-L50 PolarHBondContact O-N 3.24Å; E48-L50 PolarHBondContact O-N 2.86Å; L50-F56 HydrophobicContact CD2-CD2 4.34Å; L50-F56 HydrophobicContact CD2-CE2 4.42Å; L50-A62 HydrophobicContact CB-CB 4.17Å
51	F	77.5	Confident	79	Confident	24 Å²	24	63.7 Å²	63.7	11%	0.105	33%	0.332	C	S	.	.	H	α-helix	trans	-75	-37.7	171.8	172	-111	0	0	0	112	I47 E48 R59 A62 A63 F82	I47-F51 PolarHBondContact O-N 3.13Å; I47-F51 VanDerWaalsContact O-N 3.08Å; E48-F51 CarbonylContact O-C 3.58Å; E48-F51 WeakPolarHBondContact O-CA 3.42Å; E48-F51 WeakPolarHBondContact O-CB 3.46Å; E48-F51 PolarHBondContact O-N 3.32Å; F51-R59 HydrophobicContact CD2-CB 4.37Å; F51-R59 VanDerWaalsContact O-CZ 3.24Å; F51-R59 PolarHBondContact O-NE 2.83Å; F51-R59 PolarHBondContact O-NH2 2.85Å; F51-A62 HydrophobicContact CB-CB 4.27Å; F51-A63 HydrophobicContact CD2-CB 3.56Å; F51-A63 HydrophobicContact CE2-CB 3.67Å; F51-A63 HydrophobicContact CG-CB 4.25Å; F51-A63 HydrophobicContact CZ-CB 4.45Å; F51-F82 HydrophobicContact CD1-CD1 4.06Å; F51-F82 AromaticContact CD1-CE1 3.79Å; F51-F82 HydrophobicContact CD1-CE1 3.79Å; F51-F82 HydrophobicContact CE1-CD1 4.29Å; F51-F82 HydrophobicContact CE1-CE1 4.24Å; F51-F82 HydrophobicContact CG-CE1 4.47Å
52	E	75.9	Confident	79.1	Confident	144 Å²	144	62.9 Å²	62.9	67%	0.673	33%	0.326	S	S	*	.	H	α-helix	trans	-70.7	-34.3	177.3	-70.3	-176.1	171.2	0	0	112.6	E48 S49 R54	E48-E52 WeakPolarHBondContact O-CG 3.1Å; E48-E52 PolarHBondContact O-N 3.37Å; S49-E52 PolarHBondContact O-N 3.17Å; E52-R54 PolarHBondContact O-N 2.9Å; E52-R54 VanDerWaalsContact O-N 3.16Å
53	D	78.8	Confident	79.2	Confident	66 Å²	66	56.2 Å²	56.2	35%	0.353	29%	0.29	S	S	.	.			trans	-64.1	112.7	178.4	-176.5	1	0	0	0	111.8	S49 T55 F56 R59	S49-D53 WeakPolarHBondContact O-CB 3.42Å; S49-D53 PolarHBondContact O-N 3.36Å; D53-T55 VanDerWaalsContact CG-OG1 3.25Å; D53-T55 PolarHBondContact O-N 2.89Å; D53-T55 WeakPolarHBondContact OD1-CB 3.27Å; D53-T55 PolarHBondContact OD1-N 3.14Å; D53-T55 PolarHBondContact OD1-OG1 3.16Å; D53-T55 PolarHBondContact OD2-OG1 3.19Å; D53-T55 VanDerWaalsContact OD2-OG1 3.09Å; D53-F56 HydrophobicContact CB-CB 4.43Å; D53-F56 PolarHBondContact O-N 3.26Å; D53-R59 WeakPolarHBondContact O-CD 3.23Å; D53-R59 PolarHBondContact O-NE 3.28Å
54	R	70.2	Confident	79.4	Confident	213 Å²	213	55.7 Å²	55.7	80%	0.804	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-19.9	179.6	-64.3	-169.3	179.7	-172.4	3.6	113.7	E52	E52-R54 PolarHBondContact O-N 2.9Å; E52-R54 VanDerWaalsContact O-N 3.16Å
55	T	75.1	Confident	79.6	Confident	120 Å²	120	54.6 Å²	54.6	74%	0.736	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-14.9	-178.1	67.3	0	0	0	0	112.9	D53	D53-T55 VanDerWaalsContact CG-OG1 3.25Å; D53-T55 PolarHBondContact O-N 2.89Å; D53-T55 WeakPolarHBondContact OD1-CB 3.27Å; D53-T55 PolarHBondContact OD1-N 3.14Å; D53-T55 PolarHBondContact OD1-OG1 3.16Å; D53-T55 PolarHBondContact OD2-OG1 3.19Å; D53-T55 VanDerWaalsContact OD2-OG1 3.09Å
56	F	76.6	Confident	79.8	Confident	14 Å²	14	51.8 Å²	51.8	6%	0.061	26%	0.257	C	S	.	.			trans	-74.8	131.1	-179.3	-167.6	-112.7	0	0	0	111.3	P19 K22 I23 L26 L50 D53 E58 R59	P19-F56 HydrophobicContact CB-CE2 4.42Å; K22-F56 HydrophobicContact CB-CE2 4Å; K22-F56 HydrophobicContact CB-CZ 4.19Å; I23-F56 HydrophobicContact CG1-CE1 4.46Å; I23-F56 HydrophobicContact CG1-CE2 4.04Å; I23-F56 HydrophobicContact CG1-CZ 3.62Å; L26-F56 HydrophobicContact CD1-CE1 3.73Å; L26-F56 HydrophobicContact CD1-CZ 3.86Å; L50-F56 HydrophobicContact CD2-CD2 4.34Å; L50-F56 HydrophobicContact CD2-CE2 4.42Å; D53-F56 HydrophobicContact CB-CB 4.43Å; D53-F56 PolarHBondContact O-N 3.26Å; F56-E58 HydrophobicContact CD1-CB 4.47Å; F56-E58 HydrophobicContact CE1-CB 3.82Å; F56-E58 WeakPolarHBondContact CE1-O 3.43Å; F56-E58 HydrophobicContact CZ-CB 4.33Å; F56-R59 HydrophobicContact CB-CG 4.05Å; F56-R59 HydrophobicContact CD1-CG 4.2Å; F56-R59 VanDerWaalsContact O-CG 3.28Å; F56-R59 WeakPolarHBondContact O-CG 3.24Å
57	P	74.5	Confident	80.1	Confident	98 Å²	98	47.8 Å²	47.8	64%	0.636	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-30.4	-176.1	9	-6.9	0	0	0	114.6	I23	I23-P57 HydrophobicContact CD1-CG 4.17Å
58	E	80.5	Confident	80.4	Confident	50 Å²	50	49.6 Å²	49.6	23%	0.234	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	44.2	-173	-73.4	-88.8	-150.4	0	0	112	I23 R27 F56 K60 L61 A62	I23-E58 HydrophobicContact CD1-CB 4.41Å; I23-E58 HydrophobicContact CD1-CG 3.93Å; I23-E58 HydrophobicContact CG1-CB 3.96Å; I23-E58 HydrophobicContact CG1-CG 3.88Å; I23-E58 HydrophobicContact CG2-CB 4.5Å; I23-E58 HydrophobicContact CG2-CG 3.93Å; R27-E58 IonicContact CZ-OE1 3.95Å; R27-E58 IonicContact NE-OE1 2.85Å; R27-E58 IonicContact NH2-OE1 3.77Å; R27-E58 PolarHBondContact NH2-OE1 3.49Å; F56-E58 HydrophobicContact CD1-CB 4.47Å; F56-E58 HydrophobicContact CE1-CB 3.82Å; F56-E58 WeakPolarHBondContact CE1-O 3.43Å; F56-E58 HydrophobicContact CZ-CB 4.33Å; E58-K60 VanDerWaalsContact C-N 3.28Å; E58-K60 PolarHBondContact O-N 2.9Å; E58-L61 HydrophobicContact CB-CB 4.34Å; E58-L61 WeakPolarHBondContact O-CB 3.24Å; E58-L61 PolarHBondContact O-N 2.93Å; E58-L61 VanDerWaalsContact O-N 3.16Å; E58-A62 PolarHBondContact O-N 3.24Å
59	R	80.6	Confident	80.6	Confident	76 Å²	76	47.6 Å²	47.6	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-38.8	-180	-68	171.6	66.4	-159.7	-8.3	112.8	F51 D53 F56 L61 A62 A63	F51-R59 HydrophobicContact CD2-CB 4.37Å; F51-R59 VanDerWaalsContact O-CZ 3.24Å; F51-R59 PolarHBondContact O-NE 2.83Å; F51-R59 PolarHBondContact O-NH2 2.85Å; D53-R59 WeakPolarHBondContact O-CD 3.23Å; D53-R59 PolarHBondContact O-NE 3.28Å; F56-R59 HydrophobicContact CB-CG 4.05Å; F56-R59 HydrophobicContact CD1-CG 4.2Å; F56-R59 VanDerWaalsContact O-CG 3.28Å; F56-R59 WeakPolarHBondContact O-CG 3.24Å; R59-L61 PolarHBondContact O-N 3.25Å; R59-A62 WeakPolarHBondContact O-CB 3.37Å; R59-A62 PolarHBondContact O-N 2.93Å; R59-A63 PolarHBondContact O-N 3.25Å
60	K	82.4	Confident	80.8	Confident	65 Å²	65	46.4 Å²	46.4	28%	0.283	22%	0.221	S	C	.	.	H	α-helix	trans	-57.8	-37.5	178.5	-60.5	-168.2	-170.3	-161.4	0	110.9	E58 A63 L64 E87 E88 L89	E58-K60 VanDerWaalsContact C-N 3.28Å; E58-K60 PolarHBondContact O-N 2.9Å; K60-A63 WeakPolarHBondContact O-CB 3.43Å; K60-A63 PolarHBondContact O-N 3.07Å; K60-L64 PolarHBondContact O-N 2.99Å; K60-E87 HydrophobicContact CD-CB 4.31Å; K60-E87 WeakPolarHBondContact CE-OE2 3.44Å; K60-E87 IonicContact NZ-OE2 2.77Å; K60-E87 PolarHBondContact NZ-OE2 2.86Å; K60-E88 IonicContact NZ-OE2 3.13Å; K60-E88 PolarHBondContact NZ-OE2 3.04Å; K60-L89 VanDerWaalsContact C-CD1 3.49Å; K60-L89 HydrophobicContact CB-CD1 3.51Å; K60-L89 HydrophobicContact CB-CG 4.11Å
61	L	80.6	Confident	81.2	Confident	13 Å²	13	47.2 Å²	47.2	7%	0.068	22%	0.224	C	C	.	.	H	α-helix	trans	-72.6	-40	179.6	-175.6	67.8	0	0	0	111.6	L26 R27 E58 R59 A63 L64 V65 L89	L26-L61 HydrophobicContact CB-CD2 3.66Å; L26-L61 HydrophobicContact CB-CG 4.05Å; R27-L61 HydrophobicContact CB-CD2 4.37Å; R27-L61 HydrophobicContact CG-CD2 3.42Å; R27-L61 VanDerWaalsContact CG-CD2 3.42Å; E58-L61 HydrophobicContact CB-CB 4.34Å; E58-L61 WeakPolarHBondContact O-CB 3.24Å; E58-L61 PolarHBondContact O-N 2.93Å; E58-L61 VanDerWaalsContact O-N 3.16Å; R59-L61 PolarHBondContact O-N 3.25Å; L61-A63 VanDerWaalsContact C-N 3.28Å; L61-A63 PolarHBondContact O-N 3.43Å; L61-L64 PolarHBondContact O-N 2.9Å; L61-V65 WeakPolarHBondContact O-CG2 3.48Å; L61-V65 PolarHBondContact O-N 2.92Å; L61-V65 VanDerWaalsContact O-N 3.09Å; L61-L89 HydrophobicContact CB-CD1 3.87Å; L61-L89 HydrophobicContact CD1-CD1 4.33Å; L61-L89 VanDerWaalsContact N-CD1 3.33Å
62	A	82.5	Confident	81.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58.6	-43	172.6	0	0	0	0	0	111.1	L26 I47 L50 F51 E58 R59 V65 A66	L26-A62 HydrophobicContact CD1-CB 3.93Å; L26-A62 HydrophobicContact CD2-CB 4.34Å; I47-A62 HydrophobicContact CG2-CB 4.19Å; I47-A62 VanDerWaalsContact CG2-O 3.26Å; I47-A62 WeakPolarHBondContact CG2-O 3.43Å; L50-A62 HydrophobicContact CB-CB 4.17Å; F51-A62 HydrophobicContact CB-CB 4.27Å; E58-A62 PolarHBondContact O-N 3.24Å; R59-A62 WeakPolarHBondContact O-CB 3.37Å; R59-A62 PolarHBondContact O-N 2.93Å; A62-V65 PolarHBondContact O-N 2.92Å; A62-A66 WeakPolarHBondContact O-CB 3.34Å; A62-A66 PolarHBondContact O-N 3.36Å
63	A	84.3	Confident	82.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-44.8	175.2	0	0	0	0	0	112.4	F51 R59 K60 L61 V65 A66 S67 F82 A86	F51-A63 HydrophobicContact CD2-CB 3.56Å; F51-A63 HydrophobicContact CE2-CB 3.67Å; F51-A63 HydrophobicContact CG-CB 4.25Å; F51-A63 HydrophobicContact CZ-CB 4.45Å; R59-A63 PolarHBondContact O-N 3.25Å; K60-A63 WeakPolarHBondContact O-CB 3.43Å; K60-A63 PolarHBondContact O-N 3.07Å; L61-A63 VanDerWaalsContact C-N 3.28Å; L61-A63 PolarHBondContact O-N 3.43Å; A63-V65 PolarHBondContact O-N 3.22Å; A63-A66 PolarHBondContact O-N 2.82Å; A63-S67 WeakPolarHBondContact O-CB 3.25Å; A63-S67 PolarHBondContact O-N 3.26Å; A63-F82 WeakPolarHBondContact CB-O 3.4Å; A63-F82 WeakPolarHBondContact O-CB 3.34Å; A63-A86 HydrophobicContact CB-CB 4.14Å
64	L	84.2	Confident	82.5	Confident	13 Å²	13	46.4 Å²	46.4	7%	0.068	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-44.3	178.8	-175.3	67.8	0	0	0	112.1	K60 L61 S67 K68 A86 L89 F90	K60-L64 PolarHBondContact O-N 2.99Å; L61-L64 PolarHBondContact O-N 2.9Å; L64-S67 PolarHBondContact O-N 2.74Å; L64-K68 WeakPolarHBondContact O-CG 3.21Å; L64-K68 PolarHBondContact O-N 2.81Å; L64-K68 VanDerWaalsContact O-N 3.08Å; L64-A86 HydrophobicContact CB-CB 3.95Å; L64-A86 HydrophobicContact CD1-CB 4.27Å; L64-L89 HydrophobicContact CD2-CB 4.3Å; L64-F90 HydrophobicContact CD1-CB 4.5Å; L64-F90 HydrophobicContact CD1-CD2 4.23Å
65	V	83.9	Confident	83.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-45.5	178.3	176.7	0	0	0	0	110.4	L26 L29 D30 V33 I47 L61 A62 A63 S67 K68 I69	L26-V65 HydrophobicContact CD2-CG2 4.46Å; L29-V65 HydrophobicContact CB-CG1 4.26Å; D30-V65 HydrophobicContact CB-CG2 3.78Å; V33-V65 HydrophobicContact CG2-CG1 4.07Å; I47-V65 HydrophobicContact CD1-CG1 3.97Å; L61-V65 WeakPolarHBondContact O-CG2 3.48Å; L61-V65 PolarHBondContact O-N 2.92Å; L61-V65 VanDerWaalsContact O-N 3.09Å; A62-V65 PolarHBondContact O-N 2.92Å; A63-V65 PolarHBondContact O-N 3.22Å; V65-S67 VanDerWaalsContact C-N 3.34Å; V65-S67 PolarHBondContact O-N 2.91Å; V65-K68 PolarHBondContact O-N 3.36Å; V65-I69 HydrophobicContact CG1-CD1 3.89Å; V65-I69 WeakPolarHBondContact O-CD1 3.46Å; V65-I69 VanDerWaalsContact O-CG1 3.25Å; V65-I69 WeakPolarHBondContact O-CG1 3.41Å; V65-I69 PolarHBondContact O-N 2.86Å; V65-I69 VanDerWaalsContact O-N 3.1Å
66	A	85.1	Confident	83.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-46.3	175.6	0	0	0	0	0	111.6	I47 A62 A63 K68 I69 Y70 F82	I47-A66 HydrophobicContact CG2-CB 4.06Å; A62-A66 WeakPolarHBondContact O-CB 3.34Å; A62-A66 PolarHBondContact O-N 3.36Å; A63-A66 PolarHBondContact O-N 2.82Å; A66-K68 PolarHBondContact O-N 3.47Å; A66-I69 PolarHBondContact O-N 3.44Å; A66-I69 VanDerWaalsContact O-N 3.15Å; A66-Y70 VanDerWaalsContact O-CD2 3.26Å; A66-Y70 WeakPolarHBondContact O-CD2 3.25Å; A66-Y70 PolarHBondContact O-N 3.13Å; A66-F82 HydrophobicContact CB-CB 4.22Å; A66-F82 HydrophobicContact CB-CD1 3.83Å; A66-F82 HydrophobicContact CB-CD2 4.24Å; A66-F82 HydrophobicContact CB-CE1 4.26Å; A66-F82 HydrophobicContact CB-CG 3.83Å
67	S	86.8	Confident	83.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.5	-45.7	179.2	-176.4	0	0	0	0	112.9	A63 L64 V65 I69 Y70 F71 A79 A83 Y98	A63-S67 WeakPolarHBondContact O-CB 3.25Å; A63-S67 PolarHBondContact O-N 3.26Å; L64-S67 PolarHBondContact O-N 2.74Å; V65-S67 VanDerWaalsContact C-N 3.34Å; V65-S67 PolarHBondContact O-N 2.91Å; S67-I69 VanDerWaalsContact C-N 3.31Å; S67-I69 PolarHBondContact O-N 3.36Å; S67-Y70 PolarHBondContact O-N 3.29Å; S67-F71 PolarHBondContact O-N 3.15Å; S67-A79 WeakPolarHBondContact CB-O 3.4Å; S67-A79 PolarHBondContact OG-O 3.11Å; S67-A83 WeakPolarHBondContact OG-CB 3.31Å; S67-A83 PolarHBondContact OG-N 2.91Å; S67-Y98 VanDerWaalsContact CB-OH 3.24Å; S67-Y98 WeakPolarHBondContact CB-OH 3.49Å; S67-Y98 PolarHBondContact OG-OH 3.31Å
68	K	86.2	Confident	84.4	Confident	37 Å²	37	37.8 Å²	37.8	16%	0.161	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-37.6	175.8	-72.4	177.2	177.7	175	0	112.4	D30 V33 L64 V65 A66 H72 Y98	D30-K68 WeakPolarHBondContact OD1-CE 3.3Å; D30-K68 IonicContact OD1-NZ 3.77Å; D30-K68 PolarHBondContact OD1-NZ 2.63Å; D30-K68 IonicContact OD2-NZ 3.18Å; D30-K68 PolarHBondContact OD2-NZ 3.01Å; V33-K68 HydrophobicContact CB-CB 4.4Å; V33-K68 HydrophobicContact CG1-CB 3.84Å; L64-K68 WeakPolarHBondContact O-CG 3.21Å; L64-K68 PolarHBondContact O-N 2.81Å; L64-K68 VanDerWaalsContact O-N 3.08Å; V65-K68 PolarHBondContact O-N 3.36Å; A66-K68 PolarHBondContact O-N 3.47Å; K68-H72 PolarHBondContact O-CD2 3.34Å; K68-H72 PolarHBondContact O-N 3.32Å; K68-Y98 HydrophobicContact CG-CD1 4.07Å; K68-Y98 HydrophobicContact CG-CD2 4.45Å; K68-Y98 HydrophobicContact CG-CE1 3.68Å; K68-Y98 HydrophobicContact CG-CE2 4.06Å; K68-Y98 HydrophobicContact CG-CG 4.44Å
69	I	86.2	Confident	84.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.7	-46.4	176.6	-62.6	159.3	0	0	0	110.1	V33 I40 A41 I44 I47 V65 A66 S67 F71 H72 L73	V33-I69 HydrophobicContact CG1-CG1 3.86Å; I40-I69 HydrophobicContact CB-CD1 4.21Å; I40-I69 HydrophobicContact CG2-CD1 3.44Å; I40-I69 VanDerWaalsContact CG2-CD1 3.44Å; I40-I69 HydrophobicContact CG2-CG1 4.26Å; A41-I69 HydrophobicContact CB-CG2 3.94Å; I44-I69 HydrophobicContact CD1-CB 4.08Å; I44-I69 HydrophobicContact CD1-CG2 3.66Å; I44-I69 HydrophobicContact CG1-CG2 4.44Å; I47-I69 HydrophobicContact CD1-CD1 3.78Å; V65-I69 HydrophobicContact CG1-CD1 3.89Å; V65-I69 WeakPolarHBondContact O-CD1 3.46Å; V65-I69 VanDerWaalsContact O-CG1 3.25Å; V65-I69 WeakPolarHBondContact O-CG1 3.41Å; V65-I69 PolarHBondContact O-N 2.86Å; V65-I69 VanDerWaalsContact O-N 3.1Å; A66-I69 PolarHBondContact O-N 3.44Å; A66-I69 VanDerWaalsContact O-N 3.15Å; S67-I69 VanDerWaalsContact C-N 3.31Å; S67-I69 PolarHBondContact O-N 3.36Å; I69-F71 PolarHBondContact O-N 2.91Å; I69-H72 PolarHBondContact O-N 3.49Å; I69-L73 HydrophobicContact CG2-CD1 3.97Å; I69-L73 HydrophobicContact CG2-CG 4.28Å; I69-L73 WeakPolarHBondContact O-CG 3.27Å; I69-L73 PolarHBondContact O-N 3.31Å
70	Y	86.4	Confident	84.8	Confident	33 Å²	33	31.8 Å²	31.8	13%	0.129	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-35.1	177.9	-86.2	-62	0	0	0	113	I44 E48 A66 S67 L73 T74 A75 D78 F82	I44-Y70 HydrophobicContact CD1-CD1 4.13Å; I44-Y70 HydrophobicContact CD1-CD2 3.66Å; I44-Y70 HydrophobicContact CD1-CE1 3.88Å; I44-Y70 HydrophobicContact CD1-CE2 3.32Å; I44-Y70 HydrophobicContact CD1-CG 4.05Å; I44-Y70 VanDerWaalsContact CD1-CZ 3.48Å; I44-Y70 HydrophobicContact CG1-CE2 3.99Å; E48-Y70 WeakPolarHBondContact OE1-CE2 3.16Å; E48-Y70 VanDerWaalsContact OE1-CZ 3.29Å; E48-Y70 PolarHBondContact OE1-OH 3.38Å; A66-Y70 VanDerWaalsContact O-CD2 3.26Å; A66-Y70 WeakPolarHBondContact O-CD2 3.25Å; A66-Y70 PolarHBondContact O-N 3.13Å; S67-Y70 PolarHBondContact O-N 3.29Å; Y70-L73 HydrophobicContact CD1-CD1 4.33Å; Y70-L73 CarbonylContact O-C 3.42Å; Y70-L73 PolarHBondContact O-N 3.45Å; Y70-T74 PolarHBondContact O-N 2.92Å; Y70-T74 VanDerWaalsContact O-N 3.17Å; Y70-A75 HydrophobicContact CD1-CB 3.9Å; Y70-A75 PolarHBondContact O-N 2.8Å; Y70-D78 HydrophobicContact CD1-CB 3.56Å; Y70-D78 HydrophobicContact CD2-CB 4.03Å; Y70-D78 HydrophobicContact CE1-CB 3.79Å; Y70-D78 HydrophobicContact CE2-CB 4.26Å; Y70-D78 HydrophobicContact CG-CB 3.68Å; Y70-F82 AromaticContact CD2-CD2 3.38Å; Y70-F82 HydrophobicContact CD2-CD2 3.38Å; Y70-F82 AromaticContact CD2-CE2 3.56Å; Y70-F82 HydrophobicContact CD2-CE2 3.56Å; Y70-F82 HydrophobicContact CD2-CG 4.44Å; Y70-F82 AromaticContact CE2-CD2 3.51Å; Y70-F82 HydrophobicContact CE2-CD2 3.51Å; Y70-F82 AromaticContact CE2-CE2 3.11Å; Y70-F82 HydrophobicContact CE2-CE2 3.11Å; Y70-F82 AromaticContact CE2-CZ 3.98Å; Y70-F82 HydrophobicContact CE2-CZ 3.98Å; Y70-F82 HydrophobicContact CG-CD2 4.48Å
71	F	87.2	Confident	84.8	Confident	26 Å²	26	30.4 Å²	30.4	11%	0.114	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-47.9	170.3	167.5	-102.9	0	0	0	112.5	S67 I69 L73 T74 Y76 A79 E97 Y98 T101	S67-F71 PolarHBondContact O-N 3.15Å; I69-F71 PolarHBondContact O-N 2.91Å; F71-L73 VanDerWaalsContact C-N 3.27Å; F71-L73 PolarHBondContact O-N 3.44Å; F71-T74 WeakPolarHBondContact O-CA 3.39Å; F71-T74 PolarHBondContact O-N 3.17Å; F71-Y76 HydrophobicContact CD2-CD1 4.29Å; F71-Y76 HydrophobicContact CD2-CE1 4.03Å; F71-Y76 HydrophobicContact CE2-CE1 4.24Å; F71-A79 HydrophobicContact CB-CB 4.31Å; F71-E97 HydrophobicContact CZ-CB 4.29Å; F71-Y98 HydrophobicContact CB-CD2 3.45Å; F71-Y98 VanDerWaalsContact CB-CD2 3.45Å; F71-Y98 HydrophobicContact CB-CE2 3.88Å; F71-Y98 AromaticContact CD1-CD2 3.86Å; F71-Y98 HydrophobicContact CD1-CD2 3.86Å; F71-Y98 HydrophobicContact CD1-CG 4.27Å; F71-Y98 HydrophobicContact CD2-CD2 4.02Å; F71-Y98 AromaticContact CG-CD2 3.49Å; F71-Y98 HydrophobicContact CG-CD2 3.49Å; F71-Y98 VanDerWaalsContact CG-CD2 3.49Å; F71-Y98 HydrophobicContact CG-CE2 4.4Å; F71-Y98 HydrophobicContact CG-CG 4.29Å; F71-T101 WeakPolarHBondContact CD2-OG1 3.18Å; F71-T101 HydrophobicContact CE2-CG2 4.05Å; F71-T101 WeakPolarHBondContact CE2-OG1 3.46Å
72	H	85.4	Confident	84.9	Confident	51 Å²	51	30.5 Å²	30.5	24%	0.236	16%	0.155	C	C	.	.	H	α-helix	trans	-67.3	-28.4	176.4	-74.6	-67.4	0	0	0	112.8	N34 W37 K68 I69 T74	N34-H72 PolarHBondContact OD1-NE2 2.97Å; W37-H72 HydrophobicContact CB-CB 3.99Å; W37-H72 HydrophobicContact CD2-CB 3.79Å; W37-H72 HydrophobicContact CE3-CB 4.01Å; W37-H72 HydrophobicContact CG-CB 3.78Å; W37-H72 AromaticContact CG-CG 3.86Å; K68-H72 PolarHBondContact O-CD2 3.34Å; K68-H72 PolarHBondContact O-N 3.32Å; I69-H72 PolarHBondContact O-N 3.49Å; H72-T74 PolarHBondContact O-N 3.42Å
73	L	87.2	Confident	85	Confident	68 Å²	68	30.5 Å²	30.5	36%	0.356	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	2	170.9	-66.1	175.4	0	0	0	113.3	W37 A41 I44 I69 Y70 F71 A75	W37-L73 HydrophobicContact CE3-CD2 4.39Å; W37-L73 HydrophobicContact CZ3-CD2 4.02Å; A41-L73 HydrophobicContact CB-CD1 4.34Å; A41-L73 HydrophobicContact CB-CD2 4.17Å; I44-L73 HydrophobicContact CD1-CD1 4.13Å; I69-L73 HydrophobicContact CG2-CD1 3.97Å; I69-L73 HydrophobicContact CG2-CG 4.28Å; I69-L73 WeakPolarHBondContact O-CG 3.27Å; I69-L73 PolarHBondContact O-N 3.31Å; Y70-L73 HydrophobicContact CD1-CD1 4.33Å; Y70-L73 CarbonylContact O-C 3.42Å; Y70-L73 PolarHBondContact O-N 3.45Å; F71-L73 VanDerWaalsContact C-N 3.27Å; F71-L73 PolarHBondContact O-N 3.44Å; L73-A75 PolarHBondContact O-N 3.44Å; L73-A75 VanDerWaalsContact O-N 3.17Å
74	T	86	Confident	84.8	Confident	97 Å²	97	30.8 Å²	30.8	60%	0.595	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	16.1	-178.5	66.1	0	0	0	0	114.8	Y70 F71 H72 Y76	Y70-T74 PolarHBondContact O-N 2.92Å; Y70-T74 VanDerWaalsContact O-N 3.17Å; F71-T74 WeakPolarHBondContact O-CA 3.39Å; F71-T74 PolarHBondContact O-N 3.17Å; H72-T74 PolarHBondContact O-N 3.42Å; T74-Y76 PolarHBondContact O-N 3.2Å
75	A	85.8	Confident	84.6	Confident	28 Å²	28	30.3 Å²	30.3	23%	0.231	16%	0.155	C	C	.	.			trans	-94.1	79	176.2	0	0	0	0	0	109.7	Y70 L73 D77 D78 A79	Y70-A75 HydrophobicContact CD1-CB 3.9Å; Y70-A75 PolarHBondContact O-N 2.8Å; L73-A75 PolarHBondContact O-N 3.44Å; L73-A75 VanDerWaalsContact O-N 3.17Å; A75-D77 VanDerWaalsContact C-N 3.33Å; A75-D77 PolarHBondContact O-N 3.26Å; A75-D78 HydrophobicContact CB-CB 4.42Å; A75-D78 PolarHBondContact O-N 2.77Å; A75-A79 WeakPolarHBondContact O-CB 3.35Å; A75-A79 PolarHBondContact O-N 3.33Å
76	Y	84.5	Confident	84.4	Confident	102 Å²	102	30.3 Å²	30.3	40%	0.4	16%	0.155	S	C	.	.	H	α-helix	trans	-68.2	-27.6	-171	-53.5	-58.9	0	0	0	114.4	F71 T74 A79 L80	F71-Y76 HydrophobicContact CD2-CD1 4.29Å; F71-Y76 HydrophobicContact CD2-CE1 4.03Å; F71-Y76 HydrophobicContact CE2-CE1 4.24Å; T74-Y76 PolarHBondContact O-N 3.2Å; Y76-A79 PolarHBondContact O-N 2.94Å; Y76-L80 WeakPolarHBondContact O-CB 3.36Å; Y76-L80 PolarHBondContact O-N 3.32Å
77	D	82.5	Confident	84.3	Confident	67 Å²	67	33.2 Å²	33.2	36%	0.358	17%	0.169	S	C	.	.	H	α-helix	trans	-69.1	-43.7	177.6	-70.5	-18	0	0	0	111.3	A75 L80 L81 R105 F123	A75-D77 VanDerWaalsContact C-N 3.33Å; A75-D77 PolarHBondContact O-N 3.26Å; D77-L80 PolarHBondContact O-N 3.01Å; D77-L81 WeakPolarHBondContact O-CB 3.09Å; D77-L81 PolarHBondContact O-N 3.11Å; D77-R105 IonicContact OD1-CZ 3.39Å; D77-R105 IonicContact OD1-NE 3.65Å; D77-R105 PolarHBondContact OD1-NE 3.44Å; D77-R105 IonicContact OD1-NH2 3.21Å; D77-R105 PolarHBondContact OD1-NH2 3.48Å; D77-R105 IonicContact OD2-NH2 3.95Å; D77-R105 PolarHBondContact OD2-NH2 2.82Å; D77-F123 HydrophobicContact CB-CE1 4.45Å
78	D	83.8	Confident	83.8	Confident	68 Å²	68	40.3 Å²	40.3	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-68.6	-40	174	-59.6	-40.2	0	0	0	110.4	Y70 A75 L80 L81 F82	Y70-D78 HydrophobicContact CD1-CB 3.56Å; Y70-D78 HydrophobicContact CD2-CB 4.03Å; Y70-D78 HydrophobicContact CE1-CB 3.79Å; Y70-D78 HydrophobicContact CE2-CB 4.26Å; Y70-D78 HydrophobicContact CG-CB 3.68Å; A75-D78 HydrophobicContact CB-CB 4.42Å; A75-D78 PolarHBondContact O-N 2.77Å; D78-L80 VanDerWaalsContact C-N 3.31Å; D78-L80 PolarHBondContact O-N 2.88Å; D78-L81 WeakPolarHBondContact O-CB 3.4Å; D78-L81 PolarHBondContact O-N 3.37Å; D78-L81 VanDerWaalsContact O-N 3.15Å; D78-F82 WeakPolarHBondContact O-CD2 3.1Å; D78-F82 PolarHBondContact O-N 3.08Å
79	A	85.5	Confident	83.3	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-47.2	173.8	0	0	0	0	0	111.2	S67 F71 A75 Y76 F82 A83 V102	S67-A79 WeakPolarHBondContact CB-O 3.4Å; S67-A79 PolarHBondContact OG-O 3.11Å; F71-A79 HydrophobicContact CB-CB 4.31Å; A75-A79 WeakPolarHBondContact O-CB 3.35Å; A75-A79 PolarHBondContact O-N 3.33Å; Y76-A79 PolarHBondContact O-N 2.94Å; A79-F82 PolarHBondContact O-N 3.04Å; A79-A83 VanDerWaalsContact O-CB 3.3Å; A79-A83 WeakPolarHBondContact O-CB 3.24Å; A79-A83 PolarHBondContact O-N 2.74Å; A79-V102 HydrophobicContact CB-CG2 4.33Å
80	L	84	Confident	83	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-44.7	175.9	177.2	60	0	0	0	111.8	Y76 D77 D78 F82 A83 I84 V102 R105 A106 T109 F123 L136	Y76-L80 WeakPolarHBondContact O-CB 3.36Å; Y76-L80 PolarHBondContact O-N 3.32Å; D77-L80 PolarHBondContact O-N 3.01Å; D78-L80 VanDerWaalsContact C-N 3.31Å; D78-L80 PolarHBondContact O-N 2.88Å; L80-F82 VanDerWaalsContact C-N 3.34Å; L80-F82 PolarHBondContact O-N 2.77Å; L80-A83 PolarHBondContact O-N 2.97Å; L80-I84 HydrophobicContact CD1-CD1 3.9Å; L80-I84 HydrophobicContact CD1-CG1 4.01Å; L80-I84 HydrophobicContact CG-CD1 3.84Å; L80-I84 HydrophobicContact CG-CG1 4.4Å; L80-I84 WeakPolarHBondContact O-CG1 3.42Å; L80-I84 PolarHBondContact O-N 3.33Å; L80-V102 HydrophobicContact CD1-CG1 4.15Å; L80-R105 HydrophobicContact CD2-CG 4.18Å; L80-A106 HydrophobicContact CD1-CB 3.59Å; L80-T109 HydrophobicContact CD2-CG2 4.3Å; L80-T109 WeakPolarHBondContact CD2-OG1 3.41Å; L80-F123 HydrophobicContact CD2-CZ 4.28Å; L80-L136 HydrophobicContact CD1-CD2 4.3Å
81	L	83.3	Confident	82.5	Confident	35 Å²	35	44.6 Å²	44.6	18%	0.183	23%	0.228	C	C	.	.	H	α-helix	trans	-54.3	-49.5	178.2	-179.3	66.7	0	0	0	111.9	D77 D78 G85 F123 M129	D77-L81 WeakPolarHBondContact O-CB 3.09Å; D77-L81 PolarHBondContact O-N 3.11Å; D78-L81 WeakPolarHBondContact O-CB 3.4Å; D78-L81 PolarHBondContact O-N 3.37Å; D78-L81 VanDerWaalsContact O-N 3.15Å; L81-G85 PolarHBondContact O-N 2.93Å; L81-G85 VanDerWaalsContact O-N 3.17Å; L81-F123 HydrophobicContact CD1-CB 3.97Å; L81-F123 HydrophobicContact CD1-CD2 3.83Å; L81-F123 HydrophobicContact CD1-CG 4.09Å; L81-M129 HydrophobicContact CD1-CE 3.67Å
82	F	83	Confident	81.9	Confident	15 Å²	15	44.3 Å²	44.3	7%	0.066	23%	0.228	C	C	.	.	H	α-helix	trans	-74.8	-30	179.5	-71.9	-71.9	0	0	0	112.8	E48 F51 A63 A66 Y70 D78 A79 L80 G85 A86	E48-F82 HydrophobicContact CG-CE1 4.15Å; E48-F82 HydrophobicContact CG-CZ 3.73Å; F51-F82 HydrophobicContact CD1-CD1 4.06Å; F51-F82 AromaticContact CD1-CE1 3.79Å; F51-F82 HydrophobicContact CD1-CE1 3.79Å; F51-F82 HydrophobicContact CE1-CD1 4.29Å; F51-F82 HydrophobicContact CE1-CE1 4.24Å; F51-F82 HydrophobicContact CG-CE1 4.47Å; A63-F82 WeakPolarHBondContact CB-O 3.4Å; A63-F82 WeakPolarHBondContact O-CB 3.34Å; A66-F82 HydrophobicContact CB-CB 4.22Å; A66-F82 HydrophobicContact CB-CD1 3.83Å; A66-F82 HydrophobicContact CB-CD2 4.24Å; A66-F82 HydrophobicContact CB-CE1 4.26Å; A66-F82 HydrophobicContact CB-CG 3.83Å; Y70-F82 AromaticContact CD2-CD2 3.38Å; Y70-F82 HydrophobicContact CD2-CD2 3.38Å; Y70-F82 AromaticContact CD2-CE2 3.56Å; Y70-F82 HydrophobicContact CD2-CE2 3.56Å; Y70-F82 HydrophobicContact CD2-CG 4.44Å; Y70-F82 AromaticContact CE2-CD2 3.51Å; Y70-F82 HydrophobicContact CE2-CD2 3.51Å; Y70-F82 AromaticContact CE2-CE2 3.11Å; Y70-F82 HydrophobicContact CE2-CE2 3.11Å; Y70-F82 AromaticContact CE2-CZ 3.98Å; Y70-F82 HydrophobicContact CE2-CZ 3.98Å; Y70-F82 HydrophobicContact CG-CD2 4.48Å; D78-F82 WeakPolarHBondContact O-CD2 3.1Å; D78-F82 PolarHBondContact O-N 3.08Å; A79-F82 PolarHBondContact O-N 3.04Å; L80-F82 VanDerWaalsContact C-N 3.34Å; L80-F82 PolarHBondContact O-N 2.77Å; F82-G85 CarbonylContact O-C 3.45Å; F82-G85 WeakPolarHBondContact O-CA 3.15Å; F82-G85 PolarHBondContact O-N 3.36Å; F82-G85 VanDerWaalsContact O-N 3.16Å; F82-A86 PolarHBondContact O-N 3.09Å
83	A	83.5	Confident	81.1	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-42.7	173.4	0	0	0	0	0	111.4	S67 A79 L80 G85 A86 F90 V102	S67-A83 WeakPolarHBondContact OG-CB 3.31Å; S67-A83 PolarHBondContact OG-N 2.91Å; A79-A83 VanDerWaalsContact O-CB 3.3Å; A79-A83 WeakPolarHBondContact O-CB 3.24Å; A79-A83 PolarHBondContact O-N 2.74Å; L80-A83 PolarHBondContact O-N 2.97Å; A83-G85 PolarHBondContact O-N 3.22Å; A83-A86 WeakPolarHBondContact O-CB 3.42Å; A83-A86 PolarHBondContact O-N 2.71Å; A83-A86 VanDerWaalsContact O-N 3.13Å; A83-F90 HydrophobicContact CB-CD2 3.94Å; A83-F90 HydrophobicContact CB-CE2 4.05Å; A83-F90 HydrophobicContact CB-CG 4.4Å; A83-V102 HydrophobicContact CB-CG1 3.68Å
84	I	80.5	Confident	80.6	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-38.3	172.7	-65.8	164.8	0	0	0	110.3	L80 A86 E87 R132 L133 L136	L80-I84 HydrophobicContact CD1-CD1 3.9Å; L80-I84 HydrophobicContact CD1-CG1 4.01Å; L80-I84 HydrophobicContact CG-CD1 3.84Å; L80-I84 HydrophobicContact CG-CG1 4.4Å; L80-I84 WeakPolarHBondContact O-CG1 3.42Å; L80-I84 PolarHBondContact O-N 3.33Å; I84-A86 VanDerWaalsContact C-N 3.31Å; I84-A86 PolarHBondContact O-N 2.91Å; I84-E87 PolarHBondContact O-N 2.99Å; I84-R132 HydrophobicContact CG2-CB 3.29Å; I84-R132 HydrophobicContact CG2-CG 4.33Å; I84-L133 HydrophobicContact CD1-CB 4.11Å; I84-L133 HydrophobicContact CD1-CD1 4.05Å; I84-L136 HydrophobicContact CG1-CD2 4.16Å
85	G	79.8	Confident	79.9	Confident	2 Å²	2	47.2 Å²	47.2	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-25.2	175.7	0	0	0	0	0	115	L81 F82 A83 E87	L81-G85 PolarHBondContact O-N 2.93Å; L81-G85 VanDerWaalsContact O-N 3.17Å; F82-G85 CarbonylContact O-C 3.45Å; F82-G85 WeakPolarHBondContact O-CA 3.15Å; F82-G85 PolarHBondContact O-N 3.36Å; F82-G85 VanDerWaalsContact O-N 3.16Å; A83-G85 PolarHBondContact O-N 3.22Å; G85-E87 VanDerWaalsContact C-N 3.32Å
86	A	80.8	Confident	79.7	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-77	-18.2	177.8	0	0	0	0	0	113.2	A63 L64 F82 A83 I84 E88 L89 F90	A63-A86 HydrophobicContact CB-CB 4.14Å; L64-A86 HydrophobicContact CB-CB 3.95Å; L64-A86 HydrophobicContact CD1-CB 4.27Å; F82-A86 PolarHBondContact O-N 3.09Å; A83-A86 WeakPolarHBondContact O-CB 3.42Å; A83-A86 PolarHBondContact O-N 2.71Å; A83-A86 VanDerWaalsContact O-N 3.13Å; I84-A86 VanDerWaalsContact C-N 3.31Å; I84-A86 PolarHBondContact O-N 2.91Å; A86-E88 PolarHBondContact O-N 3.45Å; A86-E88 VanDerWaalsContact O-N 3.09Å; A86-L89 PolarHBondContact O-N 3.15Å; A86-F90 HydrophobicContact CB-CB 4.22Å
87	E	81.3	Confident	79.5	Confident	62 Å²	62	50.7 Å²	50.7	29%	0.29	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	48.1	-112.3	177.8	-60.4	174.7	180	0	0	111.8	K60 I84 G85 L89 F90 R132 R139	K60-E87 HydrophobicContact CD-CB 4.31Å; K60-E87 WeakPolarHBondContact CE-OE2 3.44Å; K60-E87 IonicContact NZ-OE2 2.77Å; K60-E87 PolarHBondContact NZ-OE2 2.86Å; I84-E87 PolarHBondContact O-N 2.99Å; G85-E87 VanDerWaalsContact C-N 3.32Å; E87-L89 VanDerWaalsContact C-N 3.3Å; E87-L89 PolarHBondContact O-N 2.92Å; E87-F90 PolarHBondContact O-N 3.3Å; E87-R132 IonicContact OE1-CZ 3.47Å; E87-R132 VanDerWaalsContact OE1-CZ 3.24Å; E87-R132 IonicContact OE1-NE 3.62Å; E87-R132 PolarHBondContact OE1-NE 2.78Å; E87-R132 VanDerWaalsContact OE1-NE 3.08Å; E87-R132 IonicContact OE1-NH2 3.5Å; E87-R132 PolarHBondContact OE1-NH2 2.82Å; E87-R139 PolarHBondContact O-NH1 3.37Å
88	E	76.4	Confident	79.6	Confident	148 Å²	148	48.3 Å²	48.3	69%	0.692	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-67.8	-23.7	-176.5	-63.1	161.4	152.5	0	0	113.9	K60 A86 F90	K60-E88 IonicContact NZ-OE2 3.13Å; K60-E88 PolarHBondContact NZ-OE2 3.04Å; A86-E88 PolarHBondContact O-N 3.45Å; A86-E88 VanDerWaalsContact O-N 3.09Å; E88-F90 VanDerWaalsContact C-N 3.28Å
89	L	76.1	Confident	79.6	Confident	73 Å²	73	45.3 Å²	45.3	38%	0.382	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-77.2	-17.8	178	-69.4	-179.8	0	0	0	112.7	K60 L61 L64 A86 E87 D91	K60-L89 VanDerWaalsContact C-CD1 3.49Å; K60-L89 HydrophobicContact CB-CD1 3.51Å; K60-L89 HydrophobicContact CB-CG 4.11Å; L61-L89 HydrophobicContact CB-CD1 3.87Å; L61-L89 HydrophobicContact CD1-CD1 4.33Å; L61-L89 VanDerWaalsContact N-CD1 3.33Å; L64-L89 HydrophobicContact CD2-CB 4.3Å; A86-L89 PolarHBondContact O-N 3.15Å; E87-L89 VanDerWaalsContact C-N 3.3Å; E87-L89 PolarHBondContact O-N 2.92Å; L89-D91 PolarHBondContact O-N 3.32Å
90	F	79.4	Confident	79.4	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.009	26%	0.26	C	S	.	.	S	Bend	trans	-77.4	105.3	168.6	-175.5	-101.2	0	0	0	108.7	L64 A83 A86 E87 E88 V92 Y98 V99 V102 V103 L136 R139	L64-F90 HydrophobicContact CD1-CB 4.5Å; L64-F90 HydrophobicContact CD1-CD2 4.23Å; A83-F90 HydrophobicContact CB-CD2 3.94Å; A83-F90 HydrophobicContact CB-CE2 4.05Å; A83-F90 HydrophobicContact CB-CG 4.4Å; A86-F90 HydrophobicContact CB-CB 4.22Å; E87-F90 PolarHBondContact O-N 3.3Å; E88-F90 VanDerWaalsContact C-N 3.28Å; F90-V92 HydrophobicContact CD1-CG2 3.84Å; F90-V92 HydrophobicContact CE1-CG2 3.96Å; F90-V92 PolarHBondContact O-N 3.19Å; F90-Y98 HydrophobicContact CD2-CE1 4.2Å; F90-Y98 AromaticContact CE2-CE1 3.71Å; F90-Y98 HydrophobicContact CE2-CE1 3.71Å; F90-Y98 AromaticContact CE2-CZ 3.81Å; F90-V99 HydrophobicContact CE2-CG2 4.26Å; F90-V99 HydrophobicContact CZ-CB 4.47Å; F90-V99 HydrophobicContact CZ-CG1 4.14Å; F90-V99 HydrophobicContact CZ-CG2 4.24Å; F90-V102 HydrophobicContact CE2-CB 4.4Å; F90-V102 HydrophobicContact CE2-CG1 4.06Å; F90-V102 HydrophobicContact CZ-CB 4.13Å; F90-V102 HydrophobicContact CZ-CG1 3.78Å; F90-V103 HydrophobicContact CE1-CG2 4.38Å; F90-V103 HydrophobicContact CZ-CG2 4.49Å; F90-L136 HydrophobicContact CD1-CD1 3.77Å; F90-L136 HydrophobicContact CE1-CD1 3.99Å; F90-R139 PolarHBondContact O-NH2 3.46Å
91	D	77.4	Confident	79.4	Confident	85 Å²	85	52 Å²	52	46%	0.455	28%	0.276	S	S	.	.			trans	-80.4	110.7	174.7	-173.7	3.2	0	0	0	109.8	L89 D93 A94 V99	L89-D91 PolarHBondContact O-N 3.32Å; D91-D93 VanDerWaalsContact C-N 3.31Å; D91-D93 PolarHBondContact OD1-N 3.25Å; D91-A94 HydrophobicContact CB-CB 4.23Å; D91-V99 WeakPolarHBondContact O-CG2 3.32Å
92	V	72.9	Confident	79.4	Confident	20 Å²	20	50.5 Å²	50.5	12%	0.121	27%	0.268	C	S	.	.	S	Bend	trans	-75.9	-24.6	-179.6	-177.7	0	0	0	0	111	F90 V99 V103 L136 I140	F90-V92 HydrophobicContact CD1-CG2 3.84Å; F90-V92 HydrophobicContact CE1-CG2 3.96Å; F90-V92 PolarHBondContact O-N 3.19Å; V92-V99 WeakPolarHBondContact O-CG1 3.42Å; V92-V103 HydrophobicContact CG1-CG2 4.29Å; V92-L136 HydrophobicContact CG2-CD1 3.87Å; V92-I140 HydrophobicContact CG1-CB 4.38Å; V92-I140 HydrophobicContact CG1-CG1 3.53Å
93	D	70.3	Confident	79.5	Confident	90 Å²	90	50.8 Å²	50.8	48%	0.481	27%	0.271	S	S	.	.	S	Bend	trans	-87.6	-8.3	-175.2	-69.7	-53.4	0	0	0	113.1	D91 N95 R147	D91-D93 VanDerWaalsContact C-N 3.31Å; D91-D93 PolarHBondContact OD1-N 3.25Å; D93-N95 PolarHBondContact O-N 3.07Å; D93-R147 IonicContact OD1-CZ 3.62Å; D93-R147 IonicContact OD1-NE 2.75Å; D93-R147 IonicContact OD1-NH2 3.94Å; D93-R147 PolarHBondContact OD1-NH2 2.64Å
94	A	75	Confident	79.5	Confident	35 Å²	35	53.1 Å²	53.1	29%	0.289	29%	0.29	S	S	.	.			trans	-69.1	118.7	179.1	0	0	0	0	0	111.6	D91 S96 V99	D91-A94 HydrophobicContact CB-CB 4.23Å; A94-S96 VanDerWaalsContact C-N 3.29Å; A94-S96 PolarHBondContact O-N 3.24Å; A94-V99 HydrophobicContact CB-CG2 4.19Å; A94-V99 WeakPolarHBondContact O-CB 3.35Å
95	N	72.4	Confident	79.6	Confident	152 Å²	152	56.5 Å²	56.5	81%	0.813	30%	0.302	S	S	*	.			trans	-77	75.5	179.6	-165.5	22.6	0	0	0	111.8	D93	D93-N95 PolarHBondContact O-N 3.07Å
96	S	80.9	Confident	79.9	Confident	44 Å²	44	56.4 Å²	56.4	31%	0.308	30%	0.301	S	S	.	.			trans	-129.6	150.6	177.8	67.8	0	0	0	0	111.2	A94 Y98 V99 N100	A94-S96 VanDerWaalsContact C-N 3.29Å; A94-S96 PolarHBondContact O-N 3.24Å; S96-Y98 PolarHBondContact O-N 2.88Å; S96-V99 PolarHBondContact O-N 3.43Å; S96-V99 VanDerWaalsContact O-N 3.12Å; S96-V99 VanDerWaalsContact OG-CG2 3.3Å; S96-V99 WeakPolarHBondContact OG-CG2 3.4Å; S96-V99 PolarHBondContact OG-N 2.87Å; S96-N100 PolarHBondContact O-N 3.13Å
97	E	80.8	Confident	80	Confident	159 Å²	159	57.4 Å²	57.4	74%	0.743	31%	0.306	S	S	*	.	H	α-helix	trans	-56.6	-36.9	176.6	-67.6	-176.9	167.2	0	0	112.2	F71 T101	F71-E97 HydrophobicContact CZ-CB 4.29Å; E97-T101 WeakPolarHBondContact O-CB 3.23Å; E97-T101 VanDerWaalsContact O-CG2 3.31Å; E97-T101 WeakPolarHBondContact O-CG2 3.1Å; E97-T101 PolarHBondContact O-N 3.45Å; E97-T101 PolarHBondContact O-OG1 3.21Å
98	Y	84.4	Confident	80.1	Confident	17 Å²	17	58.2 Å²	58.2	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-52	173.6	163.2	-112.6	0	0	0	112.4	S67 K68 F71 F90 S96 T101 V102	S67-Y98 VanDerWaalsContact CB-OH 3.24Å; S67-Y98 WeakPolarHBondContact CB-OH 3.49Å; S67-Y98 PolarHBondContact OG-OH 3.31Å; K68-Y98 HydrophobicContact CG-CD1 4.07Å; K68-Y98 HydrophobicContact CG-CD2 4.45Å; K68-Y98 HydrophobicContact CG-CE1 3.68Å; K68-Y98 HydrophobicContact CG-CE2 4.06Å; K68-Y98 HydrophobicContact CG-CG 4.44Å; F71-Y98 HydrophobicContact CB-CD2 3.45Å; F71-Y98 VanDerWaalsContact CB-CD2 3.45Å; F71-Y98 HydrophobicContact CB-CE2 3.88Å; F71-Y98 AromaticContact CD1-CD2 3.86Å; F71-Y98 HydrophobicContact CD1-CD2 3.86Å; F71-Y98 HydrophobicContact CD1-CG 4.27Å; F71-Y98 HydrophobicContact CD2-CD2 4.02Å; F71-Y98 AromaticContact CG-CD2 3.49Å; F71-Y98 HydrophobicContact CG-CD2 3.49Å; F71-Y98 VanDerWaalsContact CG-CD2 3.49Å; F71-Y98 HydrophobicContact CG-CE2 4.4Å; F71-Y98 HydrophobicContact CG-CG 4.29Å; F90-Y98 HydrophobicContact CD2-CE1 4.2Å; F90-Y98 AromaticContact CE2-CE1 3.71Å; F90-Y98 HydrophobicContact CE2-CE1 3.71Å; F90-Y98 AromaticContact CE2-CZ 3.81Å; S96-Y98 PolarHBondContact O-N 2.88Å; Y98-T101 PolarHBondContact O-OG1 3.45Å; Y98-V102 HydrophobicContact CD2-CG2 3.86Å; Y98-V102 HydrophobicContact CE2-CG2 3.61Å; Y98-V102 WeakPolarHBondContact O-CB 3.34Å; Y98-V102 VanDerWaalsContact O-CG2 3.26Å; Y98-V102 WeakPolarHBondContact O-CG2 3.29Å; Y98-V102 PolarHBondContact O-N 3.04Å
99	V	83	Confident	80.3	Confident	6 Å²	6	51.2 Å²	51.2	4%	0.036	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-44.6	-178.5	173	0	0	0	0	110.5	F90 D91 V92 A94 S96 T101 V102 V103	F90-V99 HydrophobicContact CE2-CG2 4.26Å; F90-V99 HydrophobicContact CZ-CB 4.47Å; F90-V99 HydrophobicContact CZ-CG1 4.14Å; F90-V99 HydrophobicContact CZ-CG2 4.24Å; D91-V99 WeakPolarHBondContact O-CG2 3.32Å; V92-V99 WeakPolarHBondContact O-CG1 3.42Å; A94-V99 HydrophobicContact CB-CG2 4.19Å; A94-V99 WeakPolarHBondContact O-CB 3.35Å; S96-V99 PolarHBondContact O-N 3.43Å; S96-V99 VanDerWaalsContact O-N 3.12Å; S96-V99 VanDerWaalsContact OG-CG2 3.3Å; S96-V99 WeakPolarHBondContact OG-CG2 3.4Å; S96-V99 PolarHBondContact OG-N 2.87Å; V99-T101 PolarHBondContact O-N 3.06Å; V99-V102 PolarHBondContact O-N 3.45Å; V99-V103 HydrophobicContact CG1-CG2 3.99Å; V99-V103 VanDerWaalsContact O-CB 3.29Å; V99-V103 WeakPolarHBondContact O-CB 3.23Å; V99-V103 WeakPolarHBondContact O-CG2 3.45Å; V99-V103 PolarHBondContact O-N 3.23Å
100	N	82.7	Confident	80.6	Confident	88 Å²	88	48.2 Å²	48.2	47%	0.471	26%	0.264	S	S	.	.	H	α-helix	trans	-60.4	-43.1	-179.7	-70.5	-19.6	0	0	0	112.4	S96 A104	S96-N100 PolarHBondContact O-N 3.13Å; N100-A104 WeakPolarHBondContact O-CB 3.43Å; N100-A104 PolarHBondContact O-N 3.39Å
101	T	82.8	Confident	80.7	Confident	53 Å²	53	48.7 Å²	48.7	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-69.8	-41.4	178.1	49.3	0	0	0	0	112.7	F71 E97 Y98 V99 A104 R105	F71-T101 WeakPolarHBondContact CD2-OG1 3.18Å; F71-T101 HydrophobicContact CE2-CG2 4.05Å; F71-T101 WeakPolarHBondContact CE2-OG1 3.46Å; E97-T101 WeakPolarHBondContact O-CB 3.23Å; E97-T101 VanDerWaalsContact O-CG2 3.31Å; E97-T101 WeakPolarHBondContact O-CG2 3.1Å; E97-T101 PolarHBondContact O-N 3.45Å; E97-T101 PolarHBondContact O-OG1 3.21Å; Y98-T101 PolarHBondContact O-OG1 3.45Å; V99-T101 PolarHBondContact O-N 3.06Å; T101-A104 PolarHBondContact O-N 3.46Å; T101-R105 VanDerWaalsContact O-CB 3.32Å; T101-R105 WeakPolarHBondContact O-CB 3.45Å; T101-R105 PolarHBondContact O-N 3.43Å
102	V	84.5	Confident	80.7	Confident	2 Å²	2	48 Å²	48	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-66.5	-40	176.4	172.8	0	0	0	0	111.2	A79 L80 A83 F90 Y98 V99 R105 A106	A79-V102 HydrophobicContact CB-CG2 4.33Å; L80-V102 HydrophobicContact CD1-CG1 4.15Å; A83-V102 HydrophobicContact CB-CG1 3.68Å; F90-V102 HydrophobicContact CE2-CB 4.4Å; F90-V102 HydrophobicContact CE2-CG1 4.06Å; F90-V102 HydrophobicContact CZ-CB 4.13Å; F90-V102 HydrophobicContact CZ-CG1 3.78Å; Y98-V102 HydrophobicContact CD2-CG2 3.86Å; Y98-V102 HydrophobicContact CE2-CG2 3.61Å; Y98-V102 WeakPolarHBondContact O-CB 3.34Å; Y98-V102 VanDerWaalsContact O-CG2 3.26Å; Y98-V102 WeakPolarHBondContact O-CG2 3.29Å; Y98-V102 PolarHBondContact O-N 3.04Å; V99-V102 PolarHBondContact O-N 3.45Å; V102-R105 PolarHBondContact O-N 2.92Å; V102-A106 VanDerWaalsContact O-CB 3.32Å; V102-A106 WeakPolarHBondContact O-CB 3.47Å; V102-A106 PolarHBondContact O-N 2.87Å
103	V	84.8	Confident	80.9	Confident	22 Å²	22	49.8 Å²	49.8	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-47	175.9	168.1	0	0	0	0	111	F90 V92 V99 R105 A106 I107 I140	F90-V103 HydrophobicContact CE1-CG2 4.38Å; F90-V103 HydrophobicContact CZ-CG2 4.49Å; V92-V103 HydrophobicContact CG1-CG2 4.29Å; V99-V103 HydrophobicContact CG1-CG2 3.99Å; V99-V103 VanDerWaalsContact O-CB 3.29Å; V99-V103 WeakPolarHBondContact O-CB 3.23Å; V99-V103 WeakPolarHBondContact O-CG2 3.45Å; V99-V103 PolarHBondContact O-N 3.23Å; V103-R105 VanDerWaalsContact C-N 3.32Å; V103-R105 PolarHBondContact O-N 3.4Å; V103-A106 WeakPolarHBondContact O-CB 3.25Å; V103-A106 PolarHBondContact O-N 3.49Å; V103-A106 VanDerWaalsContact O-N 3.16Å; V103-I107 HydrophobicContact CG1-CD1 4.01Å; V103-I107 WeakPolarHBondContact O-CG1 3.37Å; V103-I107 PolarHBondContact O-N 3.34Å; V103-I140 HydrophobicContact CG1-CD1 3.87Å; V103-I140 HydrophobicContact CG1-CG1 4.25Å; V103-I140 HydrophobicContact CG1-CG2 4.37Å; V103-I140 HydrophobicContact CG2-CD1 4.26Å; V103-I140 HydrophobicContact CG2-CG1 4.46Å
104	A	82.7	Confident	81.2	Confident	50 Å²	50	50.2 Å²	50.2	41%	0.413	27%	0.272	S	S	.	.	H	α-helix	trans	-57.7	-46.6	174.9	0	0	0	0	0	111	N100 T101 A106 I107 D108	N100-A104 WeakPolarHBondContact O-CB 3.43Å; N100-A104 PolarHBondContact O-N 3.39Å; T101-A104 PolarHBondContact O-N 3.46Å; A104-A106 VanDerWaalsContact C-N 3.32Å; A104-A106 PolarHBondContact O-N 2.96Å; A104-I107 PolarHBondContact O-N 3.02Å; A104-D108 PolarHBondContact O-N 3.5Å
105	R	83.6	Confident	81	Confident	76 Å²	76	53.5 Å²	53.5	29%	0.287	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-36.6	176.5	-169.3	65.9	-175.6	142.6	-3.3	112.6	D77 L80 T101 V102 V103 T109	D77-R105 IonicContact OD1-CZ 3.39Å; D77-R105 IonicContact OD1-NE 3.65Å; D77-R105 PolarHBondContact OD1-NE 3.44Å; D77-R105 IonicContact OD1-NH2 3.21Å; D77-R105 PolarHBondContact OD1-NH2 3.48Å; D77-R105 IonicContact OD2-NH2 3.95Å; D77-R105 PolarHBondContact OD2-NH2 2.82Å; L80-R105 HydrophobicContact CD2-CG 4.18Å; T101-R105 VanDerWaalsContact O-CB 3.32Å; T101-R105 WeakPolarHBondContact O-CB 3.45Å; T101-R105 PolarHBondContact O-N 3.43Å; V102-R105 PolarHBondContact O-N 2.92Å; V103-R105 VanDerWaalsContact C-N 3.32Å; V103-R105 PolarHBondContact O-N 3.4Å; R105-T109 VanDerWaalsContact O-CB 3.3Å; R105-T109 WeakPolarHBondContact O-CB 3.3Å; R105-T109 PolarHBondContact O-N 3.28Å; R105-T109 PolarHBondContact O-OG1 3.49Å
106	A	84.9	Confident	80.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-45.5	175.6	0	0	0	0	0	111.4	L80 V102 V103 A104 T109 Y110 L133 L136 I137	L80-A106 HydrophobicContact CD1-CB 3.59Å; V102-A106 VanDerWaalsContact O-CB 3.32Å; V102-A106 WeakPolarHBondContact O-CB 3.47Å; V102-A106 PolarHBondContact O-N 2.87Å; V103-A106 WeakPolarHBondContact O-CB 3.25Å; V103-A106 PolarHBondContact O-N 3.49Å; V103-A106 VanDerWaalsContact O-N 3.16Å; A104-A106 VanDerWaalsContact C-N 3.32Å; A104-A106 PolarHBondContact O-N 2.96Å; A106-T109 PolarHBondContact O-N 3.09Å; A106-Y110 WeakPolarHBondContact O-CB 3.47Å; A106-Y110 PolarHBondContact O-N 2.91Å; A106-L133 HydrophobicContact CB-CD1 4.04Å; A106-L136 HydrophobicContact CB-CD2 4.03Å; A106-I137 HydrophobicContact CB-CD1 4.33Å
107	I	83.2	Confident	79.5	Confident	21 Å²	21	56.2 Å²	56.2	11%	0.108	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-48.5	176.9	-67	166.4	0	0	0	110	V103 A104 T109 Y110 A111 I137 V156 T160	V103-I107 HydrophobicContact CG1-CD1 4.01Å; V103-I107 WeakPolarHBondContact O-CG1 3.37Å; V103-I107 PolarHBondContact O-N 3.34Å; A104-I107 PolarHBondContact O-N 3.02Å; I107-T109 PolarHBondContact O-N 2.76Å; I107-Y110 PolarHBondContact O-N 2.98Å; I107-A111 VanDerWaalsContact O-CB 3.28Å; I107-A111 WeakPolarHBondContact O-CB 3.36Å; I107-A111 PolarHBondContact O-N 3.04Å; I107-I137 HydrophobicContact CG1-CD1 4.01Å; I107-V156 HydrophobicContact CD1-CG1 4.06Å; I107-V156 HydrophobicContact CD1-CG2 4.22Å; I107-V156 HydrophobicContact CG1-CG1 4.18Å; I107-V156 HydrophobicContact CG2-CG1 4Å; I107-T160 HydrophobicContact CG2-CG2 4.19Å
108	D	83.4	Confident	78.4	Confident	79 Å²	79	50.6 Å²	50.6	42%	0.422	29%	0.288	S	S	.	.	H	α-helix	trans	-58.7	-48.6	178.3	-74.9	-23.9	0	0	0	112	A104 Y110 A111 L112	A104-D108 PolarHBondContact O-N 3.5Å; D108-Y110 VanDerWaalsContact C-N 3.32Å; D108-Y110 PolarHBondContact O-N 3.43Å; D108-A111 PolarHBondContact O-N 3.23Å; D108-L112 WeakPolarHBondContact O-CB 3.5Å; D108-L112 VanDerWaalsContact O-CG 3.25Å; D108-L112 WeakPolarHBondContact O-CG 3.38Å; D108-L112 PolarHBondContact O-N 3.21Å
109	T	81.8	Confident	77.1	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-40.9	-179.2	-53.3	0	0	0	0	110.6	L80 R105 A106 I107 L112 S113 V121 F123 L124 L133	L80-T109 HydrophobicContact CD2-CG2 4.3Å; L80-T109 WeakPolarHBondContact CD2-OG1 3.41Å; R105-T109 VanDerWaalsContact O-CB 3.3Å; R105-T109 WeakPolarHBondContact O-CB 3.3Å; R105-T109 PolarHBondContact O-N 3.28Å; R105-T109 PolarHBondContact O-OG1 3.49Å; A106-T109 PolarHBondContact O-N 3.09Å; I107-T109 PolarHBondContact O-N 2.76Å; T109-L112 PolarHBondContact O-N 3.39Å; T109-S113 PolarHBondContact O-N 3.3Å; T109-V121 HydrophobicContact CG2-CG1 4.14Å; T109-V121 HydrophobicContact CG2-CG2 4.23Å; T109-F123 HydrophobicContact CG2-CZ 4.03Å; T109-L124 HydrophobicContact CG2-CD1 3.82Å; T109-L133 HydrophobicContact CG2-CD2 4.44Å
110	Y	82.3	Confident	75.9	Confident	10 Å²	10	62.8 Å²	62.8	4%	0.039	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-45.5	176.5	-175.3	-110.3	0	0	0	111.6	A106 I107 D108 L112 S113 R114 L133 Q134 I137 T160 R162	A106-Y110 WeakPolarHBondContact O-CB 3.47Å; A106-Y110 PolarHBondContact O-N 2.91Å; I107-Y110 PolarHBondContact O-N 2.98Å; D108-Y110 VanDerWaalsContact C-N 3.32Å; D108-Y110 PolarHBondContact O-N 3.43Å; Y110-L112 VanDerWaalsContact C-N 3.3Å; Y110-L112 PolarHBondContact O-N 2.85Å; Y110-S113 PolarHBondContact O-N 3.2Å; Y110-S113 VanDerWaalsContact O-N 3.11Å; Y110-S113 PolarHBondContact O-OG 3.27Å; Y110-R114 HydrophobicContact CD1-CG 4.46Å; Y110-R114 HydrophobicContact CE1-CG 4.15Å; Y110-R114 HydrophobicContact CE2-CG 4.38Å; Y110-R114 VanDerWaalsContact O-CG 3.3Å; Y110-R114 WeakPolarHBondContact O-CG 3.46Å; Y110-R114 PolarHBondContact O-N 3.36Å; Y110-R114 VanDerWaalsContact O-N 3.13Å; Y110-R114 PolarHBondContact OH-NH1 3.33Å; Y110-L133 HydrophobicContact CD2-CD2 4.22Å; Y110-L133 HydrophobicContact CD2-CG 4.23Å; Y110-Q134 HydrophobicContact CE2-CB 4.4Å; Y110-I137 HydrophobicContact CD1-CD1 4.43Å; Y110-I137 HydrophobicContact CD1-CG1 4.07Å; Y110-I137 HydrophobicContact CD1-CG2 4.07Å; Y110-I137 HydrophobicContact CD2-CG1 4.34Å; Y110-I137 HydrophobicContact CE1-CG2 4.08Å; Y110-I137 HydrophobicContact CG-CD1 4.37Å; Y110-I137 HydrophobicContact CG-CG1 3.88Å; Y110-T160 HydrophobicContact CD1-CG2 3.63Å; Y110-T160 HydrophobicContact CE1-CG2 4.17Å; Y110-R162 HydrophobicContact CE1-CG 4.47Å
111	A	80	Confident	75	Confident	11 Å²	11	60.1 Å²	60.1	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-41.7	175.7	0	0	0	0	0	111.5	I107 D108 R114 K115 T160	I107-A111 VanDerWaalsContact O-CB 3.28Å; I107-A111 WeakPolarHBondContact O-CB 3.36Å; I107-A111 PolarHBondContact O-N 3.04Å; D108-A111 PolarHBondContact O-N 3.23Å; A111-R114 PolarHBondContact O-N 3.05Å; A111-K115 PolarHBondContact O-N 2.64Å; A111-T160 HydrophobicContact CB-CG2 4.47Å
112	L	77.5	Confident	74	Confident	71 Å²	71	62.4 Å²	62.4	37%	0.372	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-45.3	172.9	-73.7	169.1	0	0	0	112	D108 T109 Y110 R114 K115 A118	D108-L112 WeakPolarHBondContact O-CB 3.5Å; D108-L112 VanDerWaalsContact O-CG 3.25Å; D108-L112 WeakPolarHBondContact O-CG 3.38Å; D108-L112 PolarHBondContact O-N 3.21Å; T109-L112 PolarHBondContact O-N 3.39Å; Y110-L112 VanDerWaalsContact C-N 3.3Å; Y110-L112 PolarHBondContact O-N 2.85Å; L112-R114 PolarHBondContact O-N 3.16Å; L112-R114 VanDerWaalsContact O-N 3.14Å; L112-K115 HydrophobicContact CD2-CD 4.27Å; L112-K115 WeakPolarHBondContact O-CB 3.29Å; L112-K115 PolarHBondContact O-N 2.8Å; L112-A118 VanDerWaalsContact O-CB 3.27Å; L112-A118 WeakPolarHBondContact O-CB 3.48Å
113	S	77.8	Confident	73.2	Confident	58 Å²	58	64.3 Å²	64.3	41%	0.406	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-23.3	178.4	79.5	0	0	0	0	113.6	T109 Y110	T109-S113 PolarHBondContact O-N 3.3Å; Y110-S113 PolarHBondContact O-N 3.2Å; Y110-S113 VanDerWaalsContact O-N 3.11Å; Y110-S113 PolarHBondContact O-OG 3.27Å
114	R	76.4	Confident	72	Confident	98 Å²	98	64.5 Å²	64.5	37%	0.37	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.2	179.5	-65.7	-69.1	-64.6	-115.9	-5.1	113.4	Y110 A111 L112 R161	Y110-R114 HydrophobicContact CD1-CG 4.46Å; Y110-R114 HydrophobicContact CE1-CG 4.15Å; Y110-R114 HydrophobicContact CE2-CG 4.38Å; Y110-R114 VanDerWaalsContact O-CG 3.3Å; Y110-R114 WeakPolarHBondContact O-CG 3.46Å; Y110-R114 PolarHBondContact O-N 3.36Å; Y110-R114 VanDerWaalsContact O-N 3.13Å; Y110-R114 PolarHBondContact OH-NH1 3.33Å; A111-R114 PolarHBondContact O-N 3.05Å; L112-R114 PolarHBondContact O-N 3.16Å; L112-R114 VanDerWaalsContact O-N 3.14Å; R114-R161 PolarHBondContact NH2-O 2.88Å
115	K	71.7	Confident	70.9	Confident	104 Å²	104	69 Å²	69	45%	0.452	38%	0.376	S	S	.	.	S	Bend	trans	-75.9	129.7	174.3	-71.4	177	-172.4	176.7	0	109.5	A111 L112 G117 A118	A111-K115 PolarHBondContact O-N 2.64Å; L112-K115 HydrophobicContact CD2-CD 4.27Å; L112-K115 WeakPolarHBondContact O-CB 3.29Å; L112-K115 PolarHBondContact O-N 2.8Å; K115-G117 PolarHBondContact O-N 2.94Å; K115-A118 HydrophobicContact CB-CB 4.1Å; K115-A118 WeakPolarHBondContact O-CB 3.18Å; K115-A118 PolarHBondContact O-N 3.23Å
116	E	63.3	Low	70	Confident	165 Å²	165	71.1 Å²	71.1	77%	0.771	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	131.5	173.8	-68	-174.5	171.9	0	0	110.7	A118	E116-A118 VanDerWaalsContact C-N 3.26Å; E116-A118 PolarHBondContact O-N 3.08Å
117	G	57.1	Low	68.8	Low	88 Å²	88	80.2 Å²	80.2	91%	0.907	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	13.6	179.4	0	0	0	0	0	115.4	K115	K115-G117 PolarHBondContact O-N 2.94Å
118	A	57.9	Low	68.1	Low	42 Å²	42	86.6 Å²	86.6	35%	0.347	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-63.3	149.7	173.2	0	0	0	0	0	111.8	L112 K115 E116	L112-A118 VanDerWaalsContact O-CB 3.27Å; L112-A118 WeakPolarHBondContact O-CB 3.48Å; K115-A118 HydrophobicContact CB-CB 4.1Å; K115-A118 WeakPolarHBondContact O-CB 3.18Å; K115-A118 PolarHBondContact O-N 3.23Å; E116-A118 VanDerWaalsContact C-N 3.26Å; E116-A118 PolarHBondContact O-N 3.08Å
119	E	57.6	Low	67.2	Low	180 Å²	180	84 Å²	84	84%	0.841	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-60.8	133.5	171.4	-69.1	-175.4	167.7	0	0	109.7	V121	E119-V121 PolarHBondContact O-N 2.93Å; E119-V121 VanDerWaalsContact O-N 3.1Å
120	P	58.8	Low	66.6	Low	99 Å²	99	85.9 Å²	85.9	64%	0.643	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-64.1	117	179.3	23.6	-30.2	0	0	0	109.3	P122	P120-P122 WeakPolarHBondContact O-CD 3.19Å
121	V	62.4	Low	66.4	Low	31 Å²	31	88.1 Å²	88.1	19%	0.188	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-59.5	120.4	172.8	-174.7	0	0	0	0	107.8	T109 E119 F123 L124	T109-V121 HydrophobicContact CG2-CG1 4.14Å; T109-V121 HydrophobicContact CG2-CG2 4.23Å; E119-V121 PolarHBondContact O-N 2.93Å; E119-V121 VanDerWaalsContact O-N 3.1Å; V121-F123 VanDerWaalsContact C-N 3.3Å; V121-F123 HydrophobicContact CG1-CD1 3.79Å; V121-F123 HydrophobicContact CG1-CE1 3.42Å; V121-F123 VanDerWaalsContact CG1-CE1 3.42Å; V121-F123 HydrophobicContact CG1-CE2 4.45Å; V121-F123 HydrophobicContact CG1-CG 4.44Å; V121-F123 HydrophobicContact CG1-CZ 3.81Å; V121-F123 PolarHBondContact O-N 2.88Å; V121-F123 VanDerWaalsContact O-N 3.13Å; V121-L124 HydrophobicContact CB-CB 4.12Å; V121-L124 HydrophobicContact CB-CD1 3.93Å; V121-L124 HydrophobicContact CB-CG 4.07Å; V121-L124 HydrophobicContact CG1-CD1 4.26Å; V121-L124 HydrophobicContact CG1-CG 4.19Å; V121-L124 HydrophobicContact CG2-CD1 4.12Å; V121-L124 PolarHBondContact O-N 3.4Å
122	P	63.4	Low	66.4	Low	102 Å²	102	91.1 Å²	91.1	66%	0.662	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-52.7	-41.7	-166.8	-30.7	34.9	0	0	0	114.6	P120 Q125	P120-P122 WeakPolarHBondContact O-CD 3.19Å; P122-Q125 VanDerWaalsContact O-CG 3.31Å; P122-Q125 WeakPolarHBondContact O-CG 3.24Å
123	F	67.1	Low	66.4	Low	42 Å²	42	87.8 Å²	87.8	18%	0.184	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-83.8	-13.4	-178.3	67	-96.5	0	0	0	114.4	D77 L80 L81 T109 V121 Q125	D77-F123 HydrophobicContact CB-CE1 4.45Å; L80-F123 HydrophobicContact CD2-CZ 4.28Å; L81-F123 HydrophobicContact CD1-CB 3.97Å; L81-F123 HydrophobicContact CD1-CD2 3.83Å; L81-F123 HydrophobicContact CD1-CG 4.09Å; T109-F123 HydrophobicContact CG2-CZ 4.03Å; V121-F123 VanDerWaalsContact C-N 3.3Å; V121-F123 HydrophobicContact CG1-CD1 3.79Å; V121-F123 HydrophobicContact CG1-CE1 3.42Å; V121-F123 VanDerWaalsContact CG1-CE1 3.42Å; V121-F123 HydrophobicContact CG1-CE2 4.45Å; V121-F123 HydrophobicContact CG1-CG 4.44Å; V121-F123 HydrophobicContact CG1-CZ 3.81Å; V121-F123 PolarHBondContact O-N 2.88Å; V121-F123 VanDerWaalsContact O-N 3.13Å; F123-Q125 VanDerWaalsContact C-N 3.29Å
124	L	59.9	Low	66.5	Low	25 Å²	25	89 Å²	89	13%	0.131	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-85.8	1	174.7	-66.8	-178.6	0	0	0	113.2	T109 V121 E126 M129 L133	T109-L124 HydrophobicContact CG2-CD1 3.82Å; V121-L124 HydrophobicContact CB-CB 4.12Å; V121-L124 HydrophobicContact CB-CD1 3.93Å; V121-L124 HydrophobicContact CB-CG 4.07Å; V121-L124 HydrophobicContact CG1-CD1 4.26Å; V121-L124 HydrophobicContact CG1-CG 4.19Å; V121-L124 HydrophobicContact CG2-CD1 4.12Å; V121-L124 PolarHBondContact O-N 3.4Å; L124-E126 PolarHBondContact O-N 3.3Å; L124-M129 HydrophobicContact CD2-CB 4.42Å; L124-L133 HydrophobicContact CD1-CD2 3.89Å; L124-L133 HydrophobicContact CD2-CB 4.46Å; L124-L133 HydrophobicContact CD2-CD2 3.95Å
125	Q	59.5	Low	66.8	Low	144 Å²	144	88.2 Å²	88.2	67%	0.673	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-61.3	-27.4	175.2	-67.7	-178.9	12.6	0	0	112.1	P122 F123 K127	P122-Q125 VanDerWaalsContact O-CG 3.31Å; P122-Q125 WeakPolarHBondContact O-CG 3.24Å; F123-Q125 VanDerWaalsContact C-N 3.29Å; Q125-K127 PolarHBondContact O-N 3.21Å
126	E	63.2	Low	67.3	Low	122 Å²	122	83.7 Å²	83.7	57%	0.57	45%	0.45	S	S	*	.	S	Bend	trans	-77.9	117.5	172.4	-65.3	-166.1	171.3	0	0	111.5	L124 K128 M129 A130	L124-E126 PolarHBondContact O-N 3.3Å; E126-K128 PolarHBondContact O-N 2.93Å; E126-M129 HydrophobicContact CB-CB 4.39Å; E126-M129 HydrophobicContact CB-CG 4.05Å; E126-M129 PolarHBondContact O-N 3.13Å; E126-A130 PolarHBondContact O-N 3.04Å
127	K	60.6	Low	68.3	Low	190 Å²	190	75.9 Å²	75.9	83%	0.826	41%	0.413	S	S	*	.	H	α-helix	trans	-50.3	-32.6	177.4	-72.8	-172.9	177	-177.4	0	113.9	Q125 S131	Q125-K127 PolarHBondContact O-N 3.21Å; K127-S131 PolarHBondContact O-N 3.12Å; K127-S131 VanDerWaalsContact O-N 3.13Å
128	K	68.3	Low	69.6	Low	155 Å²	155	73.8 Å²	73.8	67%	0.674	38%	0.381	S	S	*	.	H	α-helix	trans	-66.2	-39.2	178	-69.6	-176.9	178.7	179.5	0	112.2	E126 S131 R132	E126-K128 PolarHBondContact O-N 2.93Å; K128-S131 PolarHBondContact O-N 2.95Å; K128-R132 WeakPolarHBondContact O-CG 3.37Å; K128-R132 PolarHBondContact O-N 3.45Å; K128-R132 VanDerWaalsContact O-N 3.08Å
129	M	65.3	Low	70.8	Confident	24 Å²	24	75.6 Å²	75.6	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-72.4	-40.1	-179.7	-65.3	-59	-144.6	0	0	111.3	L81 L124 E126 S131 R132 L133	L81-M129 HydrophobicContact CD1-CE 3.67Å; L124-M129 HydrophobicContact CD2-CB 4.42Å; E126-M129 HydrophobicContact CB-CB 4.39Å; E126-M129 HydrophobicContact CB-CG 4.05Å; E126-M129 PolarHBondContact O-N 3.13Å; M129-S131 VanDerWaalsContact C-N 3.32Å; M129-S131 PolarHBondContact O-N 3.25Å; M129-R132 PolarHBondContact O-N 2.73Å; M129-L133 PolarHBondContact O-N 2.89Å
130	A	69.5	Low	72	Confident	42 Å²	42	67.6 Å²	67.6	35%	0.347	34%	0.342	S	S	.	.	H	α-helix	trans	-58.7	-43.1	172.6	0	0	0	0	0	112.1	E126 L133 Q134	E126-A130 PolarHBondContact O-N 3.04Å; A130-L133 PolarHBondContact O-N 3.17Å; A130-Q134 PolarHBondContact O-N 3.15Å
131	S	77.2	Confident	73.2	Confident	58 Å²	58	63.1 Å²	63.1	41%	0.406	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-45.5	175.1	-168.1	0	0	0	0	112	K127 K128 M129 L133 Q134 D135	K127-S131 PolarHBondContact O-N 3.12Å; K127-S131 VanDerWaalsContact O-N 3.13Å; K128-S131 PolarHBondContact O-N 2.95Å; M129-S131 VanDerWaalsContact C-N 3.32Å; M129-S131 PolarHBondContact O-N 3.25Å; S131-L133 PolarHBondContact O-N 2.95Å; S131-Q134 WeakPolarHBondContact O-CB 3.46Å; S131-Q134 PolarHBondContact O-N 2.92Å; S131-D135 VanDerWaalsContact O-CG 3.26Å; S131-D135 PolarHBondContact O-N 3.18Å
132	R	79.1	Confident	74.2	Confident	74 Å²	74	67 Å²	67	28%	0.279	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-35.2	-179.8	-70.9	174.1	164.1	172.5	-10.7	113.3	I84 E87 K128 M129 Q134 D135 L136	I84-R132 HydrophobicContact CG2-CB 3.29Å; I84-R132 HydrophobicContact CG2-CG 4.33Å; E87-R132 IonicContact OE1-CZ 3.47Å; E87-R132 VanDerWaalsContact OE1-CZ 3.24Å; E87-R132 IonicContact OE1-NE 3.62Å; E87-R132 PolarHBondContact OE1-NE 2.78Å; E87-R132 VanDerWaalsContact OE1-NE 3.08Å; E87-R132 IonicContact OE1-NH2 3.5Å; E87-R132 PolarHBondContact OE1-NH2 2.82Å; K128-R132 WeakPolarHBondContact O-CG 3.37Å; K128-R132 PolarHBondContact O-N 3.45Å; K128-R132 VanDerWaalsContact O-N 3.08Å; M129-R132 PolarHBondContact O-N 2.73Å; R132-Q134 VanDerWaalsContact C-N 3.33Å; R132-D135 PolarHBondContact O-N 3.38Å; R132-L136 PolarHBondContact O-N 2.73Å
133	L	79.2	Confident	75.1	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63	-43.3	171.8	177	60.2	0	0	0	110.4	I84 A106 T109 Y110 L124 M129 A130 S131 D135 L136 I137	I84-L133 HydrophobicContact CD1-CB 4.11Å; I84-L133 HydrophobicContact CD1-CD1 4.05Å; A106-L133 HydrophobicContact CB-CD1 4.04Å; T109-L133 HydrophobicContact CG2-CD2 4.44Å; Y110-L133 HydrophobicContact CD2-CD2 4.22Å; Y110-L133 HydrophobicContact CD2-CG 4.23Å; L124-L133 HydrophobicContact CD1-CD2 3.89Å; L124-L133 HydrophobicContact CD2-CB 4.46Å; L124-L133 HydrophobicContact CD2-CD2 3.95Å; M129-L133 PolarHBondContact O-N 2.89Å; A130-L133 PolarHBondContact O-N 3.17Å; S131-L133 PolarHBondContact O-N 2.95Å; L133-D135 VanDerWaalsContact C-N 3.29Å; L133-D135 PolarHBondContact O-N 2.95Å; L133-L136 WeakPolarHBondContact O-CB 3.44Å; L133-L136 PolarHBondContact O-N 3.45Å; L133-I137 HydrophobicContact CD1-CG1 4.3Å; L133-I137 VanDerWaalsContact O-CG1 3.26Å; L133-I137 WeakPolarHBondContact O-CG1 3.28Å; L133-I137 PolarHBondContact O-N 2.73Å
134	Q	80	Confident	75.8	Confident	82 Å²	82	62 Å²	62	38%	0.383	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-39.2	174.9	-174.4	178.9	-8.9	0	0	111.8	Y110 A130 S131 R132 I137 N138	Y110-Q134 HydrophobicContact CE2-CB 4.4Å; A130-Q134 PolarHBondContact O-N 3.15Å; S131-Q134 WeakPolarHBondContact O-CB 3.46Å; S131-Q134 PolarHBondContact O-N 2.92Å; R132-Q134 VanDerWaalsContact C-N 3.33Å; Q134-I137 PolarHBondContact O-N 3.15Å; Q134-N138 WeakPolarHBondContact O-CB 3.5Å; Q134-N138 VanDerWaalsContact O-CG 3.27Å; Q134-N138 PolarHBondContact O-N 3.25Å; Q134-N138 PolarHBondContact O-ND2 3.23Å
135	D	82	Confident	76.8	Confident	82 Å²	82	61.4 Å²	61.4	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-65.2	-41.2	175.2	-63.7	-29.7	0	0	0	112.1	S131 R132 L133 I137 N138 R139	S131-D135 VanDerWaalsContact O-CG 3.26Å; S131-D135 PolarHBondContact O-N 3.18Å; R132-D135 PolarHBondContact O-N 3.38Å; L133-D135 VanDerWaalsContact C-N 3.29Å; L133-D135 PolarHBondContact O-N 2.95Å; D135-I137 VanDerWaalsContact C-N 3.35Å; D135-N138 PolarHBondContact O-N 3.21Å; D135-R139 WeakPolarHBondContact O-CG 3.45Å; D135-R139 PolarHBondContact O-N 2.86Å
136	L	82.5	Confident	77.9	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.052	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-45.1	173.3	179.4	63.9	0	0	0	111.1	L80 I84 F90 V92 A106 R132 L133 R139 I140	L80-L136 HydrophobicContact CD1-CD2 4.3Å; I84-L136 HydrophobicContact CG1-CD2 4.16Å; F90-L136 HydrophobicContact CD1-CD1 3.77Å; F90-L136 HydrophobicContact CE1-CD1 3.99Å; V92-L136 HydrophobicContact CG2-CD1 3.87Å; A106-L136 HydrophobicContact CB-CD2 4.03Å; R132-L136 PolarHBondContact O-N 2.73Å; L133-L136 WeakPolarHBondContact O-CB 3.44Å; L133-L136 PolarHBondContact O-N 3.45Å; L136-R139 PolarHBondContact O-N 2.78Å; L136-I140 HydrophobicContact CG-CD1 4.14Å; L136-I140 WeakPolarHBondContact O-CD1 3.41Å; L136-I140 VanDerWaalsContact O-CG1 3.31Å; L136-I140 WeakPolarHBondContact O-CG1 3.38Å; L136-I140 PolarHBondContact O-N 3.15Å
137	I	83	Confident	78.8	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-39.9	177.1	-65.7	-68.6	0	0	0	111.4	A106 I107 Y110 L133 Q134 D135 R139 I140 F141	A106-I137 HydrophobicContact CB-CD1 4.33Å; I107-I137 HydrophobicContact CG1-CD1 4.01Å; Y110-I137 HydrophobicContact CD1-CD1 4.43Å; Y110-I137 HydrophobicContact CD1-CG1 4.07Å; Y110-I137 HydrophobicContact CD1-CG2 4.07Å; Y110-I137 HydrophobicContact CD2-CG1 4.34Å; Y110-I137 HydrophobicContact CE1-CG2 4.08Å; Y110-I137 HydrophobicContact CG-CD1 4.37Å; Y110-I137 HydrophobicContact CG-CG1 3.88Å; L133-I137 HydrophobicContact CD1-CG1 4.3Å; L133-I137 VanDerWaalsContact O-CG1 3.26Å; L133-I137 WeakPolarHBondContact O-CG1 3.28Å; L133-I137 PolarHBondContact O-N 2.73Å; Q134-I137 PolarHBondContact O-N 3.15Å; D135-I137 VanDerWaalsContact C-N 3.35Å; I137-R139 VanDerWaalsContact C-N 3.35Å; I137-R139 PolarHBondContact O-N 3.14Å; I137-I140 HydrophobicContact CD1-CD1 4.04Å; I137-I140 PolarHBondContact O-N 3.12Å; I137-F141 HydrophobicContact CG2-CD2 3.74Å; I137-F141 HydrophobicContact CG2-CE2 3.41Å; I137-F141 VanDerWaalsContact CG2-CE2 3.41Å; I137-F141 HydrophobicContact CG2-CZ 4.45Å; I137-F141 WeakPolarHBondContact O-CD2 3.3Å; I137-F141 PolarHBondContact O-N 3.36Å
138	N	85.4	Confident	79.7	Confident	43 Å²	43	56.3 Å²	56.3	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-44.7	173.6	-75.5	-30.4	0	0	0	111.5	Q134 D135 I140 F141 E142 R162	Q134-N138 WeakPolarHBondContact O-CB 3.5Å; Q134-N138 VanDerWaalsContact O-CG 3.27Å; Q134-N138 PolarHBondContact O-N 3.25Å; Q134-N138 PolarHBondContact O-ND2 3.23Å; D135-N138 PolarHBondContact O-N 3.21Å; N138-I140 VanDerWaalsContact C-N 3.34Å; N138-I140 PolarHBondContact O-N 3.24Å; N138-F141 PolarHBondContact O-N 3.18Å; N138-E142 WeakPolarHBondContact O-CG 3.47Å; N138-E142 PolarHBondContact O-N 2.84Å; N138-R162 PolarHBondContact OD1-NH1 3.16Å; N138-R162 PolarHBondContact OD1-NH2 3.02Å; N138-R162 VanDerWaalsContact OD1-NH2 3.14Å
139	R	83.2	Confident	80.4	Confident	81 Å²	81	53.2 Å²	53.2	31%	0.306	27%	0.274	S	S	.	.	H	α-helix	trans	-62.4	-39.6	175.6	-74.6	176.8	58.6	-162.3	-5.9	112.6	E87 F90 D135 L136 I137 F141 E142 G143	E87-R139 PolarHBondContact O-NH1 3.37Å; F90-R139 PolarHBondContact O-NH2 3.46Å; D135-R139 WeakPolarHBondContact O-CG 3.45Å; D135-R139 PolarHBondContact O-N 2.86Å; L136-R139 PolarHBondContact O-N 2.78Å; I137-R139 VanDerWaalsContact C-N 3.35Å; I137-R139 PolarHBondContact O-N 3.14Å; R139-F141 VanDerWaalsContact C-N 3.34Å; R139-E142 PolarHBondContact O-N 3.24Å; R139-G143 PolarHBondContact O-N 3.11Å
140	I	82.7	Confident	81.3	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.056	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-47.4	173.9	-68.8	158.1	0	0	0	109.9	V92 V103 L136 I137 N138 E142 G143 C144	V92-I140 HydrophobicContact CG1-CB 4.38Å; V92-I140 HydrophobicContact CG1-CG1 3.53Å; V103-I140 HydrophobicContact CG1-CD1 3.87Å; V103-I140 HydrophobicContact CG1-CG1 4.25Å; V103-I140 HydrophobicContact CG1-CG2 4.37Å; V103-I140 HydrophobicContact CG2-CD1 4.26Å; V103-I140 HydrophobicContact CG2-CG1 4.46Å; L136-I140 HydrophobicContact CG-CD1 4.14Å; L136-I140 WeakPolarHBondContact O-CD1 3.41Å; L136-I140 VanDerWaalsContact O-CG1 3.31Å; L136-I140 WeakPolarHBondContact O-CG1 3.38Å; L136-I140 PolarHBondContact O-N 3.15Å; I137-I140 HydrophobicContact CD1-CD1 4.04Å; I137-I140 PolarHBondContact O-N 3.12Å; N138-I140 VanDerWaalsContact C-N 3.34Å; N138-I140 PolarHBondContact O-N 3.24Å; I140-E142 PolarHBondContact O-N 3.31Å; I140-G143 PolarHBondContact O-N 3.2Å; I140-C144 PolarHBondContact O-N 2.95Å; I140-C144 PolarHBondContact O-SG 2.87Å
141	F	83	Confident	81.9	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-61.5	-45.6	176.4	-76.2	-58.8	0	0	0	112.1	I137 N138 R139 G143 C144 F145 I153 V156 V165	I137-F141 HydrophobicContact CG2-CD2 3.74Å; I137-F141 HydrophobicContact CG2-CE2 3.41Å; I137-F141 VanDerWaalsContact CG2-CE2 3.41Å; I137-F141 HydrophobicContact CG2-CZ 4.45Å; I137-F141 WeakPolarHBondContact O-CD2 3.3Å; I137-F141 PolarHBondContact O-N 3.36Å; N138-F141 PolarHBondContact O-N 3.18Å; R139-F141 VanDerWaalsContact C-N 3.34Å; F141-G143 VanDerWaalsContact C-N 3.33Å; F141-G143 PolarHBondContact O-N 3.21Å; F141-C144 PolarHBondContact O-N 3Å; F141-C144 VanDerWaalsContact O-N 3.15Å; F141-F145 HydrophobicContact CB-CD2 4.34Å; F141-F145 HydrophobicContact CB-CE2 4.34Å; F141-F145 WeakPolarHBondContact O-CD2 3.44Å; F141-F145 PolarHBondContact O-N 3.39Å; F141-I153 HydrophobicContact CD1-CG2 4.11Å; F141-I153 HydrophobicContact CE1-CG2 4.27Å; F141-V156 HydrophobicContact CE1-CB 3.95Å; F141-V156 HydrophobicContact CE1-CG1 3.77Å; F141-V156 HydrophobicContact CZ-CB 4.24Å; F141-V156 HydrophobicContact CZ-CG1 3.64Å; F141-V165 HydrophobicContact CD1-CG1 3.59Å; F141-V165 HydrophobicContact CD2-CG1 4.39Å; F141-V165 HydrophobicContact CD2-CG2 4.02Å; F141-V165 HydrophobicContact CE1-CG1 3.65Å; F141-V165 HydrophobicContact CE2-CG1 4.44Å; F141-V165 HydrophobicContact CE2-CG2 4.11Å; F141-V165 HydrophobicContact CG-CG1 3.97Å; F141-V165 HydrophobicContact CG-CG2 4.3Å; F141-V165 HydrophobicContact CZ-CG1 4.07Å; F141-V165 HydrophobicContact CZ-CG2 4.45Å
142	E	84.7	Confident	82.1	Confident	112 Å²	112	56 Å²	56	52%	0.523	28%	0.278	S	S	.	.	H	α-helix	trans	-58	-42.9	177.4	-74	174.4	178.5	0	0	112.5	N138 R139 I140 F145 A146	N138-E142 WeakPolarHBondContact O-CG 3.47Å; N138-E142 PolarHBondContact O-N 2.84Å; R139-E142 PolarHBondContact O-N 3.24Å; I140-E142 PolarHBondContact O-N 3.31Å; E142-F145 PolarHBondContact O-N 3.39Å; E142-A146 PolarHBondContact O-N 3.21Å
143	G	81.3	Confident	82.3	Confident	13 Å²	13	52.5 Å²	52.5	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-44.3	173.5	0	0	0	0	0	112.4	R139 I140 F141 A146 R147	R139-G143 PolarHBondContact O-N 3.11Å; I140-G143 PolarHBondContact O-N 3.2Å; F141-G143 VanDerWaalsContact C-N 3.33Å; F141-G143 PolarHBondContact O-N 3.21Å; G143-A146 PolarHBondContact O-N 2.96Å; G143-R147 WeakPolarHBondContact O-CG 3.18Å; G143-R147 PolarHBondContact O-N 3.37Å; G143-R147 VanDerWaalsContact O-N 3.14Å
144	C	81.6	Confident	82.5	Confident	27 Å²	27	52.5 Å²	52.5	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-38.6	176.2	-66.1	0	0	0	0	112.8	I140 F141 R147 K148 E149 I153	I140-C144 PolarHBondContact O-N 2.95Å; I140-C144 PolarHBondContact O-SG 2.87Å; F141-C144 PolarHBondContact O-N 3Å; F141-C144 VanDerWaalsContact O-N 3.15Å; C144-R147 PolarHBondContact O-N 3.24Å; C144-K148 PolarHBondContact O-N 3.24Å; C144-E149 PolarHBondContact O-N 3.35Å; C144-I153 HydrophobicContact CB-CD1 4Å; C144-I153 HydrophobicContact CB-CG1 3.62Å
145	F	82.4	Confident	82.6	Confident	12 Å²	12	49.6 Å²	49.6	5%	0.053	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-43.5	173.9	-86.3	-72.6	0	0	0	111	F141 E142 R147 K148 Y150 I153 V165 R168 A169 E172	F141-F145 HydrophobicContact CB-CD2 4.34Å; F141-F145 HydrophobicContact CB-CE2 4.34Å; F141-F145 WeakPolarHBondContact O-CD2 3.44Å; F141-F145 PolarHBondContact O-N 3.39Å; E142-F145 PolarHBondContact O-N 3.39Å; F145-R147 PolarHBondContact O-N 3.4Å; F145-K148 PolarHBondContact O-N 3.1Å; F145-Y150 HydrophobicContact CD1-CE1 4.25Å; F145-Y150 HydrophobicContact CE1-CE1 4.44Å; F145-I153 HydrophobicContact CB-CD1 4.46Å; F145-I153 HydrophobicContact CD1-CD1 3.83Å; F145-I153 HydrophobicContact CD2-CD1 4.14Å; F145-I153 HydrophobicContact CE1-CD1 4.04Å; F145-I153 HydrophobicContact CE2-CD1 4.3Å; F145-I153 HydrophobicContact CE2-CG2 4.22Å; F145-I153 HydrophobicContact CG-CD1 3.87Å; F145-I153 HydrophobicContact CZ-CD1 4.24Å; F145-I153 HydrophobicContact CZ-CG2 4.06Å; F145-V165 HydrophobicContact CE2-CG1 3.98Å; F145-V165 HydrophobicContact CZ-CG1 4.18Å; F145-R168 HydrophobicContact CE1-CB 4.44Å; F145-R168 HydrophobicContact CE1-CG 3.92Å; F145-R168 HydrophobicContact CZ-CB 3.98Å; F145-R168 HydrophobicContact CZ-CG 3.76Å; F145-A169 HydrophobicContact CE1-CB 4.05Å; F145-A169 HydrophobicContact CZ-CB 4.08Å; F145-E172 VanDerWaalsContact CD1-OE2 3.22Å; F145-E172 WeakPolarHBondContact CD1-OE2 3.16Å
146	A	81.2	Confident	82.6	Confident	86 Å²	86	47 Å²	47	71%	0.711	24%	0.244	S	C	*	.	H	α-helix	trans	-61.4	-32.2	176.6	0	0	0	0	0	112.7	E142 G143 K148	E142-A146 PolarHBondContact O-N 3.21Å; G143-A146 PolarHBondContact O-N 2.96Å; A146-K148 VanDerWaalsContact C-N 3.33Å
147	R	82	Confident	82.7	Confident	126 Å²	126	46.6 Å²	46.6	48%	0.475	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-6.5	175.8	-64	173.2	-166.7	-173.5	3.2	114.1	D93 G143 C144 F145 E149	D93-R147 IonicContact OD1-CZ 3.62Å; D93-R147 IonicContact OD1-NE 2.75Å; D93-R147 IonicContact OD1-NH2 3.94Å; D93-R147 PolarHBondContact OD1-NH2 2.64Å; G143-R147 WeakPolarHBondContact O-CG 3.18Å; G143-R147 PolarHBondContact O-N 3.37Å; G143-R147 VanDerWaalsContact O-N 3.14Å; C144-R147 PolarHBondContact O-N 3.24Å; F145-R147 PolarHBondContact O-N 3.4Å; R147-E149 HydrophobicContact CB-CG 4.02Å; R147-E149 PolarHBondContact O-N 3.13Å
148	K	81.3	Confident	82.6	Confident	136 Å²	136	47.1 Å²	47.1	59%	0.591	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	29.3	-175.1	-56.4	-174.1	173.1	-166	0	114.4	C144 F145 A146 Y150	C144-K148 PolarHBondContact O-N 3.24Å; F145-K148 PolarHBondContact O-N 3.1Å; A146-K148 VanDerWaalsContact C-N 3.33Å; K148-Y150 VanDerWaalsContact C-N 3.28Å; K148-Y150 HydrophobicContact CB-CE2 4.12Å; K148-Y150 WeakPolarHBondContact O-CD2 3.24Å; K148-Y150 PolarHBondContact O-N 3.4Å
149	E	82.3	Confident	82.3	Confident	91 Å²	91	50.4 Å²	50.4	43%	0.425	26%	0.259	S	S	.	.			trans	-85	60.5	-179.5	-69.3	177.6	-163.6	0	0	112.1	C144 R147 K151 A152 I153	C144-E149 PolarHBondContact O-N 3.35Å; R147-E149 HydrophobicContact CB-CG 4.02Å; R147-E149 PolarHBondContact O-N 3.13Å; E149-K151 VanDerWaalsContact C-N 3.33Å; E149-K151 PolarHBondContact O-N 3.03Å; E149-A152 HydrophobicContact CB-CB 4.29Å; E149-A152 PolarHBondContact O-N 3.14Å; E149-A152 VanDerWaalsContact O-N 3.13Å; E149-I153 WeakPolarHBondContact O-CG1 3.44Å; E149-I153 PolarHBondContact O-N 3.04Å; E149-I153 VanDerWaalsContact O-N 3.11Å
150	Y	83.1	Confident	82.2	Confident	34 Å²	34	46.6 Å²	46.6	13%	0.133	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-35.6	-170.5	-59.2	-65.1	0	0	0	114.5	F145 K148 A152 I153 V154 A169 E172 L179	F145-Y150 HydrophobicContact CD1-CE1 4.25Å; F145-Y150 HydrophobicContact CE1-CE1 4.44Å; K148-Y150 VanDerWaalsContact C-N 3.28Å; K148-Y150 HydrophobicContact CB-CE2 4.12Å; K148-Y150 WeakPolarHBondContact O-CD2 3.24Å; K148-Y150 PolarHBondContact O-N 3.4Å; Y150-A152 VanDerWaalsContact C-N 3.34Å; Y150-A152 PolarHBondContact O-N 2.96Å; Y150-I153 HydrophobicContact CD1-CD1 4.2Å; Y150-I153 PolarHBondContact O-N 3.15Å; Y150-V154 VanDerWaalsContact O-CG2 3.3Å; Y150-V154 WeakPolarHBondContact O-CG2 3.35Å; Y150-V154 PolarHBondContact O-N 2.91Å; Y150-A169 HydrophobicContact CD1-CB 4.32Å; Y150-E172 HydrophobicContact CE1-CB 4.22Å; Y150-E172 PolarHBondContact OH-O 3.04Å; Y150-E172 VanDerWaalsContact OH-O 3.13Å; Y150-L179 HydrophobicContact CG-CD2 4.34Å
151	K	82.6	Confident	82.1	Confident	101 Å²	101	48.4 Å²	48.4	44%	0.439	25%	0.25	S	S	.	.	H	α-helix	trans	-63.4	-38.9	177.9	-69.8	-179	179.5	172.6	0	112.3	E149 G155 E178 L179 Y182	E149-K151 VanDerWaalsContact C-N 3.33Å; E149-K151 PolarHBondContact O-N 3.03Å; K151-G155 PolarHBondContact O-N 3.38Å; K151-G155 VanDerWaalsContact O-N 3.14Å; K151-E178 WeakPolarHBondContact CE-OE1 3.47Å; K151-E178 IonicContact NZ-OE1 3.14Å; K151-E178 PolarHBondContact NZ-OE1 3.29Å; K151-L179 HydrophobicContact CG-CD1 4.28Å; K151-Y182 HydrophobicContact CB-CD1 4.38Å; K151-Y182 HydrophobicContact CB-CE1 3.92Å; K151-Y182 HydrophobicContact CG-CD1 4.13Å; K151-Y182 HydrophobicContact CG-CE1 4.16Å; K151-Y182 HydrophobicContact CG-CG 4.42Å; K151-Y182 WeakPolarHBondContact O-CE1 3.42Å
152	A	81	Confident	82.1	Confident	46 Å²	46	49 Å²	49	38%	0.38	25%	0.252	S	S	.	.	H	α-helix	trans	-69	-42.1	175.1	0	0	0	0	0	110.9	E149 Y150 V154 G155 V156	E149-A152 HydrophobicContact CB-CB 4.29Å; E149-A152 PolarHBondContact O-N 3.14Å; E149-A152 VanDerWaalsContact O-N 3.13Å; Y150-A152 VanDerWaalsContact C-N 3.34Å; Y150-A152 PolarHBondContact O-N 2.96Å; A152-V154 VanDerWaalsContact C-N 3.32Å; A152-V154 PolarHBondContact O-N 3.1Å; A152-G155 PolarHBondContact O-N 2.92Å; A152-G155 VanDerWaalsContact O-N 3.17Å; A152-V156 WeakPolarHBondContact O-CG2 3.27Å; A152-V156 PolarHBondContact O-N 3.45Å
153	I	84.2	Confident	81.8	Confident	2 Å²	2	46 Å²	46	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-57.8	-45.6	175.6	-62.6	169.7	0	0	0	110.8	F141 C144 F145 E149 Y150 G155 V156 A157 V165 A169	F141-I153 HydrophobicContact CD1-CG2 4.11Å; F141-I153 HydrophobicContact CE1-CG2 4.27Å; C144-I153 HydrophobicContact CB-CD1 4Å; C144-I153 HydrophobicContact CB-CG1 3.62Å; F145-I153 HydrophobicContact CB-CD1 4.46Å; F145-I153 HydrophobicContact CD1-CD1 3.83Å; F145-I153 HydrophobicContact CD2-CD1 4.14Å; F145-I153 HydrophobicContact CE1-CD1 4.04Å; F145-I153 HydrophobicContact CE2-CD1 4.3Å; F145-I153 HydrophobicContact CE2-CG2 4.22Å; F145-I153 HydrophobicContact CG-CD1 3.87Å; F145-I153 HydrophobicContact CZ-CD1 4.24Å; F145-I153 HydrophobicContact CZ-CG2 4.06Å; E149-I153 WeakPolarHBondContact O-CG1 3.44Å; E149-I153 PolarHBondContact O-N 3.04Å; E149-I153 VanDerWaalsContact O-N 3.11Å; Y150-I153 HydrophobicContact CD1-CD1 4.2Å; Y150-I153 PolarHBondContact O-N 3.15Å; I153-G155 PolarHBondContact O-N 3.48Å; I153-V156 PolarHBondContact O-N 2.83Å; I153-A157 WeakPolarHBondContact O-CB 3.36Å; I153-A157 PolarHBondContact O-N 3.39Å; I153-V165 HydrophobicContact CG2-CG1 3.61Å; I153-A169 HydrophobicContact CG2-CB 3.9Å
154	V	83.6	Confident	81.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-47.8	176.2	167.2	0	0	0	0	110.8	Y150 A152 A157 I158 L166 L179 Y182 C183	Y150-V154 VanDerWaalsContact O-CG2 3.3Å; Y150-V154 WeakPolarHBondContact O-CG2 3.35Å; Y150-V154 PolarHBondContact O-N 2.91Å; A152-V154 VanDerWaalsContact C-N 3.32Å; A152-V154 PolarHBondContact O-N 3.1Å; V154-A157 PolarHBondContact O-N 3.21Å; V154-I158 HydrophobicContact CG1-CD1 3.55Å; V154-I158 HydrophobicContact CG1-CG1 4.32Å; V154-I158 WeakPolarHBondContact O-CB 3.47Å; V154-I158 WeakPolarHBondContact O-CD1 3.48Å; V154-I158 WeakPolarHBondContact O-CG1 3.47Å; V154-I158 PolarHBondContact O-N 2.9Å; V154-L166 HydrophobicContact CB-CD1 4.2Å; V154-L166 HydrophobicContact CG1-CD1 4Å; V154-L166 HydrophobicContact CG2-CD1 3.87Å; V154-L179 HydrophobicContact CG2-CD1 3.71Å; V154-L179 HydrophobicContact CG2-CD2 4.31Å; V154-L179 HydrophobicContact CG2-CG 4.06Å; V154-Y182 HydrophobicContact CB-CD1 4.29Å; V154-Y182 HydrophobicContact CB-CE1 4.06Å; V154-Y182 HydrophobicContact CG1-CD1 3.93Å; V154-Y182 HydrophobicContact CG1-CE1 3.84Å; V154-C183 HydrophobicContact CG1-CB 4.33Å; V154-C183 WeakPolarHBondContact CG1-SG 3.28Å; V154-C183 WeakPolarHBondContact CG2-SG 3.22Å
155	G	81.9	Confident	82	Confident	21 Å²	21	48.3 Å²	48.3	22%	0.216	25%	0.248	C	C	.	.	H	α-helix	trans	-56.8	-52.6	178	0	0	0	0	0	112.4	K151 A152 I153 A157 I158 E159	K151-G155 PolarHBondContact O-N 3.38Å; K151-G155 VanDerWaalsContact O-N 3.14Å; A152-G155 PolarHBondContact O-N 2.92Å; A152-G155 VanDerWaalsContact O-N 3.17Å; I153-G155 PolarHBondContact O-N 3.48Å; G155-A157 PolarHBondContact O-N 3.11Å; G155-I158 PolarHBondContact O-N 2.95Å; G155-E159 WeakPolarHBondContact O-CG 3.11Å; G155-E159 PolarHBondContact O-N 2.86Å
156	V	82.4	Confident	82	Confident	29 Å²	29	47.8 Å²	47.8	18%	0.176	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-38.1	179.4	-177.9	0	0	0	0	111.5	I107 F141 A152 I153 I158 E159 T160	I107-V156 HydrophobicContact CD1-CG1 4.06Å; I107-V156 HydrophobicContact CD1-CG2 4.22Å; I107-V156 HydrophobicContact CG1-CG1 4.18Å; I107-V156 HydrophobicContact CG2-CG1 4Å; F141-V156 HydrophobicContact CE1-CB 3.95Å; F141-V156 HydrophobicContact CE1-CG1 3.77Å; F141-V156 HydrophobicContact CZ-CB 4.24Å; F141-V156 HydrophobicContact CZ-CG1 3.64Å; A152-V156 WeakPolarHBondContact O-CG2 3.27Å; A152-V156 PolarHBondContact O-N 3.45Å; I153-V156 PolarHBondContact O-N 2.83Å; V156-I158 VanDerWaalsContact C-N 3.33Å; V156-I158 PolarHBondContact O-N 2.98Å; V156-E159 PolarHBondContact O-N 3.3Å; V156-T160 HydrophobicContact CG1-CG2 4.06Å; V156-T160 VanDerWaalsContact O-CB 3.3Å; V156-T160 WeakPolarHBondContact O-CB 3.42Å; V156-T160 VanDerWaalsContact O-CG2 3.22Å; V156-T160 WeakPolarHBondContact O-CG2 3.11Å; V156-T160 PolarHBondContact O-N 2.9Å; V156-T160 PolarHBondContact O-OG1 2.85Å
157	A	84.3	Confident	82.1	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-64.8	-37.6	177.2	0	0	0	0	0	112	I153 V154 G155 R161 R162 V165 L166	I153-A157 WeakPolarHBondContact O-CB 3.36Å; I153-A157 PolarHBondContact O-N 3.39Å; V154-A157 PolarHBondContact O-N 3.21Å; G155-A157 PolarHBondContact O-N 3.11Å; A157-R161 WeakPolarHBondContact O-CA 3.41Å; A157-R161 PolarHBondContact O-N 3.22Å; A157-R162 PolarHBondContact O-N 3.13Å; A157-V165 HydrophobicContact CB-CB 4.3Å; A157-V165 HydrophobicContact CB-CG1 4.13Å; A157-L166 HydrophobicContact CB-CB 4.28Å; A157-L166 HydrophobicContact CB-CD1 4.45Å
158	I	81.7	Confident	82.1	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.056	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-49	174.9	-73.1	168.3	0	0	0	110.5	V154 G155 V156 T160 R161 A186 V187 V191	V154-I158 HydrophobicContact CG1-CD1 3.55Å; V154-I158 HydrophobicContact CG1-CG1 4.32Å; V154-I158 WeakPolarHBondContact O-CB 3.47Å; V154-I158 WeakPolarHBondContact O-CD1 3.48Å; V154-I158 WeakPolarHBondContact O-CG1 3.47Å; V154-I158 PolarHBondContact O-N 2.9Å; G155-I158 PolarHBondContact O-N 2.95Å; V156-I158 VanDerWaalsContact C-N 3.33Å; V156-I158 PolarHBondContact O-N 2.98Å; I158-T160 VanDerWaalsContact C-N 3.35Å; I158-T160 PolarHBondContact O-N 3.44Å; I158-R161 PolarHBondContact O-N 2.81Å; I158-A186 HydrophobicContact CD1-CB 3.74Å; I158-V187 HydrophobicContact CD1-CG2 3.71Å; I158-V187 HydrophobicContact CG1-CG2 4.03Å; I158-V191 HydrophobicContact CG2-CG2 3.21Å
159	E	78.2	Confident	82.2	Confident	113 Å²	113	39 Å²	39	53%	0.528	19%	0.192	S	C	.	.	H	α-helix	trans	-62.5	-41.5	179.2	-73	178.1	173.5	0	0	112.4	G155 V156 R161	G155-E159 WeakPolarHBondContact O-CG 3.11Å; G155-E159 PolarHBondContact O-N 2.86Å; V156-E159 PolarHBondContact O-N 3.3Å; E159-R161 VanDerWaalsContact C-N 3.29Å; E159-R161 PolarHBondContact O-N 3.47Å
160	T	81	Confident	82.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-1	-179.1	62.7	0	0	0	0	114	I107 Y110 A111 V156 I158 R162	I107-T160 HydrophobicContact CG2-CG2 4.19Å; Y110-T160 HydrophobicContact CD1-CG2 3.63Å; Y110-T160 HydrophobicContact CE1-CG2 4.17Å; A111-T160 HydrophobicContact CB-CG2 4.47Å; V156-T160 HydrophobicContact CG1-CG2 4.06Å; V156-T160 VanDerWaalsContact O-CB 3.3Å; V156-T160 WeakPolarHBondContact O-CB 3.42Å; V156-T160 VanDerWaalsContact O-CG2 3.22Å; V156-T160 WeakPolarHBondContact O-CG2 3.11Å; V156-T160 PolarHBondContact O-N 2.9Å; V156-T160 PolarHBondContact O-OG1 2.85Å; I158-T160 VanDerWaalsContact C-N 3.35Å; I158-T160 PolarHBondContact O-N 3.44Å; T160-R162 VanDerWaalsContact C-N 3.34Å; T160-R162 PolarHBondContact O-N 3.01Å
161	R	81.1	Confident	82.1	Confident	50 Å²	50	37.2 Å²	37.2	19%	0.189	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	44.1	-178.7	-55	-179.9	-178.5	-174.2	-4	113.4	R114 A157 I158 E159 H193 F196	R114-R161 PolarHBondContact NH2-O 2.88Å; A157-R161 WeakPolarHBondContact O-CA 3.41Å; A157-R161 PolarHBondContact O-N 3.22Å; I158-R161 PolarHBondContact O-N 2.81Å; E159-R161 VanDerWaalsContact C-N 3.29Å; E159-R161 PolarHBondContact O-N 3.47Å; R161-H193 PolarHBondContact NH2-CD2 3.36Å; R161-F196 VanDerWaalsContact CA-CZ 3.48Å; R161-F196 HydrophobicContact CB-CD1 4.46Å; R161-F196 HydrophobicContact CB-CD2 4.05Å; R161-F196 HydrophobicContact CB-CE1 4.33Å; R161-F196 HydrophobicContact CB-CE2 3.91Å; R161-F196 HydrophobicContact CB-CG 4.34Å; R161-F196 HydrophobicContact CB-CZ 4.08Å; R161-F196 HydrophobicContact CG-CD1 4.05Å; R161-F196 HydrophobicContact CG-CD2 4.39Å; R161-F196 HydrophobicContact CG-CE1 4.19Å; R161-F196 HydrophobicContact CG-CG 4.17Å; R161-F196 HydrophobicContact CG-CZ 4.44Å
162	R	81.8	Confident	82	Confident	17 Å²	17	36.3 Å²	36.3	6%	0.064	19%	0.185	C	C	.	.			trans	-105.2	93.3	179.9	-78.2	-163.6	74.7	174.4	1.7	112	Y110 N138 A157 T160 D164 V165 L166	Y110-R162 HydrophobicContact CE1-CG 4.47Å; N138-R162 PolarHBondContact OD1-NH1 3.16Å; N138-R162 PolarHBondContact OD1-NH2 3.02Å; N138-R162 VanDerWaalsContact OD1-NH2 3.14Å; A157-R162 PolarHBondContact O-N 3.13Å; T160-R162 VanDerWaalsContact C-N 3.34Å; T160-R162 PolarHBondContact O-N 3.01Å; R162-D164 VanDerWaalsContact C-N 3.3Å; R162-D164 VanDerWaalsContact CB-OD1 3.31Å; R162-D164 WeakPolarHBondContact CB-OD1 2.99Å; R162-D164 IonicContact CZ-OD1 3.52Å; R162-D164 IonicContact CZ-OD2 2.88Å; R162-D164 IonicContact NE-OD1 2.8Å; R162-D164 PolarHBondContact NE-OD1 2.99Å; R162-D164 VanDerWaalsContact NE-OD1 3.12Å; R162-D164 IonicContact NE-OD2 3.75Å; R162-D164 PolarHBondContact NE-OD2 3.17Å; R162-D164 IonicContact NH2-OD1 2.69Å; R162-D164 IonicContact NH2-OD2 2.74Å; R162-D164 PolarHBondContact NH2-OD2 3.3Å; R162-D164 PolarHBondContact O-N 3.44Å; R162-V165 HydrophobicContact CB-CB 4.17Å; R162-V165 HydrophobicContact CB-CG2 4.15Å; R162-V165 VanDerWaalsContact NE-CG2 3.35Å; R162-L166 PolarHBondContact O-N 2.9Å
163	L	78.7	Confident	82	Confident	50 Å²	50	34.7 Å²	34.7	26%	0.262	17%	0.171	S	C	.	.	H	α-helix	trans	-67.7	-32.6	177.7	-165.1	118.2	0	0	0	112.2	V165 L166 Q167 Q199 V200	L163-V165 PolarHBondContact O-N 3.17Å; L163-L166 PolarHBondContact O-N 3.15Å; L163-Q167 HydrophobicContact CD2-CG 4.27Å; L163-Q167 VanDerWaalsContact CD2-NE2 3.34Å; L163-Q167 HydrophobicContact CG-CG 4.48Å; L163-Q167 WeakPolarHBondContact O-CB 3.44Å; L163-Q167 VanDerWaalsContact O-CG 3.24Å; L163-Q167 WeakPolarHBondContact O-CG 3.09Å; L163-Q167 PolarHBondContact O-N 3.32Å; L163-Q199 HydrophobicContact CD1-CB 4.44Å; L163-V200 HydrophobicContact CD1-CG2 4.15Å
164	D	83.6	Confident	81.6	Confident	81 Å²	81	41.5 Å²	41.5	43%	0.433	21%	0.207	S	C	.	.	H	α-helix	trans	-60.8	-44.9	177.6	60.2	-40.4	0	0	0	112.4	R162 R168	R162-D164 VanDerWaalsContact C-N 3.3Å; R162-D164 VanDerWaalsContact CB-OD1 3.31Å; R162-D164 WeakPolarHBondContact CB-OD1 2.99Å; R162-D164 IonicContact CZ-OD1 3.52Å; R162-D164 IonicContact CZ-OD2 2.88Å; R162-D164 IonicContact NE-OD1 2.8Å; R162-D164 PolarHBondContact NE-OD1 2.99Å; R162-D164 VanDerWaalsContact NE-OD1 3.12Å; R162-D164 IonicContact NE-OD2 3.75Å; R162-D164 PolarHBondContact NE-OD2 3.17Å; R162-D164 IonicContact NH2-OD1 2.69Å; R162-D164 IonicContact NH2-OD2 2.74Å; R162-D164 PolarHBondContact NH2-OD2 3.3Å; R162-D164 PolarHBondContact O-N 3.44Å; D164-R168 WeakPolarHBondContact O-CB 3.19Å; D164-R168 PolarHBondContact O-N 2.89Å; D164-R168 VanDerWaalsContact O-N 3.1Å
165	V	84	Confident	81.4	Confident	8 Å²	8	47.4 Å²	47.4	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-70.8	-40	177.8	174.7	0	0	0	0	111.2	F141 F145 I153 A157 R162 L163 Q167 R168 A169	F141-V165 HydrophobicContact CD1-CG1 3.59Å; F141-V165 HydrophobicContact CD2-CG1 4.39Å; F141-V165 HydrophobicContact CD2-CG2 4.02Å; F141-V165 HydrophobicContact CE1-CG1 3.65Å; F141-V165 HydrophobicContact CE2-CG1 4.44Å; F141-V165 HydrophobicContact CE2-CG2 4.11Å; F141-V165 HydrophobicContact CG-CG1 3.97Å; F141-V165 HydrophobicContact CG-CG2 4.3Å; F141-V165 HydrophobicContact CZ-CG1 4.07Å; F141-V165 HydrophobicContact CZ-CG2 4.45Å; F145-V165 HydrophobicContact CE2-CG1 3.98Å; F145-V165 HydrophobicContact CZ-CG1 4.18Å; I153-V165 HydrophobicContact CG2-CG1 3.61Å; A157-V165 HydrophobicContact CB-CB 4.3Å; A157-V165 HydrophobicContact CB-CG1 4.13Å; R162-V165 HydrophobicContact CB-CB 4.17Å; R162-V165 HydrophobicContact CB-CG2 4.15Å; R162-V165 VanDerWaalsContact NE-CG2 3.35Å; L163-V165 PolarHBondContact O-N 3.17Å; V165-Q167 VanDerWaalsContact C-N 3.34Å; V165-Q167 PolarHBondContact O-N 2.94Å; V165-R168 PolarHBondContact O-N 2.98Å; V165-A169 WeakPolarHBondContact O-CB 3.47Å; V165-A169 PolarHBondContact O-N 2.89Å
166	L	82.7	Confident	81.2	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-46	177.1	-171.8	70.9	0	0	0	111.1	V154 A157 R162 L163 A169 L170 V200 M204	V154-L166 HydrophobicContact CB-CD1 4.2Å; V154-L166 HydrophobicContact CG1-CD1 4Å; V154-L166 HydrophobicContact CG2-CD1 3.87Å; A157-L166 HydrophobicContact CB-CB 4.28Å; A157-L166 HydrophobicContact CB-CD1 4.45Å; R162-L166 PolarHBondContact O-N 2.9Å; L163-L166 PolarHBondContact O-N 3.15Å; L166-A169 PolarHBondContact O-N 3.44Å; L166-L170 HydrophobicContact CG-CD1 4.18Å; L166-L170 WeakPolarHBondContact O-CD1 3.39Å; L166-L170 VanDerWaalsContact O-CG 3.29Å; L166-L170 WeakPolarHBondContact O-CG 3.23Å; L166-L170 PolarHBondContact O-N 3.44Å; L166-L170 VanDerWaalsContact O-N 3.11Å; L166-V200 HydrophobicContact CD2-CB 4.48Å; L166-V200 HydrophobicContact CD2-CG1 3.5Å; L166-V200 HydrophobicContact CD2-CG2 4.18Å; L166-M204 HydrophobicContact CD2-CE 4Å
167	Q	81.9	Confident	80.8	Confident	54 Å²	54	53.4 Å²	53.4	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-60.9	-46	176.8	-75.3	179.1	-24.8	0	0	111.5	L163 V165 A169 L170 D171 D203	L163-Q167 HydrophobicContact CD2-CG 4.27Å; L163-Q167 VanDerWaalsContact CD2-NE2 3.34Å; L163-Q167 HydrophobicContact CG-CG 4.48Å; L163-Q167 WeakPolarHBondContact O-CB 3.44Å; L163-Q167 VanDerWaalsContact O-CG 3.24Å; L163-Q167 WeakPolarHBondContact O-CG 3.09Å; L163-Q167 PolarHBondContact O-N 3.32Å; V165-Q167 VanDerWaalsContact C-N 3.34Å; V165-Q167 PolarHBondContact O-N 2.94Å; Q167-A169 VanDerWaalsContact C-N 3.35Å; Q167-A169 PolarHBondContact O-N 3.06Å; Q167-L170 PolarHBondContact O-N 3.45Å; Q167-D171 VanDerWaalsContact O-CG 3.32Å; Q167-D171 PolarHBondContact O-N 3.16Å; Q167-D203 WeakPolarHBondContact CG-OD2 3.22Å; Q167-D203 PolarHBondContact NE2-OD1 2.69Å; Q167-D203 PolarHBondContact NE2-OD2 2.93Å; Q167-D203 VanDerWaalsContact NE2-OD2 3.15Å
168	R	83.5	Confident	80.5	Confident	108 Å²	108	57.9 Å²	57.9	41%	0.408	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-43.3	176.1	-174.6	-179.1	171.3	-161.5	-10	112.5	F145 D164 V165 L170 D171 E172	F145-R168 HydrophobicContact CE1-CB 4.44Å; F145-R168 HydrophobicContact CE1-CG 3.92Å; F145-R168 HydrophobicContact CZ-CB 3.98Å; F145-R168 HydrophobicContact CZ-CG 3.76Å; D164-R168 WeakPolarHBondContact O-CB 3.19Å; D164-R168 PolarHBondContact O-N 2.89Å; D164-R168 VanDerWaalsContact O-N 3.1Å; V165-R168 PolarHBondContact O-N 2.98Å; R168-L170 VanDerWaalsContact C-N 3.27Å; R168-L170 PolarHBondContact O-N 2.87Å; R168-D171 PolarHBondContact O-N 3.07Å; R168-E172 HydrophobicContact CG-CG 4.42Å; R168-E172 WeakPolarHBondContact CG-OE1 3.34Å; R168-E172 IonicContact CZ-OE1 3.77Å; R168-E172 IonicContact NE-OE1 3.28Å; R168-E172 PolarHBondContact NE-OE1 3.44Å; R168-E172 IonicContact NH2-OE1 3.99Å; R168-E172 PolarHBondContact NH2-OE1 3.41Å; R168-E172 VanDerWaalsContact NH2-OE1 3.13Å; R168-E172 IonicContact NH2-OE2 3.58Å; R168-E172 PolarHBondContact O-N 3.43Å
169	A	83.4	Confident	80.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-35.3	177.4	0	0	0	0	0	112.9	F145 Y150 I153 V165 L166 Q167 T173	F145-A169 HydrophobicContact CE1-CB 4.05Å; F145-A169 HydrophobicContact CZ-CB 4.08Å; Y150-A169 HydrophobicContact CD1-CB 4.32Å; I153-A169 HydrophobicContact CG2-CB 3.9Å; V165-A169 WeakPolarHBondContact O-CB 3.47Å; V165-A169 PolarHBondContact O-N 2.89Å; L166-A169 PolarHBondContact O-N 3.44Å; Q167-A169 VanDerWaalsContact C-N 3.35Å; Q167-A169 PolarHBondContact O-N 3.06Å; A169-T173 WeakPolarHBondContact O-CB 3.44Å; A169-T173 PolarHBondContact O-N 2.92Å
170	L	79.8	Confident	80.4	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-77.5	-27.3	177.6	-67.1	163.7	0	0	0	113.2	L166 Q167 R168 L179 I180 M204	L166-L170 HydrophobicContact CG-CD1 4.18Å; L166-L170 WeakPolarHBondContact O-CD1 3.39Å; L166-L170 VanDerWaalsContact O-CG 3.29Å; L166-L170 WeakPolarHBondContact O-CG 3.23Å; L166-L170 PolarHBondContact O-N 3.44Å; L166-L170 VanDerWaalsContact O-N 3.11Å; Q167-L170 PolarHBondContact O-N 3.45Å; R168-L170 VanDerWaalsContact C-N 3.27Å; R168-L170 PolarHBondContact O-N 2.87Å; L170-L179 HydrophobicContact CD2-CB 4.14Å; L170-L179 HydrophobicContact CD2-CD2 3.85Å; L170-L179 HydrophobicContact CD2-CG 3.85Å; L170-L179 HydrophobicContact CG-CD2 4.45Å; L170-I180 HydrophobicContact CD2-CG1 3.73Å; L170-M204 HydrophobicContact CD1-CE 3.37Å; L170-M204 HydrophobicContact CD1-SD 3.46Å; L170-M204 WeakPolarHBondContact CD1-SD 3.5Å
171	D	82.2	Confident	80.2	Confident	85 Å²	85	53.9 Å²	53.9	46%	0.455	26%	0.259	S	S	.	.	H	α-helix	trans	-80.4	-35.4	177.7	-69.8	-33.6	0	0	0	112.3	Q167 R168 R207	Q167-D171 VanDerWaalsContact O-CG 3.32Å; Q167-D171 PolarHBondContact O-N 3.16Å; R168-D171 PolarHBondContact O-N 3.07Å; D171-R207 IonicContact OD1-CZ 3.92Å; D171-R207 IonicContact OD1-NH1 3.76Å; D171-R207 PolarHBondContact OD1-NH1 2.98Å; D171-R207 IonicContact OD1-NH2 3.26Å; D171-R207 IonicContact OD2-NH1 2.59Å; D171-R207 IonicContact OD2-NH2 2.64Å; D171-R207 PolarHBondContact OD2-NH2 2.96Å
172	E	82.1	Confident	80.2	Confident	82 Å²	82	55.6 Å²	55.6	38%	0.383	27%	0.266	S	S	.	.	H	α-helix	trans	-84.5	-17.6	-179.8	-69.7	-176	-166.1	0	0	114.5	F145 Y150 R168	F145-E172 VanDerWaalsContact CD1-OE2 3.22Å; F145-E172 WeakPolarHBondContact CD1-OE2 3.16Å; Y150-E172 HydrophobicContact CE1-CB 4.22Å; Y150-E172 PolarHBondContact OH-O 3.04Å; Y150-E172 VanDerWaalsContact OH-O 3.13Å; R168-E172 HydrophobicContact CG-CG 4.42Å; R168-E172 WeakPolarHBondContact CG-OE1 3.34Å; R168-E172 IonicContact CZ-OE1 3.77Å; R168-E172 IonicContact NE-OE1 3.28Å; R168-E172 PolarHBondContact NE-OE1 3.44Å; R168-E172 IonicContact NH2-OE1 3.99Å; R168-E172 PolarHBondContact NH2-OE1 3.41Å; R168-E172 VanDerWaalsContact NH2-OE1 3.13Å; R168-E172 IonicContact NH2-OE2 3.58Å; R168-E172 PolarHBondContact O-N 3.43Å
173	T	79.9	Confident	80.2	Confident	12 Å²	12	54.8 Å²	54.8	7%	0.074	26%	0.263	C	S	.	.			trans	-74.7	141.9	-179.9	-167.9	0	0	0	0	112.6	A169 E175 K176 L179	A169-T173 WeakPolarHBondContact O-CB 3.44Å; A169-T173 PolarHBondContact O-N 2.92Å; T173-E175 PolarHBondContact OG1-N 3.28Å; T173-K176 HydrophobicContact CG2-CG 3.99Å; T173-L179 HydrophobicContact CG2-CB 4.22Å; T173-L179 HydrophobicContact CG2-CD2 3.69Å
174	D	76.6	Confident	80.2	Confident	144 Å²	144	52.6 Å²	52.6	77%	0.77	25%	0.252	S	S	*	.	S	Bend	trans	-73.5	-39.1	171.9	-61.9	-46.7	0	0	0	110.7	K176	D174-K176 PolarHBondContact O-N 2.95Å
175	E	79.3	Confident	80	Confident	125 Å²	125	54.5 Å²	54.5	58%	0.584	26%	0.256	S	S	*	.			trans	-95.9	69.1	-176.6	-67.1	-179.1	164.9	0	0	112.1	T173 L177 E178 L179	T173-E175 PolarHBondContact OG1-N 3.28Å; E175-L177 PolarHBondContact O-N 3.02Å; E175-E178 HydrophobicContact CB-CB 4.47Å; E175-L179 PolarHBondContact O-N 3.2Å
176	K	76.5	Confident	79.8	Confident	109 Å²	109	54.4 Å²	54.4	47%	0.474	26%	0.256	S	S	.	.	H	α-helix	trans	-59.1	-43.6	-175.3	-65.5	-174	176.9	-175.2	0	113.6	T173 D174 L179 I180	T173-K176 HydrophobicContact CG2-CG 3.99Å; D174-K176 PolarHBondContact O-N 2.95Å; K176-L179 PolarHBondContact O-N 3Å; K176-I180 WeakPolarHBondContact O-CB 3.4Å; K176-I180 WeakPolarHBondContact O-CD1 3.43Å; K176-I180 WeakPolarHBondContact O-CG1 3.41Å; K176-I180 PolarHBondContact O-N 3.4Å
177	L	74.5	Confident	79.8	Confident	67 Å²	67	54.3 Å²	54.3	35%	0.351	26%	0.256	S	S	.	.	H	α-helix	trans	-65.5	-45	-175.7	-177.6	64.9	0	0	0	112.3	E175 I180 T181 L208 N213	E175-L177 PolarHBondContact O-N 3.02Å; L177-I180 PolarHBondContact O-N 2.99Å; L177-T181 WeakPolarHBondContact O-CB 3.45Å; L177-T181 PolarHBondContact O-N 3.4Å; L177-T181 PolarHBondContact O-OG1 3.11Å; L177-L208 HydrophobicContact CD1-CD1 3.4Å; L177-L208 VanDerWaalsContact CD1-CD1 3.4Å; L177-N213 WeakPolarHBondContact CD2-O 3.26Å
178	E	78.8	Confident	79.5	Confident	94 Å²	94	52.8 Å²	52.8	44%	0.439	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-44	179.5	-174.3	177	156.2	0	0	110.8	K151 E175 T181 Y182	K151-E178 WeakPolarHBondContact CE-OE1 3.47Å; K151-E178 IonicContact NZ-OE1 3.14Å; K151-E178 PolarHBondContact NZ-OE1 3.29Å; E175-E178 HydrophobicContact CB-CB 4.47Å; E178-T181 PolarHBondContact O-N 2.79Å; E178-Y182 WeakPolarHBondContact O-CB 3.3Å; E178-Y182 PolarHBondContact O-N 2.93Å
179	L	80	Confident	79.1	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-41.3	179.9	-165.6	63.8	0	0	0	111.9	Y150 K151 V154 L170 T173 E175 K176 T181 Y182 C183	Y150-L179 HydrophobicContact CG-CD2 4.34Å; K151-L179 HydrophobicContact CG-CD1 4.28Å; V154-L179 HydrophobicContact CG2-CD1 3.71Å; V154-L179 HydrophobicContact CG2-CD2 4.31Å; V154-L179 HydrophobicContact CG2-CG 4.06Å; L170-L179 HydrophobicContact CD2-CB 4.14Å; L170-L179 HydrophobicContact CD2-CD2 3.85Å; L170-L179 HydrophobicContact CD2-CG 3.85Å; L170-L179 HydrophobicContact CG-CD2 4.45Å; T173-L179 HydrophobicContact CG2-CB 4.22Å; T173-L179 HydrophobicContact CG2-CD2 3.69Å; E175-L179 PolarHBondContact O-N 3.2Å; K176-L179 PolarHBondContact O-N 3Å; L179-T181 VanDerWaalsContact C-N 3.35Å; L179-T181 PolarHBondContact O-N 3.29Å; L179-Y182 HydrophobicContact CD1-CD1 4.4Å; L179-Y182 PolarHBondContact O-N 3.27Å; L179-C183 WeakPolarHBondContact O-CB 3.39Å; L179-C183 PolarHBondContact O-N 2.92Å; L179-C183 PolarHBondContact O-SG 3.17Å
180	I	77.9	Confident	78.7	Confident	11 Å²	11	60.5 Å²	60.5	6%	0.056	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-45	174.7	-69.5	167.2	0	0	0	110.6	L170 K176 L177 Y182 C183 I184 M204 R207 L208	L170-I180 HydrophobicContact CD2-CG1 3.73Å; K176-I180 WeakPolarHBondContact O-CB 3.4Å; K176-I180 WeakPolarHBondContact O-CD1 3.43Å; K176-I180 WeakPolarHBondContact O-CG1 3.41Å; K176-I180 PolarHBondContact O-N 3.4Å; L177-I180 PolarHBondContact O-N 2.99Å; I180-Y182 VanDerWaalsContact C-N 3.32Å; I180-Y182 PolarHBondContact O-N 3.47Å; I180-C183 WeakPolarHBondContact O-CB 3.45Å; I180-C183 PolarHBondContact O-N 3.23Å; I180-I184 HydrophobicContact CG2-CD1 3.9Å; I180-I184 HydrophobicContact CG2-CG1 4.39Å; I180-I184 WeakPolarHBondContact O-CG1 3.28Å; I180-I184 PolarHBondContact O-N 2.89Å; I180-M204 HydrophobicContact CG2-CB 4.23Å; I180-R207 HydrophobicContact CD1-CB 4.26Å; I180-L208 HydrophobicContact CG2-CB 4.4Å; I180-L208 HydrophobicContact CG2-CD2 4.35Å
181	T	76	Confident	78.6	Confident	22 Å²	22	61 Å²	61	14%	0.135	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-42	179.1	-55.2	0	0	0	0	111	L177 E178 L179 I184 K185	L177-T181 WeakPolarHBondContact O-CB 3.45Å; L177-T181 PolarHBondContact O-N 3.4Å; L177-T181 PolarHBondContact O-OG1 3.11Å; E178-T181 PolarHBondContact O-N 2.79Å; L179-T181 VanDerWaalsContact C-N 3.35Å; L179-T181 PolarHBondContact O-N 3.29Å; T181-I184 PolarHBondContact O-N 3.32Å; T181-K185 HydrophobicContact CG2-CD 4.39Å; T181-K185 WeakPolarHBondContact O-CG 3.34Å; T181-K185 PolarHBondContact O-N 3.3Å
182	Y	81.4	Confident	78	Confident	86 Å²	86	61.2 Å²	61.2	34%	0.337	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-44.2	172.8	177.2	-101.1	0	0	0	111.8	K151 V154 E178 L179 I180 I184 K185 A186	K151-Y182 HydrophobicContact CB-CD1 4.38Å; K151-Y182 HydrophobicContact CB-CE1 3.92Å; K151-Y182 HydrophobicContact CG-CD1 4.13Å; K151-Y182 HydrophobicContact CG-CE1 4.16Å; K151-Y182 HydrophobicContact CG-CG 4.42Å; K151-Y182 WeakPolarHBondContact O-CE1 3.42Å; V154-Y182 HydrophobicContact CB-CD1 4.29Å; V154-Y182 HydrophobicContact CB-CE1 4.06Å; V154-Y182 HydrophobicContact CG1-CD1 3.93Å; V154-Y182 HydrophobicContact CG1-CE1 3.84Å; E178-Y182 WeakPolarHBondContact O-CB 3.3Å; E178-Y182 PolarHBondContact O-N 2.93Å; L179-Y182 HydrophobicContact CD1-CD1 4.4Å; L179-Y182 PolarHBondContact O-N 3.27Å; I180-Y182 VanDerWaalsContact C-N 3.32Å; I180-Y182 PolarHBondContact O-N 3.47Å; Y182-I184 PolarHBondContact O-N 2.96Å; Y182-K185 PolarHBondContact O-N 3.35Å; Y182-A186 VanDerWaalsContact O-CB 3.24Å; Y182-A186 WeakPolarHBondContact O-CB 3.46Å; Y182-A186 PolarHBondContact O-N 3.42Å
183	C	81.5	Confident	77.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-49.2	174.6	-71.1	0	0	0	0	111.5	V154 L179 I180 K185 A186 V187 M204	V154-C183 HydrophobicContact CG1-CB 4.33Å; V154-C183 WeakPolarHBondContact CG1-SG 3.28Å; V154-C183 WeakPolarHBondContact CG2-SG 3.22Å; L179-C183 WeakPolarHBondContact O-CB 3.39Å; L179-C183 PolarHBondContact O-N 2.92Å; L179-C183 PolarHBondContact O-SG 3.17Å; I180-C183 WeakPolarHBondContact O-CB 3.45Å; I180-C183 PolarHBondContact O-N 3.23Å; C183-K185 PolarHBondContact O-N 3.28Å; C183-A186 PolarHBondContact O-N 3.36Å; C183-V187 WeakPolarHBondContact O-CB 3.38Å; C183-V187 WeakPolarHBondContact O-CG2 3.44Å; C183-V187 PolarHBondContact O-N 3.4Å; C183-M204 HydrophobicContact CB-CG 4.33Å; C183-M204 HydrophobicContact CB-SD 3.86Å
184	I	78.5	Confident	77.6	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-48.7	179.4	-69.6	170.1	0	0	0	110.2	I180 T181 Y182 V187 I188 L201 M204 A222	I180-I184 HydrophobicContact CG2-CD1 3.9Å; I180-I184 HydrophobicContact CG2-CG1 4.39Å; I180-I184 WeakPolarHBondContact O-CG1 3.28Å; I180-I184 PolarHBondContact O-N 2.89Å; T181-I184 PolarHBondContact O-N 3.32Å; Y182-I184 PolarHBondContact O-N 2.96Å; I184-V187 PolarHBondContact O-N 3.17Å; I184-I188 HydrophobicContact CG2-CD1 3.64Å; I184-I188 HydrophobicContact CG2-CG1 4.47Å; I184-I188 WeakPolarHBondContact O-CB 3.45Å; I184-I188 VanDerWaalsContact O-CG1 3.24Å; I184-I188 WeakPolarHBondContact O-CG1 3.29Å; I184-I188 PolarHBondContact O-N 3.24Å; I184-L201 HydrophobicContact CG1-CD2 4.38Å; I184-L201 HydrophobicContact CG2-CD2 4.23Å; I184-M204 HydrophobicContact CD1-CB 4.26Å; I184-M204 HydrophobicContact CG1-CB 3.96Å; I184-M204 HydrophobicContact CG1-CG 4.15Å; I184-A222 HydrophobicContact CG2-CB 4.2Å
185	K	79.3	Confident	77.6	Confident	122 Å²	122	55.1 Å²	55.1	53%	0.53	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-50.2	178.1	-72.3	175.5	-178.6	175.4	0	111.8	T181 Y182 C183 V187 I188 E189	T181-K185 HydrophobicContact CG2-CD 4.39Å; T181-K185 WeakPolarHBondContact O-CG 3.34Å; T181-K185 PolarHBondContact O-N 3.3Å; Y182-K185 PolarHBondContact O-N 3.35Å; C183-K185 PolarHBondContact O-N 3.28Å; K185-V187 VanDerWaalsContact C-N 3.31Å; K185-V187 PolarHBondContact O-N 3.25Å; K185-I188 PolarHBondContact O-N 2.98Å; K185-E189 VanDerWaalsContact O-CB 3.28Å; K185-E189 WeakPolarHBondContact O-CB 3.36Å; K185-E189 PolarHBondContact O-N 3.09Å
186	A	81	Confident	77.6	Confident	5 Å²	5	50 Å²	50	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-39.5	179.7	0	0	0	0	0	112	I158 Y182 C183 E189 F190	I158-A186 HydrophobicContact CD1-CB 3.74Å; Y182-A186 VanDerWaalsContact O-CB 3.24Å; Y182-A186 WeakPolarHBondContact O-CB 3.46Å; Y182-A186 PolarHBondContact O-N 3.42Å; C183-A186 PolarHBondContact O-N 3.36Å; A186-E189 PolarHBondContact O-N 2.76Å; A186-F190 HydrophobicContact CB-CD2 4.18Å; A186-F190 WeakPolarHBondContact O-CB 3.38Å; A186-F190 VanDerWaalsContact O-CD2 3.31Å; A186-F190 WeakPolarHBondContact O-CD2 3.43Å; A186-F190 PolarHBondContact O-N 3.46Å
187	V	80.8	Confident	77.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-43.2	177.6	167.2	0	0	0	0	111.2	I158 C183 I184 K185 V191 R197 V200 L201	I158-V187 HydrophobicContact CD1-CG2 3.71Å; I158-V187 HydrophobicContact CG1-CG2 4.03Å; C183-V187 WeakPolarHBondContact O-CB 3.38Å; C183-V187 WeakPolarHBondContact O-CG2 3.44Å; C183-V187 PolarHBondContact O-N 3.4Å; I184-V187 PolarHBondContact O-N 3.17Å; K185-V187 VanDerWaalsContact C-N 3.31Å; K185-V187 PolarHBondContact O-N 3.25Å; V187-V191 HydrophobicContact CB-CG2 4.33Å; V187-V191 HydrophobicContact CG1-CB 4.45Å; V187-V191 HydrophobicContact CG1-CG2 4.25Å; V187-V191 HydrophobicContact CG2-CG2 4.36Å; V187-V191 WeakPolarHBondContact O-CB 3.22Å; V187-V191 PolarHBondContact O-N 3.3Å; V187-R197 HydrophobicContact CG1-CB 4.3Å; V187-R197 HydrophobicContact CG1-CG 3.62Å; V187-V200 HydrophobicContact CG1-CB 4.39Å; V187-V200 HydrophobicContact CG1-CG1 4.42Å; V187-V200 HydrophobicContact CG2-CB 4.23Å; V187-V200 HydrophobicContact CG2-CG1 3.56Å; V187-L201 HydrophobicContact CB-CD2 4.46Å; V187-L201 HydrophobicContact CG1-CD2 3.93Å; V187-L201 HydrophobicContact CG1-CG 3.98Å
188	I	75.6	Confident	78.3	Confident	22 Å²	22	44.5 Å²	44.5	11%	0.113	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-39.2	177.5	-72.7	172	0	0	0	111.4	I184 K185 L201 Q221 Y225 Y767	I184-I188 HydrophobicContact CG2-CD1 3.64Å; I184-I188 HydrophobicContact CG2-CG1 4.47Å; I184-I188 WeakPolarHBondContact O-CB 3.45Å; I184-I188 VanDerWaalsContact O-CG1 3.24Å; I184-I188 WeakPolarHBondContact O-CG1 3.29Å; I184-I188 PolarHBondContact O-N 3.24Å; K185-I188 PolarHBondContact O-N 2.98Å; I188-L201 HydrophobicContact CG1-CD2 4.36Å; I188-Q221 HydrophobicContact CD1-CB 4.35Å; I188-Y225 HydrophobicContact CB-CE2 4.14Å; I188-Y225 HydrophobicContact CD1-CD2 3.94Å; I188-Y225 HydrophobicContact CD1-CE2 3.9Å; I188-Y225 HydrophobicContact CG1-CD2 3.81Å; I188-Y225 HydrophobicContact CG1-CE2 3.69Å; I188-Y225 HydrophobicContact CG2-CD2 4.42Å; I188-Y225 HydrophobicContact CG2-CE2 3.45Å; I188-Y225 VanDerWaalsContact CG2-CE2 3.45Å; I188-Y767 HydrophobicContact CG2-CE1 4.08Å
189	E	75.4	Confident	78.4	Confident	135 Å²	135	46 Å²	46	63%	0.631	22%	0.219	S	C	*	.	H	α-helix	trans	-81.4	-45	-174.2	-171.2	171.3	-179.5	0	0	113.1	K185 A186	K185-E189 VanDerWaalsContact O-CB 3.28Å; K185-E189 WeakPolarHBondContact O-CB 3.36Å; K185-E189 PolarHBondContact O-N 3.09Å; A186-E189 PolarHBondContact O-N 2.76Å
190	F	76.2	Confident	78.5	Confident	135 Å²	135	45.6 Å²	45.6	59%	0.592	22%	0.218	S	C	*	.	H	α-helix	trans	-105.2	-22.7	-169.1	-57.6	-69.1	0	0	0	114.2	A186 Q192	A186-F190 HydrophobicContact CB-CD2 4.18Å; A186-F190 WeakPolarHBondContact O-CB 3.38Å; A186-F190 VanDerWaalsContact O-CD2 3.31Å; A186-F190 WeakPolarHBondContact O-CD2 3.43Å; A186-F190 PolarHBondContact O-N 3.46Å; F190-Q192 PolarHBondContact O-N 3.26Å
191	V	76.4	Confident	78.7	Confident	13 Å²	13	45.1 Å²	45.1	8%	0.079	22%	0.215	C	C	.	.			trans	-84.6	105.3	-177.8	-174.8	0	0	0	0	111	I158 V187 H193 F196 R197	I158-V191 HydrophobicContact CG2-CG2 3.21Å; V187-V191 HydrophobicContact CB-CG2 4.33Å; V187-V191 HydrophobicContact CG1-CB 4.45Å; V187-V191 HydrophobicContact CG1-CG2 4.25Å; V187-V191 HydrophobicContact CG2-CG2 4.36Å; V187-V191 WeakPolarHBondContact O-CB 3.22Å; V187-V191 PolarHBondContact O-N 3.3Å; V191-H193 HydrophobicContact CG1-CB 4.49Å; V191-F196 HydrophobicContact CG1-CD1 3.85Å; V191-F196 HydrophobicContact CG2-CD1 4.48Å; V191-F196 HydrophobicContact CG2-CE1 4.5Å; V191-R197 HydrophobicContact CB-CB 4.29Å; V191-R197 HydrophobicContact CG1-CB 3.8Å
192	Q	70.9	Confident	78.9	Confident	90 Å²	90	46.7 Å²	46.7	42%	0.421	23%	0.225	S	C	.	.			trans	-78.3	-22.7	176.8	-62	-178.4	8.5	0	0	113.6	F190 N608	F190-Q192 PolarHBondContact O-N 3.26Å; Q192-N608 PolarHBondContact OE1-ND2 3.04Å; Q192-N608 VanDerWaalsContact OE1-ND2 3.15Å
193	H	76.4	Confident	78.8	Confident	40 Å²	40	44 Å²	44	19%	0.185	22%	0.216	C	C	.	.			trans	-86.7	117	-175.6	-174.9	-66.9	0	0	0	111.4	R161 V191 G195 F196 R197	R161-H193 PolarHBondContact NH2-CD2 3.36Å; V191-H193 HydrophobicContact CG1-CB 4.49Å; H193-G195 PolarHBondContact ND1-N 2.75Å; H193-G195 VanDerWaalsContact ND1-N 3.16Å; H193-G195 PolarHBondContact O-N 3.34Å; H193-F196 PolarHBondContact ND1-N 3.43Å; H193-F196 VanDerWaalsContact ND1-N 3.15Å; H193-R197 VanDerWaalsContact O-CB 3.26Å; H193-R197 WeakPolarHBondContact O-CB 3.29Å; H193-R197 PolarHBondContact O-N 2.99Å
194	R	76.8	Confident	78.7	Confident	38 Å²	38	44 Å²	44	14%	0.143	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-45.6	-173.2	-171.2	179.4	-173.7	-178.6	6.8	112.5	R197 N198 E227 L573 E574 E575	R194-R197 WeakPolarHBondContact O-CB 3.38Å; R194-R197 PolarHBondContact O-N 2.98Å; R194-N198 WeakPolarHBondContact O-CB 3.38Å; R194-N198 VanDerWaalsContact O-CG 3.25Å; R194-N198 PolarHBondContact O-N 3.42Å; R194-N198 PolarHBondContact O-OD1 2.81Å; R194-E227 IonicContact CZ-OE1 3.55Å; R194-E227 IonicContact NH2-OE1 2.72Å; R194-E227 PolarHBondContact NH2-OE1 3.18Å; R194-E227 IonicContact NH2-OE2 2.71Å; R194-E227 PolarHBondContact NH2-OE2 2.74Å; R194-E227 VanDerWaalsContact NH2-OE2 3.13Å; R194-L573 HydrophobicContact CB-CD1 4.26Å; R194-E574 WeakPolarHBondContact CB-OE1 3.37Å; R194-E574 PolarHBondContact N-OE1 2.84Å; R194-E575 IonicContact CZ-OE1 2.7Å; R194-E575 IonicContact NH1-OE1 3.79Å; R194-E575 PolarHBondContact NH1-OE1 3.48Å; R194-E575 IonicContact NH1-OE2 3.96Å
195	G	77.1	Confident	78.4	Confident	33 Å²	33	45.1 Å²	45.1	34%	0.34	22%	0.222	S	C	.	.	H	α-helix	trans	-58.9	-54.5	-177.7	0	0	0	0	0	113.7	H193 N198 Q199	H193-G195 PolarHBondContact ND1-N 2.75Å; H193-G195 VanDerWaalsContact ND1-N 3.16Å; H193-G195 PolarHBondContact O-N 3.34Å; G195-N198 PolarHBondContact O-N 3.23Å; G195-Q199 WeakPolarHBondContact O-CG 3.27Å; G195-Q199 PolarHBondContact O-N 3.26Å; G195-Q199 VanDerWaalsContact O-N 3.08Å
196	F	79.1	Confident	78.3	Confident	16 Å²	16	46.7 Å²	46.7	7%	0.07	23%	0.229	C	C	.	.	H	α-helix	trans	-61	-43.7	174.8	-178.6	-111.2	0	0	0	112.6	R161 V191 H193 N198 Q199 V200	R161-F196 VanDerWaalsContact CA-CZ 3.48Å; R161-F196 HydrophobicContact CB-CD1 4.46Å; R161-F196 HydrophobicContact CB-CD2 4.05Å; R161-F196 HydrophobicContact CB-CE1 4.33Å; R161-F196 HydrophobicContact CB-CE2 3.91Å; R161-F196 HydrophobicContact CB-CG 4.34Å; R161-F196 HydrophobicContact CB-CZ 4.08Å; R161-F196 HydrophobicContact CG-CD1 4.05Å; R161-F196 HydrophobicContact CG-CD2 4.39Å; R161-F196 HydrophobicContact CG-CE1 4.19Å; R161-F196 HydrophobicContact CG-CG 4.17Å; R161-F196 HydrophobicContact CG-CZ 4.44Å; V191-F196 HydrophobicContact CG1-CD1 3.85Å; V191-F196 HydrophobicContact CG2-CD1 4.48Å; V191-F196 HydrophobicContact CG2-CE1 4.5Å; H193-F196 PolarHBondContact ND1-N 3.43Å; H193-F196 VanDerWaalsContact ND1-N 3.15Å; F196-N198 VanDerWaalsContact C-N 3.32Å; F196-N198 PolarHBondContact O-N 3.17Å; F196-Q199 PolarHBondContact O-N 3.45Å; F196-V200 HydrophobicContact CD1-CG2 4.36Å; F196-V200 HydrophobicContact CD2-CG2 4.27Å; F196-V200 HydrophobicContact CE1-CG2 3.89Å; F196-V200 HydrophobicContact CE2-CG2 3.78Å; F196-V200 HydrophobicContact CZ-CG2 3.55Å; F196-V200 WeakPolarHBondContact O-CG2 3.35Å; F196-V200 PolarHBondContact O-N 2.58Å
197	R	82	Confident	77.9	Confident	24 Å²	24	49.4 Å²	49.4	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-53.7	-49.9	175.2	-179.3	174.3	68.8	-161.1	1.2	111.3	V187 V191 H193 R194 Q199 V200 L201	V187-R197 HydrophobicContact CG1-CB 4.3Å; V187-R197 HydrophobicContact CG1-CG 3.62Å; V191-R197 HydrophobicContact CB-CB 4.29Å; V191-R197 HydrophobicContact CG1-CB 3.8Å; H193-R197 VanDerWaalsContact O-CB 3.26Å; H193-R197 WeakPolarHBondContact O-CB 3.29Å; H193-R197 PolarHBondContact O-N 2.99Å; R194-R197 WeakPolarHBondContact O-CB 3.38Å; R194-R197 PolarHBondContact O-N 2.98Å; R197-Q199 PolarHBondContact O-N 2.9Å; R197-V200 PolarHBondContact O-N 3.34Å; R197-L201 HydrophobicContact CG-CD1 3.86Å; R197-L201 HydrophobicContact CG-CG 4.3Å; R197-L201 VanDerWaalsContact O-CG 3.3Å; R197-L201 WeakPolarHBondContact O-CG 3.43Å; R197-L201 PolarHBondContact O-N 3.3Å
198	N	82.4	Confident	77.4	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.203	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-40.7	-178.5	-71.2	10.2	0	0	0	111.9	R194 G195 F196 V200 L201 V202 L226	R194-N198 WeakPolarHBondContact O-CB 3.38Å; R194-N198 VanDerWaalsContact O-CG 3.25Å; R194-N198 PolarHBondContact O-N 3.42Å; R194-N198 PolarHBondContact O-OD1 2.81Å; G195-N198 PolarHBondContact O-N 3.23Å; F196-N198 VanDerWaalsContact C-N 3.32Å; F196-N198 PolarHBondContact O-N 3.17Å; N198-V200 VanDerWaalsContact C-N 3.35Å; N198-V200 PolarHBondContact O-N 3.41Å; N198-L201 PolarHBondContact O-N 2.86Å; N198-V202 WeakPolarHBondContact O-CB 3.34Å; N198-V202 VanDerWaalsContact O-CG2 3.25Å; N198-V202 WeakPolarHBondContact O-CG2 3.4Å; N198-V202 PolarHBondContact O-N 3.25Å; N198-L226 HydrophobicContact CB-CD2 3.67Å
199	Q	82	Confident	76.7	Confident	124 Å²	124	51.5 Å²	51.5	58%	0.579	26%	0.264	S	S	*	.	H	α-helix	trans	-59.7	-45	175.4	-72.4	174.2	-0.3	0	0	112	L163 G195 F196 R197 D203	L163-Q199 HydrophobicContact CD1-CB 4.44Å; G195-Q199 WeakPolarHBondContact O-CG 3.27Å; G195-Q199 PolarHBondContact O-N 3.26Å; G195-Q199 VanDerWaalsContact O-N 3.08Å; F196-Q199 PolarHBondContact O-N 3.45Å; R197-Q199 PolarHBondContact O-N 2.9Å; Q199-D203 PolarHBondContact O-N 3.01Å; Q199-D203 VanDerWaalsContact O-N 3.14Å
200	V	82.6	Confident	75.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-46.9	178.6	178.8	0	0	0	0	110.8	L163 L166 V187 F196 R197 N198 V202 D203 M204	L163-V200 HydrophobicContact CD1-CG2 4.15Å; L166-V200 HydrophobicContact CD2-CB 4.48Å; L166-V200 HydrophobicContact CD2-CG1 3.5Å; L166-V200 HydrophobicContact CD2-CG2 4.18Å; V187-V200 HydrophobicContact CG1-CB 4.39Å; V187-V200 HydrophobicContact CG1-CG1 4.42Å; V187-V200 HydrophobicContact CG2-CB 4.23Å; V187-V200 HydrophobicContact CG2-CG1 3.56Å; F196-V200 HydrophobicContact CD1-CG2 4.36Å; F196-V200 HydrophobicContact CD2-CG2 4.27Å; F196-V200 HydrophobicContact CE1-CG2 3.89Å; F196-V200 HydrophobicContact CE2-CG2 3.78Å; F196-V200 HydrophobicContact CZ-CG2 3.55Å; F196-V200 WeakPolarHBondContact O-CG2 3.35Å; F196-V200 PolarHBondContact O-N 2.58Å; R197-V200 PolarHBondContact O-N 3.34Å; N198-V200 VanDerWaalsContact C-N 3.35Å; N198-V200 PolarHBondContact O-N 3.41Å; V200-V202 PolarHBondContact O-N 3.37Å; V200-D203 PolarHBondContact O-N 3.35Å; V200-D203 VanDerWaalsContact O-N 3.17Å; V200-M204 HydrophobicContact CG1-CE 4.23Å; V200-M204 HydrophobicContact CG1-CG 4.11Å; V200-M204 VanDerWaalsContact O-CG 3.28Å; V200-M204 WeakPolarHBondContact O-CG 3.48Å; V200-M204 PolarHBondContact O-N 3.09Å
201	L	80.8	Confident	74.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-42.3	179.7	-68.6	177.1	0	0	0	112.1	I184 V187 I188 R197 N198 D203 M204 I205 A222 Y225 L226	I184-L201 HydrophobicContact CG1-CD2 4.38Å; I184-L201 HydrophobicContact CG2-CD2 4.23Å; V187-L201 HydrophobicContact CB-CD2 4.46Å; V187-L201 HydrophobicContact CG1-CD2 3.93Å; V187-L201 HydrophobicContact CG1-CG 3.98Å; I188-L201 HydrophobicContact CG1-CD2 4.36Å; R197-L201 HydrophobicContact CG-CD1 3.86Å; R197-L201 HydrophobicContact CG-CG 4.3Å; R197-L201 VanDerWaalsContact O-CG 3.3Å; R197-L201 WeakPolarHBondContact O-CG 3.43Å; R197-L201 PolarHBondContact O-N 3.3Å; N198-L201 PolarHBondContact O-N 2.86Å; L201-D203 VanDerWaalsContact C-N 3.33Å; L201-D203 PolarHBondContact O-N 2.79Å; L201-M204 PolarHBondContact O-N 3.26Å; L201-I205 WeakPolarHBondContact O-CB 3.5Å; L201-I205 WeakPolarHBondContact O-CD1 3.28Å; L201-I205 VanDerWaalsContact O-CG1 3.23Å; L201-I205 WeakPolarHBondContact O-CG1 3.29Å; L201-I205 PolarHBondContact O-N 3.46Å; L201-A222 HydrophobicContact CB-CB 4.46Å; L201-A222 HydrophobicContact CD2-CB 3.86Å; L201-Y225 HydrophobicContact CD1-CG 4.37Å; L201-L226 HydrophobicContact CB-CD1 4.21Å; L201-L226 HydrophobicContact CB-CD2 4.11Å; L201-L226 HydrophobicContact CB-CG 4.21Å
202	V	80.9	Confident	73.7	Confident	56 Å²	56	55.3 Å²	55.3	34%	0.339	30%	0.296	S	S	.	.	H	α-helix	trans	-59.9	-44.3	174.7	169.6	0	0	0	0	111.1	N198 V200 K206 L226	N198-V202 WeakPolarHBondContact O-CB 3.34Å; N198-V202 VanDerWaalsContact O-CG2 3.25Å; N198-V202 WeakPolarHBondContact O-CG2 3.4Å; N198-V202 PolarHBondContact O-N 3.25Å; V200-V202 PolarHBondContact O-N 3.37Å; V202-K206 HydrophobicContact CG1-CD 4.1Å; V202-K206 VanDerWaalsContact O-CG 3.31Å; V202-K206 WeakPolarHBondContact O-CG 3.41Å; V202-K206 PolarHBondContact O-N 2.87Å; V202-K206 VanDerWaalsContact O-N 3.08Å; V202-L226 HydrophobicContact CG2-CD1 3.62Å; V202-L226 HydrophobicContact CG2-CD2 3.72Å; V202-L226 HydrophobicContact CG2-CG 4.32Å
203	D	78.3	Confident	73	Confident	29 Å²	29	57.4 Å²	57.4	16%	0.155	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-41.8	177.6	-163.8	59.4	0	0	0	111.7	Q167 Q199 V200 L201 K206 R207	Q167-D203 WeakPolarHBondContact CG-OD2 3.22Å; Q167-D203 PolarHBondContact NE2-OD1 2.69Å; Q167-D203 PolarHBondContact NE2-OD2 2.93Å; Q167-D203 VanDerWaalsContact NE2-OD2 3.15Å; Q199-D203 PolarHBondContact O-N 3.01Å; Q199-D203 VanDerWaalsContact O-N 3.14Å; V200-D203 PolarHBondContact O-N 3.35Å; V200-D203 VanDerWaalsContact O-N 3.17Å; L201-D203 VanDerWaalsContact C-N 3.33Å; L201-D203 PolarHBondContact O-N 2.79Å; D203-K206 PolarHBondContact O-N 3.39Å; D203-R207 WeakPolarHBondContact O-CG 3.27Å; D203-R207 PolarHBondContact O-N 3.22Å; D203-R207 IonicContact OD1-NE 3.4Å; D203-R207 IonicContact OD2-NE 3.35Å; D203-R207 PolarHBondContact OD2-NE 2.85Å
204	M	79.4	Confident	72.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-43.8	177.9	-66.2	-45.3	93.7	0	0	111.9	L166 L170 I180 C183 I184 V200 L201 R207 L208	L166-M204 HydrophobicContact CD2-CE 4Å; L170-M204 HydrophobicContact CD1-CE 3.37Å; L170-M204 HydrophobicContact CD1-SD 3.46Å; L170-M204 WeakPolarHBondContact CD1-SD 3.5Å; I180-M204 HydrophobicContact CG2-CB 4.23Å; C183-M204 HydrophobicContact CB-CG 4.33Å; C183-M204 HydrophobicContact CB-SD 3.86Å; I184-M204 HydrophobicContact CD1-CB 4.26Å; I184-M204 HydrophobicContact CG1-CB 3.96Å; I184-M204 HydrophobicContact CG1-CG 4.15Å; V200-M204 HydrophobicContact CG1-CE 4.23Å; V200-M204 HydrophobicContact CG1-CG 4.11Å; V200-M204 VanDerWaalsContact O-CG 3.28Å; V200-M204 WeakPolarHBondContact O-CG 3.48Å; V200-M204 PolarHBondContact O-N 3.09Å; L201-M204 PolarHBondContact O-N 3.26Å; M204-R207 PolarHBondContact O-N 2.64Å; M204-L208 WeakPolarHBondContact O-CB 3.26Å; M204-L208 PolarHBondContact O-N 3.15Å
205	I	74	Confident	71.8	Confident	27 Å²	27	56.9 Å²	56.9	14%	0.138	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-44.4	179.9	-68.1	163.9	0	0	0	110.9	L201 R207 L208 G209 I219 A222 L223 L226	L201-I205 WeakPolarHBondContact O-CB 3.5Å; L201-I205 WeakPolarHBondContact O-CD1 3.28Å; L201-I205 VanDerWaalsContact O-CG1 3.23Å; L201-I205 WeakPolarHBondContact O-CG1 3.29Å; L201-I205 PolarHBondContact O-N 3.46Å; I205-R207 PolarHBondContact O-N 3.19Å; I205-L208 PolarHBondContact O-N 3.11Å; I205-L208 VanDerWaalsContact O-N 3.15Å; I205-G209 PolarHBondContact O-N 3.46Å; I205-I219 HydrophobicContact CG2-CG2 4.42Å; I205-A222 HydrophobicContact CD1-CB 3.72Å; I205-A222 HydrophobicContact CG1-CB 3.99Å; I205-L223 HydrophobicContact CD1-CD2 3.73Å; I205-L223 HydrophobicContact CD1-CG 3.95Å; I205-L223 HydrophobicContact CG2-CD2 4.42Å; I205-L226 HydrophobicContact CD1-CD1 3.41Å; I205-L226 VanDerWaalsContact CD1-CD1 3.41Å
206	K	76.5	Confident	71.4	Confident	156 Å²	156	57.8 Å²	57.8	68%	0.678	31%	0.306	S	S	*	.	H	α-helix	trans	-57.6	-37.1	176.4	-76.4	175.3	179.7	178.2	0	112.3	V202 D203	V202-K206 HydrophobicContact CG1-CD 4.1Å; V202-K206 VanDerWaalsContact O-CG 3.31Å; V202-K206 WeakPolarHBondContact O-CG 3.41Å; V202-K206 PolarHBondContact O-N 2.87Å; V202-K206 VanDerWaalsContact O-N 3.08Å; D203-K206 PolarHBondContact O-N 3.39Å
207	R	73	Confident	71.1	Confident	62 Å²	62	59.5 Å²	59.5	23%	0.234	32%	0.316	C	S	.	.	H	α-helix	trans	-73.3	-42	176.9	-70.9	170.1	174	-84.2	5.7	111.5	D171 I180 D203 M204 I205 S210	D171-R207 IonicContact OD1-CZ 3.92Å; D171-R207 IonicContact OD1-NH1 3.76Å; D171-R207 PolarHBondContact OD1-NH1 2.98Å; D171-R207 IonicContact OD1-NH2 3.26Å; D171-R207 IonicContact OD2-NH1 2.59Å; D171-R207 IonicContact OD2-NH2 2.64Å; D171-R207 PolarHBondContact OD2-NH2 2.96Å; I180-R207 HydrophobicContact CD1-CB 4.26Å; D203-R207 WeakPolarHBondContact O-CG 3.27Å; D203-R207 PolarHBondContact O-N 3.22Å; D203-R207 IonicContact OD1-NE 3.4Å; D203-R207 IonicContact OD2-NE 3.35Å; D203-R207 PolarHBondContact OD2-NE 2.85Å; M204-R207 PolarHBondContact O-N 2.64Å; I205-R207 PolarHBondContact O-N 3.19Å; R207-S210 PolarHBondContact O-OG 2.95Å
208	L	69.1	Low	70.5	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-71.3	-38.4	-176.9	-171.4	55.4	0	0	0	113.3	L177 I180 M204 I205 S210 T211 S214 I219	L177-L208 HydrophobicContact CD1-CD1 3.4Å; L177-L208 VanDerWaalsContact CD1-CD1 3.4Å; I180-L208 HydrophobicContact CG2-CB 4.4Å; I180-L208 HydrophobicContact CG2-CD2 4.35Å; M204-L208 WeakPolarHBondContact O-CB 3.26Å; M204-L208 PolarHBondContact O-N 3.15Å; I205-L208 PolarHBondContact O-N 3.11Å; I205-L208 VanDerWaalsContact O-N 3.15Å; L208-S210 PolarHBondContact O-N 3Å; L208-T211 PolarHBondContact O-N 3.39Å; L208-S214 PolarHBondContact O-OG 3.44Å; L208-I219 HydrophobicContact CD2-CD1 3.57Å; L208-I219 HydrophobicContact CD2-CG1 3.28Å; L208-I219 HydrophobicContact CG-CD1 3.85Å; L208-I219 HydrophobicContact CG-CG1 4.04Å
209	G	62.4	Low	70	Confident	64 Å²	64	57.3 Å²	57.3	66%	0.66	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-9.2	179.8	0	0	0	0	0	115.4	I205	I205-G209 PolarHBondContact O-N 3.46Å
210	S	54.3	Low	69.5	Low	103 Å²	103	51.4 Å²	51.4	72%	0.72	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.4	173.1	64.7	0	0	0	0	114.9	R207 L208	R207-S210 PolarHBondContact O-OG 2.95Å; L208-S210 PolarHBondContact O-N 3Å
211	T	56	Low	69.1	Low	64 Å²	64	53 Å²	53	39%	0.393	29%	0.287	S	S	.	.			trans	-115.5	131.6	-169.5	-51.3	0	0	0	0	113.1	L208 N213 S214	L208-T211 PolarHBondContact O-N 3.39Å; T211-N213 VanDerWaalsContact C-N 3.32Å; T211-N213 PolarHBondContact O-N 3.24Å; T211-S214 PolarHBondContact O-OG 3.05Å
212	K	53.4	Low	68.6	Low	197 Å²	197	53 Å²	53	86%	0.857	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-30.5	177.8	-72.9	-173	174.2	-172.7	0	114.4	S214	K212-S214 PolarHBondContact O-N 3.24Å
213	N	56.1	Low	68.3	Low	133 Å²	133	50.6 Å²	50.6	71%	0.711	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	52.1	179.5	-66.7	-0.6	0	0	0	111	L177 T211	L177-N213 WeakPolarHBondContact CD2-O 3.26Å; T211-N213 VanDerWaalsContact C-N 3.32Å; T211-N213 PolarHBondContact O-N 3.24Å
214	S	61.8	Low	68	Low	15 Å²	15	50.4 Å²	50.4	11%	0.105	27%	0.27	C	S	.	.			trans	-73.1	139.7	-177.7	-76	0	0	0	0	111.8	L208 T211 K212 Y216	L208-S214 PolarHBondContact O-OG 3.44Å; T211-S214 PolarHBondContact O-OG 3.05Å; K212-S214 PolarHBondContact O-N 3.24Å; S214-Y216 VanDerWaalsContact C-N 3.27Å; S214-Y216 WeakPolarHBondContact O-CD2 3.19Å; S214-Y216 PolarHBondContact O-N 3.28Å
215	D	67.8	Low	67.7	Low	52 Å²	52	52.6 Å²	52.6	28%	0.278	28%	0.279	S	S	.	.			trans	-73.2	84.4	167	-179.8	4.5	0	0	0	109.1	N217 G218 I219	D215-N217 PolarHBondContact O-N 3.48Å; D215-N217 WeakPolarHBondContact OD1-CB 3.37Å; D215-N217 PolarHBondContact OD1-N 2.87Å; D215-G218 PolarHBondContact O-N 2.88Å; D215-G218 PolarHBondContact OD1-N 3.14Å; D215-I219 WeakPolarHBondContact O-CG1 3.43Å; D215-I219 PolarHBondContact O-N 3.28Å
216	Y	68.6	Low	67.8	Low	53 Å²	53	53 Å²	53	21%	0.208	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-31.7	179.4	-66.3	-71.1	0	0	0	112.7	S214 I219 C220 I235 L239	S214-Y216 VanDerWaalsContact C-N 3.27Å; S214-Y216 WeakPolarHBondContact O-CD2 3.19Å; S214-Y216 PolarHBondContact O-N 3.28Å; Y216-I219 PolarHBondContact O-N 3.2Å; Y216-C220 WeakPolarHBondContact O-CB 3.27Å; Y216-C220 PolarHBondContact O-N 3.14Å; Y216-C220 PolarHBondContact O-SG 3.04Å; Y216-C220 VanDerWaalsContact O-SG 3.36Å; Y216-I235 HydrophobicContact CD1-CG2 3.45Å; Y216-I235 VanDerWaalsContact CD1-CG2 3.45Å; Y216-I235 HydrophobicContact CE1-CG2 4.04Å; Y216-I235 HydrophobicContact CG-CG2 4.27Å; Y216-L239 HydrophobicContact CD2-CD2 4.09Å; Y216-L239 HydrophobicContact CE1-CD2 4.48Å; Y216-L239 HydrophobicContact CE2-CD2 3.76Å; Y216-L239 HydrophobicContact CG-CD1 4.36Å
217	N	72.9	Confident	67.8	Low	52 Å²	52	51.3 Å²	51.3	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-68.3	-49	177.8	-166.7	0.4	0	0	0	110.6	D215 I219 C220 Q221 L253	D215-N217 PolarHBondContact O-N 3.48Å; D215-N217 WeakPolarHBondContact OD1-CB 3.37Å; D215-N217 PolarHBondContact OD1-N 2.87Å; N217-I219 VanDerWaalsContact C-N 3.31Å; N217-I219 PolarHBondContact O-N 3.45Å; N217-C220 PolarHBondContact O-N 3.38Å; N217-Q221 WeakPolarHBondContact O-CB 3.45Å; N217-Q221 WeakPolarHBondContact O-CG 3.36Å; N217-Q221 PolarHBondContact O-N 2.8Å; N217-Q221 PolarHBondContact OD1-NE2 3.4Å; N217-L253 HydrophobicContact CB-CD1 4.36Å
218	G	69.2	Low	68.2	Low	6 Å²	6	50.8 Å²	50.8	6%	0.062	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-41.4	173.2	0	0	0	0	0	113.1	D215 Q221 A222	D215-G218 PolarHBondContact O-N 2.88Å; D215-G218 PolarHBondContact OD1-N 3.14Å; G218-Q221 PolarHBondContact O-N 3.39Å; G218-A222 WeakPolarHBondContact O-CB 3.41Å; G218-A222 PolarHBondContact O-N 2.84Å
219	I	70.6	Confident	68.8	Low	9 Å²	9	52 Å²	52	5%	0.046	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-51.9	176.9	-64.5	163.6	0	0	0	111.1	I205 L208 D215 Y216 N217 Q221 A222 L223 I235	I205-I219 HydrophobicContact CG2-CG2 4.42Å; L208-I219 HydrophobicContact CD2-CD1 3.57Å; L208-I219 HydrophobicContact CD2-CG1 3.28Å; L208-I219 HydrophobicContact CG-CD1 3.85Å; L208-I219 HydrophobicContact CG-CG1 4.04Å; D215-I219 WeakPolarHBondContact O-CG1 3.43Å; D215-I219 PolarHBondContact O-N 3.28Å; Y216-I219 PolarHBondContact O-N 3.2Å; N217-I219 VanDerWaalsContact C-N 3.31Å; N217-I219 PolarHBondContact O-N 3.45Å; I219-Q221 PolarHBondContact O-N 2.84Å; I219-A222 CarbonylContact O-C 3.47Å; I219-A222 WeakPolarHBondContact O-CA 3.31Å; I219-A222 WeakPolarHBondContact O-CB 3.42Å; I219-A222 PolarHBondContact O-N 3.26Å; I219-L223 HydrophobicContact CG2-CD1 3.65Å; I219-L223 HydrophobicContact CG2-CG 4.01Å; I219-L223 WeakPolarHBondContact O-CB 3.42Å; I219-L223 WeakPolarHBondContact O-CG 3.37Å; I219-L223 PolarHBondContact O-N 2.94Å; I219-I235 HydrophobicContact CB-CD1 4.34Å; I219-I235 HydrophobicContact CG2-CD1 3.48Å; I219-I235 VanDerWaalsContact CG2-CD1 3.48Å
220	C	72	Confident	69.9	Low	1 Å²	1	55.4 Å²	55.4	1%	0.007	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-34.6	-179	-74.3	0	0	0	0	112	Y216 N217 K224 L253 I257	Y216-C220 WeakPolarHBondContact O-CB 3.27Å; Y216-C220 PolarHBondContact O-N 3.14Å; Y216-C220 PolarHBondContact O-SG 3.04Å; Y216-C220 VanDerWaalsContact O-SG 3.36Å; N217-C220 PolarHBondContact O-N 3.38Å; C220-K224 WeakPolarHBondContact O-CB 3.44Å; C220-K224 PolarHBondContact O-N 3.38Å; C220-L253 HydrophobicContact CB-CD1 3.96Å; C220-L253 HydrophobicContact CB-CD2 4.49Å; C220-L253 HydrophobicContact CB-CG 4.41Å; C220-I257 HydrophobicContact CB-CD1 3.66Å; C220-I257 HydrophobicContact CB-CG1 4.15Å
221	Q	73.5	Confident	71.1	Confident	34 Å²	34	52.4 Å²	52.4	16%	0.159	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-43.7	171.3	-72.3	174.3	35.5	0	0	112	I188 N217 G218 I219 Y225 M765 Y767	I188-Q221 HydrophobicContact CD1-CB 4.35Å; N217-Q221 WeakPolarHBondContact O-CB 3.45Å; N217-Q221 WeakPolarHBondContact O-CG 3.36Å; N217-Q221 PolarHBondContact O-N 2.8Å; N217-Q221 PolarHBondContact OD1-NE2 3.4Å; G218-Q221 PolarHBondContact O-N 3.39Å; I219-Q221 PolarHBondContact O-N 2.84Å; Q221-Y225 WeakPolarHBondContact O-CD2 3.33Å; Q221-Y225 PolarHBondContact O-N 3.15Å; Q221-M765 HydrophobicContact CG-SD 4.47Å; Q221-M765 PolarHBondContact NE2-SD 2.9Å; Q221-Y767 PolarHBondContact OE1-OH 3.02Å
222	A	71.2	Confident	72.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-45.9	176.2	0	0	0	0	0	111.9	I184 L201 I205 G218 I219 K224 Y225 L226	I184-A222 HydrophobicContact CG2-CB 4.2Å; L201-A222 HydrophobicContact CB-CB 4.46Å; L201-A222 HydrophobicContact CD2-CB 3.86Å; I205-A222 HydrophobicContact CD1-CB 3.72Å; I205-A222 HydrophobicContact CG1-CB 3.99Å; G218-A222 WeakPolarHBondContact O-CB 3.41Å; G218-A222 PolarHBondContact O-N 2.84Å; I219-A222 CarbonylContact O-C 3.47Å; I219-A222 WeakPolarHBondContact O-CA 3.31Å; I219-A222 WeakPolarHBondContact O-CB 3.42Å; I219-A222 PolarHBondContact O-N 3.26Å; A222-K224 VanDerWaalsContact C-N 3.28Å; A222-K224 PolarHBondContact O-N 2.92Å; A222-Y225 PolarHBondContact O-N 3.05Å; A222-Y225 VanDerWaalsContact O-N 3.09Å; A222-L226 WeakPolarHBondContact O-CG 3.36Å; A222-L226 PolarHBondContact O-N 3.42Å; A222-L226 VanDerWaalsContact O-N 3.13Å
223	L	73.6	Confident	74	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-35.8	177.7	-73.4	173	0	0	0	112.7	I205 I219 Y225 L226 E227 D228 C231 V232 I235	I205-L223 HydrophobicContact CD1-CD2 3.73Å; I205-L223 HydrophobicContact CD1-CG 3.95Å; I205-L223 HydrophobicContact CG2-CD2 4.42Å; I219-L223 HydrophobicContact CG2-CD1 3.65Å; I219-L223 HydrophobicContact CG2-CG 4.01Å; I219-L223 WeakPolarHBondContact O-CB 3.42Å; I219-L223 WeakPolarHBondContact O-CG 3.37Å; I219-L223 PolarHBondContact O-N 2.94Å; L223-Y225 PolarHBondContact O-N 3.17Å; L223-L226 CarbonylContact O-C 3.57Å; L223-L226 WeakPolarHBondContact O-CA 3.28Å; L223-L226 WeakPolarHBondContact O-CB 3.34Å; L223-L226 PolarHBondContact O-N 3.43Å; L223-L226 VanDerWaalsContact O-N 3.16Å; L223-E227 PolarHBondContact O-N 2.74Å; L223-D228 HydrophobicContact CD2-CB 4.14Å; L223-D228 PolarHBondContact O-N 3.41Å; L223-C231 HydrophobicContact CD1-CB 3.65Å; L223-C231 HydrophobicContact CD2-CB 3.62Å; L223-C231 HydrophobicContact CG-CB 4.29Å; L223-V232 HydrophobicContact CB-CG2 3.64Å; L223-V232 HydrophobicContact CD1-CG2 3.68Å; L223-V232 HydrophobicContact CG-CG2 4.33Å; L223-I235 HydrophobicContact CD1-CD1 3.65Å
224	K	73.9	Confident	75.3	Confident	26 Å²	26	40 Å²	40	11%	0.113	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-43.8	172.3	174.9	-164.3	168.3	-172.6	0	112.3	C220 A222 L226 E227 S260 S261 F265	C220-K224 WeakPolarHBondContact O-CB 3.44Å; C220-K224 PolarHBondContact O-N 3.38Å; A222-K224 VanDerWaalsContact C-N 3.28Å; A222-K224 PolarHBondContact O-N 2.92Å; K224-L226 PolarHBondContact O-N 3.12Å; K224-E227 PolarHBondContact O-N 2.9Å; K224-S260 WeakPolarHBondContact CE-O 3.3Å; K224-S260 VanDerWaalsContact NZ-C 3.31Å; K224-S260 PolarHBondContact NZ-O 3.46Å; K224-S260 PolarHBondContact NZ-OG 2.92Å; K224-S261 WeakPolarHBondContact CD-OG 3.49Å; K224-F265 HydrophobicContact CB-CE1 4.33Å; K224-F265 HydrophobicContact CB-CZ 4.22Å; K224-F265 HydrophobicContact CG-CE1 4.5Å
225	Y	73	Confident	76.2	Confident	45 Å²	45	40.5 Å²	40.5	18%	0.176	20%	0.201	C	C	.	.	H	α-helix	trans	-67.8	-27.9	175.9	-85.2	-75	0	0	0	113.3	I188 L201 Q221 A222 L223 Y767	I188-Y225 HydrophobicContact CB-CE2 4.14Å; I188-Y225 HydrophobicContact CD1-CD2 3.94Å; I188-Y225 HydrophobicContact CD1-CE2 3.9Å; I188-Y225 HydrophobicContact CG1-CD2 3.81Å; I188-Y225 HydrophobicContact CG1-CE2 3.69Å; I188-Y225 HydrophobicContact CG2-CD2 4.42Å; I188-Y225 HydrophobicContact CG2-CE2 3.45Å; I188-Y225 VanDerWaalsContact CG2-CE2 3.45Å; L201-Y225 HydrophobicContact CD1-CG 4.37Å; Q221-Y225 WeakPolarHBondContact O-CD2 3.33Å; Q221-Y225 PolarHBondContact O-N 3.15Å; A222-Y225 PolarHBondContact O-N 3.05Å; A222-Y225 VanDerWaalsContact O-N 3.09Å; L223-Y225 PolarHBondContact O-N 3.17Å; Y225-Y767 HydrophobicContact CE2-CD1 4.3Å; Y225-Y767 AromaticContact CE2-CE1 3.55Å; Y225-Y767 HydrophobicContact CE2-CE1 3.55Å; Y225-Y767 AromaticContact CZ-CE1 3.77Å; Y225-Y767 WeakPolarHBondContact OH-CD1 3.28Å; Y225-Y767 VanDerWaalsContact OH-CE1 3.24Å; Y225-Y767 WeakPolarHBondContact OH-CE1 3.46Å
226	L	76.1	Confident	77.1	Confident	37 Å²	37	38 Å²	38	19%	0.194	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-7.8	171.7	-62.6	178	0	0	0	112.8	N198 L201 V202 I205 A222 L223 K224 D228	N198-L226 HydrophobicContact CB-CD2 3.67Å; L201-L226 HydrophobicContact CB-CD1 4.21Å; L201-L226 HydrophobicContact CB-CD2 4.11Å; L201-L226 HydrophobicContact CB-CG 4.21Å; V202-L226 HydrophobicContact CG2-CD1 3.62Å; V202-L226 HydrophobicContact CG2-CD2 3.72Å; V202-L226 HydrophobicContact CG2-CG 4.32Å; I205-L226 HydrophobicContact CD1-CD1 3.41Å; I205-L226 VanDerWaalsContact CD1-CD1 3.41Å; A222-L226 WeakPolarHBondContact O-CG 3.36Å; A222-L226 PolarHBondContact O-N 3.42Å; A222-L226 VanDerWaalsContact O-N 3.13Å; L223-L226 CarbonylContact O-C 3.57Å; L223-L226 WeakPolarHBondContact O-CA 3.28Å; L223-L226 WeakPolarHBondContact O-CB 3.34Å; L223-L226 PolarHBondContact O-N 3.43Å; L223-L226 VanDerWaalsContact O-N 3.16Å; K224-L226 PolarHBondContact O-N 3.12Å; L226-D228 HydrophobicContact CB-CB 4.46Å; L226-D228 PolarHBondContact O-N 3.12Å
227	E	74.8	Confident	77.8	Confident	120 Å²	120	36.9 Å²	36.9	56%	0.561	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	38.2	-175.8	-63.1	174.1	176.8	0	0	112.2	R194 L223 K224 P229	R194-E227 IonicContact CZ-OE1 3.55Å; R194-E227 IonicContact NH2-OE1 2.72Å; R194-E227 PolarHBondContact NH2-OE1 3.18Å; R194-E227 IonicContact NH2-OE2 2.71Å; R194-E227 PolarHBondContact NH2-OE2 2.74Å; R194-E227 VanDerWaalsContact NH2-OE2 3.13Å; L223-E227 PolarHBondContact O-N 2.74Å; K224-E227 PolarHBondContact O-N 2.9Å; E227-P229 WeakPolarHBondContact O-CD 3.2Å
228	D	81.9	Confident	78.3	Confident	51 Å²	51	38.8 Å²	38.8	27%	0.273	19%	0.193	S	C	.	.			trans	-103.6	91.8	179.4	-169.2	-23.3	0	0	0	111.5	L223 L226 E230 C231	L223-D228 HydrophobicContact CD2-CB 4.14Å; L223-D228 PolarHBondContact O-N 3.41Å; L226-D228 HydrophobicContact CB-CB 4.46Å; L226-D228 PolarHBondContact O-N 3.12Å; D228-E230 VanDerWaalsContact C-N 3.33Å; D228-E230 PolarHBondContact OD1-N 3.43Å; D228-E230 VanDerWaalsContact OD1-N 3.16Å; D228-C231 PolarHBondContact OD1-N 3.45Å; D228-C231 VanDerWaalsContact OD1-N 3.12Å; D228-C231 PolarHBondContact OD2-SG 3.22Å
229	P	81.3	Confident	78.9	Confident	27 Å²	27	38.8 Å²	38.8	18%	0.175	19%	0.192	C	C	.	.	H	α-helix	trans	-75.8	-21.5	179.7	30.7	-36	0	0	0	113.1	E227 V232 A233 F265 I269	E227-P229 WeakPolarHBondContact O-CD 3.2Å; P229-V232 PolarHBondContact O-N 3.09Å; P229-A233 WeakPolarHBondContact O-CB 3.42Å; P229-A233 PolarHBondContact O-N 2.8Å; P229-F265 HydrophobicContact CB-CD2 4.09Å; P229-F265 HydrophobicContact CB-CE2 4.03Å; P229-I269 HydrophobicContact CB-CG1 3.68Å
230	E	85.4	Confident	79.6	Confident	134 Å²	134	38.3 Å²	38.3	63%	0.626	19%	0.189	S	C	*	.	H	α-helix	trans	-70.2	-51.2	-175.3	-67.1	176.5	-175.8	0	0	109.7	D228 V232 A233 E234	D228-E230 VanDerWaalsContact C-N 3.33Å; D228-E230 PolarHBondContact OD1-N 3.43Å; D228-E230 VanDerWaalsContact OD1-N 3.16Å; E230-V232 VanDerWaalsContact C-N 3.25Å; E230-V232 PolarHBondContact O-N 3.32Å; E230-A233 WeakPolarHBondContact O-CB 3.31Å; E230-A233 PolarHBondContact O-N 3.03Å; E230-A233 VanDerWaalsContact O-N 3.08Å; E230-E234 WeakPolarHBondContact O-CG 3.46Å; E230-E234 PolarHBondContact O-N 2.85Å
231	C	81.3	Confident	80.1	Confident	40 Å²	40	41 Å²	41	27%	0.27	21%	0.208	S	C	.	.	H	α-helix	trans	-61.8	-32.4	176	-74	0	0	0	0	112.9	L223 D228 E234 I235	L223-C231 HydrophobicContact CD1-CB 3.65Å; L223-C231 HydrophobicContact CD2-CB 3.62Å; L223-C231 HydrophobicContact CG-CB 4.29Å; D228-C231 PolarHBondContact OD1-N 3.45Å; D228-C231 VanDerWaalsContact OD1-N 3.12Å; D228-C231 PolarHBondContact OD2-SG 3.22Å; C231-E234 PolarHBondContact O-N 2.88Å; C231-I235 VanDerWaalsContact O-CG1 3.31Å; C231-I235 WeakPolarHBondContact O-CG1 3.4Å; C231-I235 PolarHBondContact O-N 3.04Å; C231-I235 VanDerWaalsContact O-N 3.1Å
232	V	83.5	Confident	80.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-44	174.1	172.3	0	0	0	0	110.8	L223 P229 E230 E234 I235 L236 I257 F265 I269	L223-V232 HydrophobicContact CB-CG2 3.64Å; L223-V232 HydrophobicContact CD1-CG2 3.68Å; L223-V232 HydrophobicContact CG-CG2 4.33Å; P229-V232 PolarHBondContact O-N 3.09Å; E230-V232 VanDerWaalsContact C-N 3.25Å; E230-V232 PolarHBondContact O-N 3.32Å; V232-E234 VanDerWaalsContact C-N 3.31Å; V232-E234 PolarHBondContact O-N 2.89Å; V232-I235 PolarHBondContact O-N 3.27Å; V232-L236 HydrophobicContact CG1-CD1 4.04Å; V232-L236 HydrophobicContact CG1-CG 4.4Å; V232-L236 VanDerWaalsContact O-CG 3.32Å; V232-L236 WeakPolarHBondContact O-CG 3.46Å; V232-L236 PolarHBondContact O-N 3.47Å; V232-I257 HydrophobicContact CG1-CD1 3.68Å; V232-F265 HydrophobicContact CG2-CZ 3.9Å; V232-I269 HydrophobicContact CB-CD1 4.25Å; V232-I269 HydrophobicContact CB-CG1 4.4Å; V232-I269 HydrophobicContact CG1-CD1 3.71Å; V232-I269 HydrophobicContact CG1-CG1 4.24Å
233	A	84.9	Confident	81	Confident	4 Å²	4	47.1 Å²	47.1	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-41.4	175.9	0	0	0	0	0	111.3	P229 E230 I235 L236 V237 I269 A272 L273	P229-A233 WeakPolarHBondContact O-CB 3.42Å; P229-A233 PolarHBondContact O-N 2.8Å; E230-A233 WeakPolarHBondContact O-CB 3.31Å; E230-A233 PolarHBondContact O-N 3.03Å; E230-A233 VanDerWaalsContact O-N 3.08Å; A233-I235 PolarHBondContact O-N 3.45Å; A233-L236 PolarHBondContact O-N 2.93Å; A233-V237 WeakPolarHBondContact O-CB 3.33Å; A233-V237 VanDerWaalsContact O-CG2 3.25Å; A233-V237 WeakPolarHBondContact O-CG2 3.48Å; A233-V237 PolarHBondContact O-N 2.94Å; A233-I269 HydrophobicContact CB-CG2 4.38Å; A233-A272 HydrophobicContact CB-CB 3.58Å; A233-L273 HydrophobicContact CB-CD2 4.06Å; A233-L273 HydrophobicContact CB-CG 4.21Å
234	E	84	Confident	81.2	Confident	130 Å²	130	50.7 Å²	50.7	61%	0.607	26%	0.261	S	S	*	.	H	α-helix	trans	-58.7	-44.9	175.5	-71.4	177.7	169.8	0	0	112.5	E230 C231 V232 V237 H238	E230-E234 WeakPolarHBondContact O-CG 3.46Å; E230-E234 PolarHBondContact O-N 2.85Å; C231-E234 PolarHBondContact O-N 2.88Å; V232-E234 VanDerWaalsContact C-N 3.31Å; V232-E234 PolarHBondContact O-N 2.89Å; E234-V237 PolarHBondContact O-N 3.27Å; E234-H238 VanDerWaalsContact O-CB 3.29Å; E234-H238 WeakPolarHBondContact O-CB 3.5Å; E234-H238 PolarHBondContact O-N 3.47Å
235	I	82	Confident	81.5	Confident	25 Å²	25	54.2 Å²	54.2	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-44.9	176.6	-70.5	166.3	0	0	0	111.1	Y216 I219 L223 C231 V232 A233 H238 L239 L253	Y216-I235 HydrophobicContact CD1-CG2 3.45Å; Y216-I235 VanDerWaalsContact CD1-CG2 3.45Å; Y216-I235 HydrophobicContact CE1-CG2 4.04Å; Y216-I235 HydrophobicContact CG-CG2 4.27Å; I219-I235 HydrophobicContact CB-CD1 4.34Å; I219-I235 HydrophobicContact CG2-CD1 3.48Å; I219-I235 VanDerWaalsContact CG2-CD1 3.48Å; L223-I235 HydrophobicContact CD1-CD1 3.65Å; C231-I235 VanDerWaalsContact O-CG1 3.31Å; C231-I235 WeakPolarHBondContact O-CG1 3.4Å; C231-I235 PolarHBondContact O-N 3.04Å; C231-I235 VanDerWaalsContact O-N 3.1Å; V232-I235 PolarHBondContact O-N 3.27Å; A233-I235 PolarHBondContact O-N 3.45Å; I235-H238 PolarHBondContact O-N 2.88Å; I235-L239 HydrophobicContact CG2-CD1 4.15Å; I235-L239 WeakPolarHBondContact O-CG 3.45Å; I235-L239 PolarHBondContact O-N 3.06Å; I235-L253 HydrophobicContact CG2-CD2 4.36Å
236	L	85.1	Confident	82	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-41.2	-179.8	-69.8	174.8	0	0	0	111.9	V232 A233 I240 A250 L253 A254 I269 L336	V232-L236 HydrophobicContact CG1-CD1 4.04Å; V232-L236 HydrophobicContact CG1-CG 4.4Å; V232-L236 VanDerWaalsContact O-CG 3.32Å; V232-L236 WeakPolarHBondContact O-CG 3.46Å; V232-L236 PolarHBondContact O-N 3.47Å; A233-L236 PolarHBondContact O-N 2.93Å; L236-I240 WeakPolarHBondContact O-CG1 3.38Å; L236-I240 PolarHBondContact O-N 3.37Å; L236-A250 HydrophobicContact CD2-CB 4.07Å; L236-A250 WeakPolarHBondContact CD2-O 3.33Å; L236-L253 HydrophobicContact CD2-CB 4.26Å; L236-L253 HydrophobicContact CD2-CD2 4.13Å; L236-L253 HydrophobicContact CD2-CG 4.29Å; L236-A254 HydrophobicContact CD1-CB 4.38Å; L236-A254 HydrophobicContact CD2-CB 4.37Å; L236-I269 HydrophobicContact CD1-CG2 4.26Å; L236-L336 HydrophobicContact CB-CD1 3.88Å
237	V	84.3	Confident	82.4	Confident	29 Å²	29	50.9 Å²	50.9	18%	0.176	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-44.5	175.9	173.2	0	0	0	0	110.6	A233 E234 L239 I240 S241 L273	A233-V237 WeakPolarHBondContact O-CB 3.33Å; A233-V237 VanDerWaalsContact O-CG2 3.25Å; A233-V237 WeakPolarHBondContact O-CG2 3.48Å; A233-V237 PolarHBondContact O-N 2.94Å; E234-V237 PolarHBondContact O-N 3.27Å; V237-L239 VanDerWaalsContact C-N 3.34Å; V237-L239 PolarHBondContact O-N 3.42Å; V237-I240 PolarHBondContact O-N 3.31Å; V237-S241 PolarHBondContact O-N 2.72Å; V237-S241 PolarHBondContact O-OG 2.68Å; V237-L273 HydrophobicContact CG2-CD2 3.61Å
238	H	83.8	Confident	83	Confident	91 Å²	91	45.2 Å²	45.2	42%	0.421	24%	0.242	S	C	.	.	H	α-helix	trans	-55.2	-49.9	177	179.8	-81.5	0	0	0	111.3	E234 I235 I240 S241 E242	E234-H238 VanDerWaalsContact O-CB 3.29Å; E234-H238 WeakPolarHBondContact O-CB 3.5Å; E234-H238 PolarHBondContact O-N 3.47Å; I235-H238 PolarHBondContact O-N 2.88Å; H238-I240 VanDerWaalsContact C-N 3.3Å; H238-I240 PolarHBondContact O-N 3.11Å; H238-S241 PolarHBondContact O-N 2.9Å; H238-E242 VanDerWaalsContact CE1-CD 3.44Å; H238-E242 IonicContact CE1-OE1 3.65Å; H238-E242 PolarHBondContact CE1-OE1 2.94Å; H238-E242 IonicContact CE1-OE2 3.08Å; H238-E242 IonicContact ND1-OE1 3.8Å; H238-E242 IonicContact ND1-OE2 2.79Å; H238-E242 IonicContact NE2-OE1 2.7Å; H238-E242 WeakPolarHBondContact O-CG 3.45Å; H238-E242 PolarHBondContact O-N 3.43Å
239	L	81.8	Confident	83.2	Confident	6 Å²	6	45 Å²	45	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-35.9	179	-72.3	172.4	0	0	0	113	Y216 I235 V237 A246 A250 L253	Y216-L239 HydrophobicContact CD2-CD2 4.09Å; Y216-L239 HydrophobicContact CE1-CD2 4.48Å; Y216-L239 HydrophobicContact CE2-CD2 3.76Å; Y216-L239 HydrophobicContact CG-CD1 4.36Å; I235-L239 HydrophobicContact CG2-CD1 4.15Å; I235-L239 WeakPolarHBondContact O-CG 3.45Å; I235-L239 PolarHBondContact O-N 3.06Å; V237-L239 VanDerWaalsContact C-N 3.34Å; V237-L239 PolarHBondContact O-N 3.42Å; L239-A246 HydrophobicContact CD2-CB 4.38Å; L239-A246 CarbonylContact O-C 3.59Å; L239-A246 WeakPolarHBondContact O-CB 3.33Å; L239-A250 HydrophobicContact CB-CB 3.84Å; L239-A250 HydrophobicContact CD1-CB 4.18Å; L239-L253 HydrophobicContact CD1-CD2 4.26Å
240	I	84.2	Confident	83.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-72.4	-36.2	177.8	-77.5	166.9	0	0	0	112.5	L236 V237 H238 E242 A247 A250 R328 V329 H332 L336	L236-I240 WeakPolarHBondContact O-CG1 3.38Å; L236-I240 PolarHBondContact O-N 3.37Å; V237-I240 PolarHBondContact O-N 3.31Å; H238-I240 VanDerWaalsContact C-N 3.3Å; H238-I240 PolarHBondContact O-N 3.11Å; I240-E242 VanDerWaalsContact C-N 3.28Å; I240-E242 PolarHBondContact O-N 3.2Å; I240-A247 HydrophobicContact CG1-CB 3.95Å; I240-A250 HydrophobicContact CD1-CB 4.4Å; I240-A250 HydrophobicContact CG1-CB 4.03Å; I240-R328 PolarHBondContact O-NH1 3.38Å; I240-V329 HydrophobicContact CG2-CG1 4.45Å; I240-H332 HydrophobicContact CB-CB 4.29Å; I240-H332 HydrophobicContact CD1-CB 3.96Å; I240-H332 HydrophobicContact CG1-CB 4.06Å; I240-H332 HydrophobicContact CG2-CB 3.27Å; I240-L336 HydrophobicContact CD1-CD1 3.06Å; I240-L336 HydrophobicContact CD1-CD2 4.4Å; I240-L336 HydrophobicContact CD1-CG 3.51Å; I240-L336 HydrophobicContact CG1-CD1 4.43Å
241	S	82.3	Confident	83.7	Confident	58 Å²	58	37.6 Å²	37.6	41%	0.406	21%	0.206	S	C	.	.	H	α-helix	trans	-69.3	-27.4	178.9	-63.5	0	0	0	0	112.5	V237 H238 R328	V237-S241 PolarHBondContact O-N 2.72Å; V237-S241 PolarHBondContact O-OG 2.68Å; H238-S241 PolarHBondContact O-N 2.9Å; S241-R328 PolarHBondContact O-NH2 2.91Å
242	E	81.7	Confident	84	Confident	111 Å²	111	36.1 Å²	36.1	52%	0.519	20%	0.195	S	C	.	.	H	α-helix	trans	-69.7	-59	-178.2	-75.7	-176.8	146.9	0	0	113.9	H238 I240 A246	H238-E242 VanDerWaalsContact CE1-CD 3.44Å; H238-E242 IonicContact CE1-OE1 3.65Å; H238-E242 PolarHBondContact CE1-OE1 2.94Å; H238-E242 IonicContact CE1-OE2 3.08Å; H238-E242 IonicContact ND1-OE1 3.8Å; H238-E242 IonicContact ND1-OE2 2.79Å; H238-E242 IonicContact NE2-OE1 2.7Å; H238-E242 WeakPolarHBondContact O-CG 3.45Å; H238-E242 PolarHBondContact O-N 3.43Å; I240-E242 VanDerWaalsContact C-N 3.28Å; I240-E242 PolarHBondContact O-N 3.2Å; E242-A246 HydrophobicContact CB-CB 4.2Å
243	S	81.8	Confident	84.1	Confident	50 Å²	50	36.5 Å²	36.5	35%	0.35	20%	0.197	S	C	.	.			trans	-163.4	165	-178	68.9	0	0	0	0	111.7	D245 A246 A247	S243-D245 VanDerWaalsContact C-N 3.28Å; S243-D245 PolarHBondContact O-N 3.44Å; S243-A246 PolarHBondContact O-N 3.28Å; S243-A246 WeakPolarHBondContact OG-CB 3.34Å; S243-A246 PolarHBondContact OG-N 2.99Å; S243-A246 VanDerWaalsContact OG-N 3.14Å; S243-A247 PolarHBondContact O-N 3.44Å
244	D	78.8	Confident	84.3	Confident	79 Å²	79	36.3 Å²	36.3	42%	0.422	20%	0.195	S	C	.	.	H	α-helix	trans	-68.1	-31.5	177.6	-61.4	-14.7	0	0	0	111.6	A247 A248 R328 H332	D244-A247 WeakPolarHBondContact O-CB 3.33Å; D244-A247 PolarHBondContact O-N 3.23Å; D244-A248 PolarHBondContact O-N 3.47Å; D244-R328 WeakPolarHBondContact OD1-CD 3.47Å; D244-R328 IonicContact OD1-CZ 2.7Å; D244-R328 IonicContact OD1-NE 2.92Å; D244-R328 IonicContact OD1-NH1 3.65Å; D244-R328 PolarHBondContact OD1-NH1 3.11Å; D244-H332 IonicContact OD1-CE1 3.8Å; D244-H332 IonicContact OD1-NE2 3.87Å; D244-H332 PolarHBondContact OD1-NE2 3.28Å
245	D	80.5	Confident	84.5	Confident	101 Å²	101	30.1 Å²	30.1	54%	0.54	17%	0.166	S	C	.	.	H	α-helix	trans	-63.2	-39.7	171.3	-80.9	-33	0	0	0	112.8	S243 V249	S243-D245 VanDerWaalsContact C-N 3.28Å; S243-D245 PolarHBondContact O-N 3.44Å; D245-V249 PolarHBondContact O-N 3.41Å
246	A	83.2	Confident	84.5	Confident	12 Å²	12	29.7 Å²	29.7	10%	0.099	16%	0.164	C	C	.	.	H	α-helix	trans	-73.6	-31.6	175.6	0	0	0	0	0	111.2	L239 E242 S243 A248 V249 A250	L239-A246 HydrophobicContact CD2-CB 4.38Å; L239-A246 CarbonylContact O-C 3.59Å; L239-A246 WeakPolarHBondContact O-CB 3.33Å; E242-A246 HydrophobicContact CB-CB 4.2Å; S243-A246 PolarHBondContact O-N 3.28Å; S243-A246 WeakPolarHBondContact OG-CB 3.34Å; S243-A246 PolarHBondContact OG-N 2.99Å; S243-A246 VanDerWaalsContact OG-N 3.14Å; A246-A248 VanDerWaalsContact C-N 3.35Å; A246-A248 PolarHBondContact O-N 3.5Å; A246-V249 WeakPolarHBondContact O-CB 3.46Å; A246-V249 PolarHBondContact O-N 3.06Å; A246-V249 VanDerWaalsContact O-N 3.17Å; A246-A250 PolarHBondContact O-N 3.03Å
247	A	85.2	Confident	84.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-39.4	171.5	0	0	0	0	0	112.3	I240 S243 D244 V249 A250 Y251	I240-A247 HydrophobicContact CG1-CB 3.95Å; S243-A247 PolarHBondContact O-N 3.44Å; D244-A247 WeakPolarHBondContact O-CB 3.33Å; D244-A247 PolarHBondContact O-N 3.23Å; A247-V249 VanDerWaalsContact C-N 3.3Å; A247-V249 PolarHBondContact O-N 2.9Å; A247-A250 WeakPolarHBondContact O-CA 3.4Å; A247-A250 WeakPolarHBondContact O-CB 3.22Å; A247-A250 PolarHBondContact O-N 3.2Å; A247-A250 VanDerWaalsContact O-N 3.12Å; A247-Y251 WeakPolarHBondContact O-CD1 3.29Å; A247-Y251 VanDerWaalsContact O-CG 3.24Å; A247-Y251 PolarHBondContact O-N 2.88Å
248	A	85.8	Confident	84.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-38.2	173.5	0	0	0	0	0	112.6	D244 A246 Y251 Q252 T806 V909 V919	D244-A248 PolarHBondContact O-N 3.47Å; A246-A248 VanDerWaalsContact C-N 3.35Å; A246-A248 PolarHBondContact O-N 3.5Å; A248-Y251 PolarHBondContact O-N 3.2Å; A248-Q252 PolarHBondContact O-N 3.2Å; A248-Q252 VanDerWaalsContact O-N 3.08Å; A248-T806 HydrophobicContact CB-CG2 4.01Å; A248-V909 HydrophobicContact CB-CG2 4.02Å; A248-V919 HydrophobicContact CB-CG1 4.05Å
249	V	85.7	Confident	84	Confident	46 Å²	46	28 Å²	28	28%	0.279	16%	0.156	S	C	.	.	H	α-helix	trans	-66.3	-41.7	172.7	-179.9	0	0	0	0	110.7	D245 A246 A247 Y251 Q252 L253 V909 R921	D245-V249 PolarHBondContact O-N 3.41Å; A246-V249 WeakPolarHBondContact O-CB 3.46Å; A246-V249 PolarHBondContact O-N 3.06Å; A246-V249 VanDerWaalsContact O-N 3.17Å; A247-V249 VanDerWaalsContact C-N 3.3Å; A247-V249 PolarHBondContact O-N 2.9Å; V249-Y251 VanDerWaalsContact C-N 3.33Å; V249-Y251 PolarHBondContact O-N 3.2Å; V249-Q252 PolarHBondContact O-N 3.45Å; V249-L253 VanDerWaalsContact O-CB 3.28Å; V249-L253 WeakPolarHBondContact O-CB 3.26Å; V249-L253 PolarHBondContact O-N 3.33Å; V249-V909 HydrophobicContact CB-CG1 4.49Å; V249-V909 HydrophobicContact CG2-CG1 3.92Å; V249-R921 VanDerWaalsContact CG2-NH2 3.33Å
250	A	86.6	Confident	83.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-41.5	175.7	0	0	0	0	0	111.9	L236 L239 I240 A246 A247 L253 A254	L236-A250 HydrophobicContact CD2-CB 4.07Å; L236-A250 WeakPolarHBondContact CD2-O 3.33Å; L239-A250 HydrophobicContact CB-CB 3.84Å; L239-A250 HydrophobicContact CD1-CB 4.18Å; I240-A250 HydrophobicContact CD1-CB 4.4Å; I240-A250 HydrophobicContact CG1-CB 4.03Å; A246-A250 PolarHBondContact O-N 3.03Å; A247-A250 WeakPolarHBondContact O-CA 3.4Å; A247-A250 WeakPolarHBondContact O-CB 3.22Å; A247-A250 PolarHBondContact O-N 3.2Å; A247-A250 VanDerWaalsContact O-N 3.12Å; A250-L253 PolarHBondContact O-N 3.48Å; A250-A254 WeakPolarHBondContact O-CB 3.29Å; A250-A254 PolarHBondContact O-N 3.21Å
251	Y	90.7	Very high	83.1	Confident	6 Å²	6	29.7 Å²	29.7	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-46.1	175.5	-62.6	-21	0	0	0	112.3	A247 A248 V249 L253 A254 L255 H332 A335 L336 I339 T806 L808	A247-Y251 WeakPolarHBondContact O-CD1 3.29Å; A247-Y251 VanDerWaalsContact O-CG 3.24Å; A247-Y251 PolarHBondContact O-N 2.88Å; A248-Y251 PolarHBondContact O-N 3.2Å; V249-Y251 VanDerWaalsContact C-N 3.33Å; V249-Y251 PolarHBondContact O-N 3.2Å; Y251-L253 VanDerWaalsContact C-N 3.29Å; Y251-L253 PolarHBondContact O-N 3.05Å; Y251-A254 PolarHBondContact O-N 3.48Å; Y251-L255 WeakPolarHBondContact O-CG 3.41Å; Y251-L255 PolarHBondContact O-N 3.36Å; Y251-H332 AromaticContact CZ-ND1 3.56Å; Y251-H332 WeakPolarHBondContact OH-CA 3.33Å; Y251-H332 PolarHBondContact OH-ND1 3Å; Y251-A335 HydrophobicContact CE1-CB 3.91Å; Y251-A335 VanDerWaalsContact OH-CB 3.22Å; Y251-A335 WeakPolarHBondContact OH-CB 3.35Å; Y251-L336 HydrophobicContact CD1-CD2 3.73Å; Y251-L336 HydrophobicContact CD1-CG 4.12Å; Y251-L336 HydrophobicContact CE1-CD2 4.21Å; Y251-L336 HydrophobicContact CE1-CG 4.07Å; Y251-I339 HydrophobicContact CD1-CD1 3.95Å; Y251-I339 HydrophobicContact CG-CD1 4.01Å; Y251-T806 WeakPolarHBondContact CE2-O 3.49Å; Y251-L808 HydrophobicContact CD2-CD2 4Å; Y251-L808 HydrophobicContact CE2-CD2 4.26Å; Y251-L808 HydrophobicContact CG-CD2 4.38Å
252	Q	89.1	Confident	82.6	Confident	8 Å²	8	29.5 Å²	29.5	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-40.5	176.3	-174	62.8	62.1	0	0	111.6	A248 V249 L255 D256 V909 K910 I917 I918 V919	A248-Q252 PolarHBondContact O-N 3.2Å; A248-Q252 VanDerWaalsContact O-N 3.08Å; V249-Q252 PolarHBondContact O-N 3.45Å; Q252-L255 PolarHBondContact O-N 2.87Å; Q252-D256 PolarHBondContact NE2-OD1 3.4Å; Q252-D256 WeakPolarHBondContact O-CB 3.46Å; Q252-D256 VanDerWaalsContact O-CG 3.31Å; Q252-D256 PolarHBondContact O-N 3.09Å; Q252-V909 HydrophobicContact CB-CG1 4.15Å; Q252-V909 HydrophobicContact CG-CG1 4.5Å; Q252-K910 HydrophobicContact CG-CB 4.1Å; Q252-K910 HydrophobicContact CG-CD 4.13Å; Q252-I917 PolarHBondContact NE2-O 3.42Å; Q252-I918 VanDerWaalsContact OE1-CA 3.31Å; Q252-V919 HydrophobicContact CB-CG2 4.18Å
253	L	85.3	Confident	82.1	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-43.2	177.4	-173.5	58.4	0	0	0	111.2	N217 C220 I235 L236 L239 V249 A250 Y251 L255 D256 I257	N217-L253 HydrophobicContact CB-CD1 4.36Å; C220-L253 HydrophobicContact CB-CD1 3.96Å; C220-L253 HydrophobicContact CB-CD2 4.49Å; C220-L253 HydrophobicContact CB-CG 4.41Å; I235-L253 HydrophobicContact CG2-CD2 4.36Å; L236-L253 HydrophobicContact CD2-CB 4.26Å; L236-L253 HydrophobicContact CD2-CD2 4.13Å; L236-L253 HydrophobicContact CD2-CG 4.29Å; L239-L253 HydrophobicContact CD1-CD2 4.26Å; V249-L253 VanDerWaalsContact O-CB 3.28Å; V249-L253 WeakPolarHBondContact O-CB 3.26Å; V249-L253 PolarHBondContact O-N 3.33Å; A250-L253 PolarHBondContact O-N 3.48Å; Y251-L253 VanDerWaalsContact C-N 3.29Å; Y251-L253 PolarHBondContact O-N 3.05Å; L253-L255 VanDerWaalsContact C-N 3.35Å; L253-L255 PolarHBondContact O-N 3.03Å; L253-D256 PolarHBondContact O-N 2.85Å; L253-I257 HydrophobicContact CD1-CD1 4.2Å; L253-I257 HydrophobicContact CD1-CG1 4.46Å; L253-I257 HydrophobicContact CG-CD1 3.9Å; L253-I257 WeakPolarHBondContact O-CB 3.46Å; L253-I257 WeakPolarHBondContact O-CD1 3.47Å; L253-I257 WeakPolarHBondContact O-CG1 3.33Å; L253-I257 PolarHBondContact O-N 3.17Å
254	A	88	Confident	81.8	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-39.1	175.3	0	0	0	0	0	112.4	L236 A250 Y251 H258 L336 I339	L236-A254 HydrophobicContact CD1-CB 4.38Å; L236-A254 HydrophobicContact CD2-CB 4.37Å; A250-A254 WeakPolarHBondContact O-CB 3.29Å; A250-A254 PolarHBondContact O-N 3.21Å; Y251-A254 PolarHBondContact O-N 3.48Å; A254-H258 VanDerWaalsContact O-CB 3.31Å; A254-H258 WeakPolarHBondContact O-CB 3.32Å; A254-H258 PolarHBondContact O-N 2.64Å; A254-L336 HydrophobicContact CB-CD2 3.68Å; A254-I339 HydrophobicContact CB-CG2 3.75Å
255	L	87.9	Confident	81.8	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.4	-49	173.3	-73.4	165.2	0	0	0	111.5	Y251 Q252 L253 I257 H258 D259 I339 Q345 I804 I917 V919	Y251-L255 WeakPolarHBondContact O-CG 3.41Å; Y251-L255 PolarHBondContact O-N 3.36Å; Q252-L255 PolarHBondContact O-N 2.87Å; L253-L255 VanDerWaalsContact C-N 3.35Å; L253-L255 PolarHBondContact O-N 3.03Å; L255-I257 VanDerWaalsContact C-N 3.32Å; L255-I257 PolarHBondContact O-N 3.35Å; L255-H258 PolarHBondContact O-N 3.38Å; L255-D259 PolarHBondContact O-N 3.26Å; L255-D259 VanDerWaalsContact O-N 3.09Å; L255-I339 HydrophobicContact CD2-CG2 3.79Å; L255-I339 HydrophobicContact CG-CG2 3.84Å; L255-Q345 HydrophobicContact CD2-CG 3.71Å; L255-I804 HydrophobicContact CD1-CD1 4.07Å; L255-I917 HydrophobicContact CD1-CB 4.33Å; L255-I917 HydrophobicContact CD1-CG2 3.77Å; L255-I917 HydrophobicContact CD2-CB 4.41Å; L255-I917 HydrophobicContact CD2-CD1 4.37Å; L255-I917 HydrophobicContact CD2-CG2 4.24Å; L255-V919 HydrophobicContact CD1-CG2 3.92Å
256	D	83.8	Confident	81.9	Confident	16 Å²	16	17.2 Å²	17.2	9%	0.086	10%	0.103	C	C	.	.	H	α-helix	trans	-62.3	-38.6	179.1	-75.6	-10	0	0	0	112.3	Q252 L253 S260 M765 K910	Q252-D256 PolarHBondContact NE2-OD1 3.4Å; Q252-D256 WeakPolarHBondContact O-CB 3.46Å; Q252-D256 VanDerWaalsContact O-CG 3.31Å; Q252-D256 PolarHBondContact O-N 3.09Å; L253-D256 PolarHBondContact O-N 2.85Å; D256-S260 PolarHBondContact O-OG 3.11Å; D256-M765 HydrophobicContact CB-CE 4.02Å; D256-M765 WeakPolarHBondContact OD2-CE 3.41Å; D256-K910 IonicContact OD1-NZ 3.95Å; D256-K910 PolarHBondContact OD1-NZ 3.23Å; D256-K910 IonicContact OD2-NZ 3.6Å; D256-K910 PolarHBondContact OD2-NZ 3.18Å
257	I	83	Confident	81.9	Confident	9 Å²	9	20.7 Å²	20.7	5%	0.046	12%	0.116	C	C	.	.	H	α-helix	trans	-68.1	-46.5	176	-67.9	164.6	0	0	0	110.1	C220 V232 L253 L255 D259 S260 S261 F265 M266 I269	C220-I257 HydrophobicContact CB-CD1 3.66Å; C220-I257 HydrophobicContact CB-CG1 4.15Å; V232-I257 HydrophobicContact CG1-CD1 3.68Å; L253-I257 HydrophobicContact CD1-CD1 4.2Å; L253-I257 HydrophobicContact CD1-CG1 4.46Å; L253-I257 HydrophobicContact CG-CD1 3.9Å; L253-I257 WeakPolarHBondContact O-CB 3.46Å; L253-I257 WeakPolarHBondContact O-CD1 3.47Å; L253-I257 WeakPolarHBondContact O-CG1 3.33Å; L253-I257 PolarHBondContact O-N 3.17Å; L255-I257 VanDerWaalsContact C-N 3.32Å; L255-I257 PolarHBondContact O-N 3.35Å; I257-D259 VanDerWaalsContact C-N 3.34Å; I257-D259 PolarHBondContact O-N 2.92Å; I257-S260 PolarHBondContact O-N 3.04Å; I257-S260 VanDerWaalsContact O-N 3.16Å; I257-S260 PolarHBondContact O-OG 3.37Å; I257-S261 WeakPolarHBondContact CG2-OG 3.28Å; I257-S261 WeakPolarHBondContact O-CB 2.92Å; I257-S261 PolarHBondContact O-N 3.48Å; I257-S261 PolarHBondContact O-OG 3.23Å; I257-F265 HydrophobicContact CG2-CD1 4.38Å; I257-F265 HydrophobicContact CG2-CE1 3.86Å; I257-M266 HydrophobicContact CG2-SD 3.86Å; I257-I269 HydrophobicContact CG2-CD1 4.12Å
258	H	83.5	Confident	81.8	Confident	31 Å²	31	21.6 Å²	21.6	14%	0.144	13%	0.125	C	C	.	.	H	α-helix	trans	-55.5	-48.6	179.6	175.9	-91.4	0	0	0	111.8	A254 L255 S260 S261 M266 Q345	A254-H258 VanDerWaalsContact O-CB 3.31Å; A254-H258 WeakPolarHBondContact O-CB 3.32Å; A254-H258 PolarHBondContact O-N 2.64Å; L255-H258 PolarHBondContact O-N 3.38Å; H258-S260 PolarHBondContact O-N 3.25Å; H258-S260 VanDerWaalsContact O-N 3.12Å; H258-S261 PolarHBondContact O-N 3.13Å; H258-M266 HydrophobicContact CB-CE 3.66Å; H258-M266 HydrophobicContact CB-SD 4.37Å; H258-Q345 PolarHBondContact ND1-NE2 3.07Å
259	D	75	Confident	81.8	Confident	44 Å²	44	21.6 Å²	21.6	24%	0.235	13%	0.125	C	C	.	.	H	α-helix	trans	-64.1	-21.5	-176.8	-70.1	-34	0	0	0	113.7	L255 I257 R764	L255-D259 PolarHBondContact O-N 3.26Å; L255-D259 VanDerWaalsContact O-N 3.09Å; I257-D259 VanDerWaalsContact C-N 3.34Å; I257-D259 PolarHBondContact O-N 2.92Å; D259-R764 VanDerWaalsContact CG-NH2 3.33Å; D259-R764 IonicContact OD1-NH2 2.87Å; D259-R764 IonicContact OD2-CZ 3.69Å; D259-R764 VanDerWaalsContact OD2-CZ 3.26Å; D259-R764 IonicContact OD2-NH1 3.95Å; D259-R764 IonicContact OD2-NH2 3.62Å; D259-R764 PolarHBondContact OD2-NH2 3.48Å
260	S	72.7	Confident	81.7	Confident	24 Å²	24	20 Å²	20	17%	0.168	12%	0.118	C	C	.	.	H	α-helix	trans	-109.6	-9.9	-174.7	77.5	0	0	0	0	114.2	K224 D256 I257 H258	K224-S260 WeakPolarHBondContact CE-O 3.3Å; K224-S260 VanDerWaalsContact NZ-C 3.31Å; K224-S260 PolarHBondContact NZ-O 3.46Å; K224-S260 PolarHBondContact NZ-OG 2.92Å; D256-S260 PolarHBondContact O-OG 3.11Å; I257-S260 PolarHBondContact O-N 3.04Å; I257-S260 VanDerWaalsContact O-N 3.16Å; I257-S260 PolarHBondContact O-OG 3.37Å; H258-S260 PolarHBondContact O-N 3.25Å; H258-S260 VanDerWaalsContact O-N 3.12Å
261	S	74.8	Confident	81.8	Confident	19 Å²	19	27.5 Å²	27.5	13%	0.133	15%	0.151	C	C	.	.	S	Bend	trans	-111.3	151.5	-166.8	-57.3	0	0	0	0	114	K224 I257 H258	K224-S261 WeakPolarHBondContact CD-OG 3.49Å; I257-S261 WeakPolarHBondContact CG2-OG 3.28Å; I257-S261 WeakPolarHBondContact O-CB 2.92Å; I257-S261 PolarHBondContact O-N 3.48Å; I257-S261 PolarHBondContact O-OG 3.23Å; H258-S261 PolarHBondContact O-N 3.13Å
262	P	71	Confident	81.5	Confident	54 Å²	54	28.5 Å²	28.5	35%	0.351	16%	0.16	S	C	.	.			trans	-69	154.2	175.3	28.6	-33.5	0	0	0	112.1	S264 F265 M266	P262-S264 VanDerWaalsContact C-N 3.29Å; P262-S264 PolarHBondContact O-N 3.44Å; P262-F265 HydrophobicContact CG-CB 3.92Å; P262-F265 WeakPolarHBondContact O-CB 3.3Å; P262-F265 PolarHBondContact O-N 3.41Å; P262-F265 VanDerWaalsContact O-N 3.13Å; P262-M266 PolarHBondContact O-N 3.41Å; P262-M266 VanDerWaalsContact O-N 3.15Å
263	Q	72.3	Confident	81.3	Confident	19 Å²	19	28.2 Å²	28.2	9%	0.089	16%	0.159	C	C	.	.	H	α-helix	trans	-54.9	-39.8	178.2	-85.3	-81.5	-36.4	0	0	113.9	F265 M266 K267 N464	Q263-F265 VanDerWaalsContact C-N 3.28Å; Q263-F265 PolarHBondContact O-N 2.86Å; Q263-M266 PolarHBondContact O-N 3.47Å; Q263-K267 WeakPolarHBondContact O-CB 3.34Å; Q263-K267 WeakPolarHBondContact O-CG 3.41Å; Q263-K267 PolarHBondContact O-N 3.2Å; Q263-K267 VanDerWaalsContact OE1-CE 3.3Å; Q263-N464 HydrophobicContact CG-CB 4.44Å; Q263-N464 WeakPolarHBondContact CG-ND2 3.28Å; Q263-N464 VanDerWaalsContact CG-O 3.32Å; Q263-N464 WeakPolarHBondContact CG-O 3.47Å; Q263-N464 WeakPolarHBondContact CG-OD1 3.41Å; Q263-N464 PolarHBondContact NE2-ND2 2.9Å; Q263-N464 PolarHBondContact NE2-O 3.33Å; Q263-N464 PolarHBondContact OE1-O 3.48Å
264	S	75	Confident	81.2	Confident	49 Å²	49	31.6 Å²	31.6	34%	0.343	17%	0.174	S	C	.	.	H	α-helix	trans	-58.6	-42.7	178.8	51.7	0	0	0	0	111.5	P262 G268	P262-S264 VanDerWaalsContact C-N 3.29Å; P262-S264 PolarHBondContact O-N 3.44Å; S264-G268 PolarHBondContact O-N 3.38Å
265	F	79.4	Confident	80.9	Confident	9 Å²	9	34.6 Å²	34.6	4%	0.039	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-47.3	176.8	-174.5	-103.8	0	0	0	111.6	K224 P229 V232 I257 P262 Q263 K267 G268 I269	K224-F265 HydrophobicContact CB-CE1 4.33Å; K224-F265 HydrophobicContact CB-CZ 4.22Å; K224-F265 HydrophobicContact CG-CE1 4.5Å; P229-F265 HydrophobicContact CB-CD2 4.09Å; P229-F265 HydrophobicContact CB-CE2 4.03Å; V232-F265 HydrophobicContact CG2-CZ 3.9Å; I257-F265 HydrophobicContact CG2-CD1 4.38Å; I257-F265 HydrophobicContact CG2-CE1 3.86Å; P262-F265 HydrophobicContact CG-CB 3.92Å; P262-F265 WeakPolarHBondContact O-CB 3.3Å; P262-F265 PolarHBondContact O-N 3.41Å; P262-F265 VanDerWaalsContact O-N 3.13Å; Q263-F265 VanDerWaalsContact C-N 3.28Å; Q263-F265 PolarHBondContact O-N 2.86Å; F265-K267 VanDerWaalsContact C-N 3.33Å; F265-K267 PolarHBondContact O-N 2.88Å; F265-G268 WeakPolarHBondContact O-CA 3.11Å; F265-G268 PolarHBondContact O-N 3.27Å; F265-I269 HydrophobicContact CD1-CD1 3.82Å; F265-I269 HydrophobicContact CE1-CD1 3.52Å; F265-I269 HydrophobicContact CE1-CG1 4.36Å; F265-I269 HydrophobicContact CZ-CD1 4.17Å; F265-I269 PolarHBondContact O-N 3.31Å
266	M	82.3	Confident	80.1	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-39.3	177	-63.4	-51.6	-64.9	0	0	112.5	I257 H258 P262 Q263 G268 I269 G270 V340	I257-M266 HydrophobicContact CG2-SD 3.86Å; H258-M266 HydrophobicContact CB-CE 3.66Å; H258-M266 HydrophobicContact CB-SD 4.37Å; P262-M266 PolarHBondContact O-N 3.41Å; P262-M266 VanDerWaalsContact O-N 3.15Å; Q263-M266 PolarHBondContact O-N 3.47Å; M266-G268 VanDerWaalsContact C-N 3.32Å; M266-G268 PolarHBondContact O-N 3.3Å; M266-I269 PolarHBondContact O-N 2.96Å; M266-I269 HydrophobicContact SD-CD1 4.1Å; M266-G270 PolarHBondContact O-N 3.24Å; M266-V340 HydrophobicContact CE-CB 4.15Å; M266-V340 HydrophobicContact CE-CG1 4.02Å; M266-V340 HydrophobicContact CE-CG2 4.14Å; M266-V340 WeakPolarHBondContact O-CG1 3.48Å
267	K	81.9	Confident	79.5	Confident	84 Å²	84	46.8 Å²	46.8	37%	0.365	25%	0.249	S	C	.	.	H	α-helix	trans	-65.2	-35.8	173.2	-74.4	178.5	-177.3	179.3	0	112.2	Q263 F265 G270 K271	Q263-K267 WeakPolarHBondContact O-CB 3.34Å; Q263-K267 WeakPolarHBondContact O-CG 3.41Å; Q263-K267 PolarHBondContact O-N 3.2Å; Q263-K267 VanDerWaalsContact OE1-CE 3.3Å; F265-K267 VanDerWaalsContact C-N 3.33Å; F265-K267 PolarHBondContact O-N 2.88Å; K267-G270 PolarHBondContact O-N 3.07Å; K267-K271 WeakPolarHBondContact O-CG 3.45Å; K267-K271 PolarHBondContact O-N 2.92Å
268	G	83.5	Confident	78.5	Confident	20 Å²	20	51.4 Å²	51.4	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-59.3	-49.5	171.7	0	0	0	0	0	111.6	S264 F265 M266 G270 K271 A272	S264-G268 PolarHBondContact O-N 3.38Å; F265-G268 WeakPolarHBondContact O-CA 3.11Å; F265-G268 PolarHBondContact O-N 3.27Å; M266-G268 VanDerWaalsContact C-N 3.32Å; M266-G268 PolarHBondContact O-N 3.3Å; G268-G270 PolarHBondContact O-N 3.13Å; G268-K271 PolarHBondContact O-N 3.17Å; G268-A272 PolarHBondContact O-N 3.07Å
269	I	85.6	Confident	77.1	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-47.9	176.8	-64.4	169.5	0	0	0	110.1	P229 V232 A233 L236 I257 F265 M266 K271 A272 L273 V340	P229-I269 HydrophobicContact CB-CG1 3.68Å; V232-I269 HydrophobicContact CB-CD1 4.25Å; V232-I269 HydrophobicContact CB-CG1 4.4Å; V232-I269 HydrophobicContact CG1-CD1 3.71Å; V232-I269 HydrophobicContact CG1-CG1 4.24Å; A233-I269 HydrophobicContact CB-CG2 4.38Å; L236-I269 HydrophobicContact CD1-CG2 4.26Å; I257-I269 HydrophobicContact CG2-CD1 4.12Å; F265-I269 HydrophobicContact CD1-CD1 3.82Å; F265-I269 HydrophobicContact CE1-CD1 3.52Å; F265-I269 HydrophobicContact CE1-CG1 4.36Å; F265-I269 HydrophobicContact CZ-CD1 4.17Å; F265-I269 PolarHBondContact O-N 3.31Å; M266-I269 PolarHBondContact O-N 2.96Å; M266-I269 HydrophobicContact SD-CD1 4.1Å; I269-K271 VanDerWaalsContact C-N 3.32Å; I269-K271 PolarHBondContact O-N 3.2Å; I269-A272 PolarHBondContact O-N 3.07Å; I269-A272 VanDerWaalsContact O-N 3.16Å; I269-L273 HydrophobicContact CG2-CD1 3.87Å; I269-L273 HydrophobicContact CG2-CG 4.15Å; I269-L273 WeakPolarHBondContact O-CB 3.37Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.47Å; I269-L273 PolarHBondContact O-N 3.08Å; I269-V340 HydrophobicContact CB-CG1 4.17Å; I269-V340 HydrophobicContact CG2-CG1 4.12Å; I269-V340 HydrophobicContact CG2-CG2 3.96Å
270	G	85.2	Confident	75.4	Confident	13 Å²	13	55.3 Å²	55.3	13%	0.134	31%	0.307	C	S	.	.	H	α-helix	trans	-60.1	-39.7	180	0	0	0	0	0	113.2	M266 K267 G268 Q274	M266-G270 PolarHBondContact O-N 3.24Å; K267-G270 PolarHBondContact O-N 3.07Å; G268-G270 PolarHBondContact O-N 3.13Å; G270-Q274 WeakPolarHBondContact O-CB 3.41Å; G270-Q274 PolarHBondContact O-N 3.45Å
271	K	86.8	Confident	73.6	Confident	156 Å²	156	59.6 Å²	59.6	68%	0.678	33%	0.328	S	S	*	.	H	α-helix	trans	-65.7	-43.7	173.8	-75.3	-178.9	178.8	-173.4	0	112.2	K267 G268 I269 Q274 A275	K267-K271 WeakPolarHBondContact O-CG 3.45Å; K267-K271 PolarHBondContact O-N 2.92Å; G268-K271 PolarHBondContact O-N 3.17Å; I269-K271 VanDerWaalsContact C-N 3.32Å; I269-K271 PolarHBondContact O-N 3.2Å; K271-Q274 PolarHBondContact O-N 3.31Å; K271-A275 WeakPolarHBondContact O-CB 3.35Å; K271-A275 PolarHBondContact O-N 3.36Å
272	A	85.7	Confident	71.6	Confident	27 Å²	27	67.9 Å²	67.9	22%	0.223	37%	0.365	C	S	.	.	H	α-helix	trans	-63.9	-40.9	178.5	0	0	0	0	0	111.7	A233 G268 I269 R276	A233-A272 HydrophobicContact CB-CB 3.58Å; G268-A272 PolarHBondContact O-N 3.07Å; I269-A272 PolarHBondContact O-N 3.07Å; I269-A272 VanDerWaalsContact O-N 3.16Å; A272-R276 PolarHBondContact O-N 3.22Å
273	L	84.8	Confident	69.8	Low	2 Å²	2	72 Å²	72	1%	0.01	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-42.5	173.4	-69.4	175.8	0	0	0	111.9	A233 V237 I269 R276 L277 V333 L336 V340	A233-L273 HydrophobicContact CB-CD2 4.06Å; A233-L273 HydrophobicContact CB-CG 4.21Å; V237-L273 HydrophobicContact CG2-CD2 3.61Å; I269-L273 HydrophobicContact CG2-CD1 3.87Å; I269-L273 HydrophobicContact CG2-CG 4.15Å; I269-L273 WeakPolarHBondContact O-CB 3.37Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.47Å; I269-L273 PolarHBondContact O-N 3.08Å; L273-R276 PolarHBondContact O-N 3.14Å; L273-L277 PolarHBondContact O-N 3.41Å; L273-V333 HydrophobicContact CB-CG1 4.49Å; L273-L336 HydrophobicContact CD1-CB 4.11Å; L273-L336 HydrophobicContact CD1-CD1 4.24Å; L273-L336 HydrophobicContact CD2-CD1 4.19Å; L273-V340 HydrophobicContact CD1-CG2 4.04Å
274	Q	82.2	Confident	67.6	Low	79 Å²	79	78.2 Å²	78.2	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-68.9	-44.6	179.3	-174	172.6	-1.4	0	0	112.6	G270 K271 R276 L277 E278	G270-Q274 WeakPolarHBondContact O-CB 3.41Å; G270-Q274 PolarHBondContact O-N 3.45Å; K271-Q274 PolarHBondContact O-N 3.31Å; Q274-R276 PolarHBondContact O-N 2.85Å; Q274-R276 VanDerWaalsContact O-N 3.14Å; Q274-L277 PolarHBondContact O-N 3.06Å; Q274-E278 PolarHBondContact NE2-OE1 3.37Å; Q274-E278 PolarHBondContact O-N 3Å; Q274-E278 VanDerWaalsContact O-N 3.14Å
275	A	81.8	Confident	65.3	Low	64 Å²	64	84 Å²	84	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-58.6	-27.3	177.5	0	0	0	0	0	112.4	K271	K271-A275 WeakPolarHBondContact O-CB 3.35Å; K271-A275 PolarHBondContact O-N 3.36Å
276	R	72.1	Confident	62.8	Low	194 Å²	194	88.3 Å²	88.3	73%	0.732	48%	0.476	S	S	*	.	H	α-helix	trans	-78	-29.6	175.8	-161.5	62.3	175.2	168.2	1.3	113.3	A272 L273 Q274	A272-R276 PolarHBondContact O-N 3.22Å; L273-R276 PolarHBondContact O-N 3.14Å; Q274-R276 PolarHBondContact O-N 2.85Å; Q274-R276 VanDerWaalsContact O-N 3.14Å
277	L	69.9	Low	60	Low	78 Å²	78	98 Å²	98	41%	0.408	52%	0.518	S	S	.	.	H	α-helix	trans	-78	-37.4	-179	-157.9	125.9	0	0	0	112.2	L273 Q274 G279 K330 V333	L273-L277 PolarHBondContact O-N 3.41Å; Q274-L277 PolarHBondContact O-N 3.06Å; L277-G279 VanDerWaalsContact C-N 3.28Å; L277-K330 HydrophobicContact CD1-CG 4.35Å; L277-V333 HydrophobicContact CD1-CB 3.57Å; L277-V333 HydrophobicContact CD1-CG1 3.37Å; L277-V333 HydrophobicContact CD1-CG2 4.23Å
278	E	63.1	Low	57.3	Low	107 Å²	107	99.4 Å²	99.4	50%	0.5	54%	0.539	S	S	.	.	S	Bend	trans	-81.8	-6.3	179.9	-69.1	173.6	-166.2	0	0	113	Q274	Q274-E278 PolarHBondContact NE2-OE1 3.37Å; Q274-E278 PolarHBondContact O-N 3Å; Q274-E278 VanDerWaalsContact O-N 3.14Å
279	G	53.6	Low	54.5	Low	31 Å²	31	108 Å²	108	32%	0.32	57%	0.571	S	S	.	*			trans	65.5	172.5	-171.7	0	0	0	0	0	112.1	L277 N281	L277-G279 VanDerWaalsContact C-N 3.28Å; G279-N281 PolarHBondContact O-N 3.07Å
280	P	39.9	Very low	51.6	Low	126 Å²	126	114.6 Å²	114.6	82%	0.818	61%	0.61	S	S	*	*			trans	-64.8	104.3	170.3	26.2	-29.7	0	0	0	108.4	E282	P280-E282 PolarHBondContact O-N 3.16Å
281	N	35	Very low	48.6	Very low	113 Å²	113	119 Å²	119	60%	0.604	65%	0.645	S	S	*	*			trans	-53.7	113.6	167	-81.5	-35.1	0	0	0	108.1	G279 D283	G279-N281 PolarHBondContact O-N 3.07Å; N281-D283 PolarHBondContact O-N 3.13Å
282	E	32.1	Very low	45.7	Very low	193 Å²	193	116.6 Å²	116.6	90%	0.902	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	7.7	172.1	-73.9	-168.5	149.5	0	0	113.1	P280	P280-E282 PolarHBondContact O-N 3.16Å
283	D	32.7	Very low	42.7	Very low	140 Å²	140	120.4 Å²	120.4	75%	0.749	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	7.3	-166.6	-82.4	-26.3	0	0	0	116.7	N281	N281-D283 PolarHBondContact O-N 3.13Å
284	D	27.3	Very low	39.9	Very low	151 Å²	151	125.4 Å²	125.4	81%	0.807	72%	0.715	S	S	*	*	S	Bend	trans	-101.4	7	-179.5	-136.2	12.5	0	0	0	116.3
285	D	26.8	Very low	37	Very low	169 Å²	169	129.3 Å²	129.3	90%	0.904	74%	0.738	S	S	*	*	S	Bend	trans	-111.9	19.6	-176.6	-116.5	-6.1	0	0	0	116.2
286	S	26.7	Very low	34.5	Very low	101 Å²	101	135.6 Å²	135.6	71%	0.706	76%	0.757	S	S	*	*	S	Bend	trans	-134.5	22.6	177.5	71.5	0	0	0	0	117.5
287	K	24.1	Very low	32.1	Very low	208 Å²	208	134 Å²	134	90%	0.904	76%	0.757	S	S	*	*			trans	-117.9	54.8	171.9	-75.6	-177.7	-177.6	165.1	0	114.2
288	S	23.7	Very low	30	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	77%	0.768	S	S	*	*			trans	-142.5	56.1	159.4	66	0	0	0	0	112.3
289	K	24.9	Very low	28.2	Very low	201 Å²	201	140.6 Å²	140.6	87%	0.874	78%	0.783	S	S	*	*	S	Bend	trans	-133.3	94.8	159.3	-78.4	-172.4	179.2	171.9	0	110.4
290	V	24.9	Very low	26.9	Very low	138 Å²	138	142 Å²	142	84%	0.836	80%	0.798	S	S	*	*			trans	29.8	109.1	142.1	-169.6	0	0	0	0	116	S292	V290-S292 PolarHBondContact O-N 3.49Å; V290-S292 VanDerWaalsContact O-N 3.14Å
291	A	23.4	Very low	26.4	Very low	105 Å²	105	142.1 Å²	142.1	87%	0.868	80%	0.799	S	S	*	*			trans	-48.5	111.4	165.1	0	0	0	0	0	112.2
292	S	25.1	Very low	26.1	Very low	107 Å²	107	142.4 Å²	142.4	75%	0.748	81%	0.81	S	S	*	*			trans	-109.1	106.8	156.3	57	0	0	0	0	107.7	V290 S294	V290-S292 PolarHBondContact O-N 3.49Å; V290-S292 VanDerWaalsContact O-N 3.14Å; S292-S294 PolarHBondContact O-N 3.21Å
293	A	22.8	Very low	25.6	Very low	106 Å²	106	139.4 Å²	139.4	88%	0.876	80%	0.804	S	S	*	*			trans	-66.2	121.8	171.5	0	0	0	0	0	109.8
294	S	26.1	Very low	25.3	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	81%	0.806	S	S	*	*			trans	-143	104.5	160.4	58.4	0	0	0	0	108.1	S292 Q296	S292-S294 PolarHBondContact O-N 3.21Å; S294-Q296 PolarHBondContact O-N 3.2Å
295	D	20.8	Very low	25.3	Very low	161 Å²	161	136.5 Å²	136.5	86%	0.861	80%	0.802	S	S	*	*			trans	-54	127.8	165.3	-68	-54.7	0	0	0	110.2
296	Q	29.3	Very low	25.2	Very low	196 Å²	196	137.4 Å²	137.4	92%	0.916	80%	0.8	S	S	*	*			trans	-151.9	102.1	153.8	-108.1	172.3	31.1	0	0	110.1	S294	S294-Q296 PolarHBondContact O-N 3.2Å
297	E	22	Very low	25.4	Very low	161 Å²	161	138.6 Å²	138.6	75%	0.752	81%	0.805	S	S	*	*			trans	-15.6	153.1	151.6	-72.2	-176.3	173.7	0	0	119.9
298	Q	25.8	Very low	25.5	Very low	133 Å²	133	134 Å²	134	62%	0.621	80%	0.8	S	S	*	*			trans	101.4	120.1	138.7	-86.4	172.2	55.1	0	0	120.9
299	K	25.4	Very low	25.6	Very low	190 Å²	190	137.9 Å²	137.9	83%	0.826	81%	0.805	S	S	*	*			trans	73.2	133.2	142.9	-62.7	169.4	-179.8	167	0	116.4
300	G	25.1	Very low	25.7	Very low	61 Å²	61	133.2 Å²	133.2	63%	0.629	80%	0.798	S	S	*	*			cis	180	161.9	3.9	0	0	0	0	0	107.1
301	P	29.4	Very low	25.7	Very low	129 Å²	129	133.6 Å²	133.6	84%	0.838	80%	0.8	S	S	*	*			trans	-85.1	119.9	-167.3	31.7	-30.3	0	0	0	111.8
302	S	28.7	Very low	26	Very low	119 Å²	119	133.4 Å²	133.4	83%	0.832	79%	0.792	S	S	*	*			trans	-92.3	98.6	169.1	33.2	0	0	0	0	110.4
303	T	22.5	Very low	26.3	Very low	129 Å²	129	136.9 Å²	136.9	79%	0.791	80%	0.797	S	S	*	*			trans	-75.8	115.9	161.4	41.4	0	0	0	0	110.1
304	V	26.5	Very low	26.6	Very low	128 Å²	128	137.2 Å²	137.2	78%	0.776	79%	0.792	S	S	*	*			trans	-150	114.1	157.6	-167.7	0	0	0	0	111.5
305	S	28.2	Very low	26.9	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	80%	0.796	S	S	*	*			trans	60.1	117	143.5	62.6	0	0	0	0	122.1
306	E	24.4	Very low	27.4	Very low	188 Å²	188	141.5 Å²	141.5	88%	0.879	80%	0.795	S	S	*	*			trans	-49.2	136.8	154	-63.5	169.7	152	0	0	112.2	S308	E306-S308 PolarHBondContact O-N 2.72Å
307	P	30.8	Very low	27.7	Very low	125 Å²	125	141.4 Å²	141.4	81%	0.812	79%	0.792	S	S	*	*			trans	-82.6	115.6	172.1	23.7	-14.9	0	0	0	110
308	S	25.3	Very low	28.4	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	80%	0.797	S	S	*	*			trans	-59.9	130.4	170	49.4	0	0	0	0	111.7	E306 S310	E306-S308 PolarHBondContact O-N 2.72Å; S308-S310 PolarHBondContact O-N 2.77Å
309	Q	25.6	Very low	29.1	Very low	197 Å²	197	140 Å²	140	92%	0.921	80%	0.797	S	S	*	*			trans	-60	105.3	173.4	-66.1	167.9	-19.6	0	0	111.1
310	S	27.9	Very low	30.4	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	78%	0.775	S	S	*	*			trans	-107	111.4	159.5	58.4	0	0	0	0	108.2	S308 S312	S308-S310 PolarHBondContact O-N 2.77Å; S310-S312 VanDerWaalsContact C-N 3.27Å; S310-S312 PolarHBondContact O-N 3.26Å
311	V	24.8	Very low	32	Very low	146 Å²	146	138.9 Å²	138.9	89%	0.885	78%	0.784	S	S	*	*			trans	-66.7	86.8	170.6	-177.6	0	0	0	0	107.1
312	S	29.5	Very low	33.4	Very low	101 Å²	101	140.4 Å²	140.4	71%	0.706	78%	0.78	S	S	*	*			trans	-85.4	118.4	165	53.5	0	0	0	0	107.2	S310 S314	S310-S312 VanDerWaalsContact C-N 3.27Å; S310-S312 PolarHBondContact O-N 3.26Å; S312-S314 PolarHBondContact O-N 2.71Å
313	E	30.8	Very low	35.2	Very low	180 Å²	180	138.6 Å²	138.6	84%	0.841	76%	0.761	S	S	*	*			trans	-34.7	121.3	169.4	-67.7	165.4	161.1	0	0	109.9	E315	E313-E315 VanDerWaalsContact C-N 3.28Å; E313-E315 PolarHBondContact O-N 2.79Å
314	S	30.3	Very low	37.3	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	75%	0.75	S	S	*	*			trans	-60.3	91.6	177.7	46.9	0	0	0	0	108.6	S312 E316	S312-S314 PolarHBondContact O-N 2.71Å; S314-E316 PolarHBondContact O-N 3.36Å
315	E	30.8	Very low	39.6	Very low	177 Å²	177	135.9 Å²	135.9	83%	0.827	73%	0.733	S	S	*	*			trans	-54.5	109.8	156.1	-71.5	-178.1	162	0	0	105.7	E313 K317	E313-E315 VanDerWaalsContact C-N 3.28Å; E313-E315 PolarHBondContact O-N 2.79Å; E315-K317 PolarHBondContact O-N 3.31Å
316	E	31.8	Very low	41.9	Very low	181 Å²	181	135.9 Å²	135.9	85%	0.846	72%	0.722	S	S	*	*			trans	-52.8	88.2	168.7	-70.8	174.2	159.3	0	0	107.3	S314 T318	S314-E316 PolarHBondContact O-N 3.36Å; E316-T318 VanDerWaalsContact C-N 3.25Å; E316-T318 PolarHBondContact O-N 3.32Å; E316-T318 PolarHBondContact O-OG1 3Å
317	K	37	Very low	44.6	Very low	195 Å²	195	130.6 Å²	130.6	85%	0.848	71%	0.705	S	S	*	*			trans	-60.8	100.3	167.5	-82.8	-174.6	176	-178.3	0	105.5	E315 M319	E315-K317 PolarHBondContact O-N 3.31Å; K317-M319 VanDerWaalsContact C-N 3.32Å; K317-M319 PolarHBondContact O-N 3.01Å
318	T	35.9	Very low	47	Very low	138 Å²	138	127.3 Å²	127.3	85%	0.847	68%	0.677	S	S	*	*			trans	-57.8	102.6	169.2	-28	0	0	0	0	105	E316 S320	E316-T318 VanDerWaalsContact C-N 3.25Å; E316-T318 PolarHBondContact O-N 3.32Å; E316-T318 PolarHBondContact O-OG1 3Å; T318-S320 PolarHBondContact O-N 3.13Å
319	M	40.8	Very low	49.6	Very low	127 Å²	127	123.5 Å²	123.5	63%	0.626	65%	0.649	S	S	*	*			trans	-59.8	131	-177.9	-141.6	128.1	62.2	0	0	107	K317 D323	K317-M319 VanDerWaalsContact C-N 3.32Å; K317-M319 PolarHBondContact O-N 3.01Å; M319-D323 HydrophobicContact CG-CB 3.69Å
320	S	53.1	Low	52.4	Low	52 Å²	52	118.5 Å²	118.5	36%	0.364	62%	0.624	S	S	.	*			trans	-69.1	152	-178.5	67.9	0	0	0	0	109.7	T318 E322 D323 E324	T318-S320 PolarHBondContact O-N 3.13Å; S320-E322 PolarHBondContact O-N 2.83Å; S320-D323 PolarHBondContact N-OD2 2.8Å; S320-D323 WeakPolarHBondContact O-CB 3.33Å; S320-D323 PolarHBondContact O-N 3.2Å; S320-D323 PolarHBondContact OG-N 3.07Å; S320-D323 PolarHBondContact OG-OD2 2.9Å; S320-E324 PolarHBondContact O-N 3.41Å
321	E	57	Low	55.1	Low	175 Å²	175	116.8 Å²	116.8	82%	0.818	61%	0.612	S	S	*	*	H	α-helix	trans	-55.1	-27.1	176.1	-66.4	179	170	0	0	112	N325	E321-N325 PolarHBondContact O-N 3.04Å
322	E	59.5	Low	58.1	Low	161 Å²	161	110.9 Å²	110.9	75%	0.752	58%	0.575	S	S	*	*	H	α-helix	trans	-67.9	-41.8	174.9	-64.6	-176	171.6	0	0	112.2	S320 N325 E326	S320-E322 PolarHBondContact O-N 2.83Å; E322-N325 PolarHBondContact O-N 3.13Å; E322-E326 WeakPolarHBondContact O-CB 3.47Å; E322-E326 PolarHBondContact O-N 2.92Å
323	D	65.8	Low	60.7	Low	81 Å²	81	106.5 Å²	106.5	43%	0.433	54%	0.544	S	S	.	.	H	α-helix	trans	-66.5	-38.8	178.7	-63.8	-51.8	0	0	0	111.6	M319 S320 S327	M319-D323 HydrophobicContact CG-CB 3.69Å; S320-D323 PolarHBondContact N-OD2 2.8Å; S320-D323 WeakPolarHBondContact O-CB 3.33Å; S320-D323 PolarHBondContact O-N 3.2Å; S320-D323 PolarHBondContact OG-N 3.07Å; S320-D323 PolarHBondContact OG-OD2 2.9Å; D323-S327 WeakPolarHBondContact O-CB 3.27Å; D323-S327 PolarHBondContact O-N 2.83Å
324	E	68.4	Low	63.4	Low	119 Å²	119	100.8 Å²	100.8	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-65.8	-44.3	177.1	-70.7	-169.7	169.2	0	0	111.6	S320 S327 R328	S320-E324 PolarHBondContact O-N 3.41Å; E324-S327 PolarHBondContact O-N 2.74Å; E324-R328 WeakPolarHBondContact O-CB 3.5Å; E324-R328 PolarHBondContact O-N 2.91Å
325	N	73.2	Confident	66.2	Low	81 Å²	81	96.3 Å²	96.3	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-67	-38.4	178.7	-167.4	39.7	0	0	0	111.9	E321 E322 R328 V329	E321-N325 PolarHBondContact O-N 3.04Å; E322-N325 PolarHBondContact O-N 3.13Å; N325-R328 PolarHBondContact O-N 3.19Å; N325-R328 PolarHBondContact OD1-NE 3.24Å; N325-R328 PolarHBondContact OD1-NH2 2.72Å; N325-V329 VanDerWaalsContact O-CG2 3.32Å; N325-V329 WeakPolarHBondContact O-CG2 3.42Å; N325-V329 PolarHBondContact O-N 3.35Å
326	E	77.7	Confident	68.9	Low	102 Å²	102	87.9 Å²	87.9	48%	0.477	46%	0.458	S	S	.	.	H	α-helix	trans	-65.5	-42.8	176.1	-164.1	-173.4	158.7	0	0	111.7	E322 V329 K330	E322-E326 WeakPolarHBondContact O-CB 3.47Å; E322-E326 PolarHBondContact O-N 2.92Å; E326-V329 PolarHBondContact O-N 2.91Å; E326-K330 HydrophobicContact CG-CD 4.46Å; E326-K330 WeakPolarHBondContact O-CB 3.33Å; E326-K330 VanDerWaalsContact O-CG 3.3Å; E326-K330 WeakPolarHBondContact O-CG 3.5Å; E326-K330 PolarHBondContact O-N 3.09Å; E326-K330 WeakPolarHBondContact OE1-CE 3.45Å; E326-K330 IonicContact OE1-NZ 3.74Å; E326-K330 PolarHBondContact OE1-NZ 3.24Å
327	S	79.8	Confident	71.6	Confident	77 Å²	77	80.4 Å²	80.4	54%	0.538	42%	0.424	S	S	.	.	H	α-helix	trans	-61.9	-44	175	-175.2	0	0	0	0	112.1	D323 E324 K330 S331	D323-S327 WeakPolarHBondContact O-CB 3.27Å; D323-S327 PolarHBondContact O-N 2.83Å; E324-S327 PolarHBondContact O-N 2.74Å; S327-K330 PolarHBondContact O-N 3.49Å; S327-S331 PolarHBondContact O-N 2.86Å
328	R	81	Confident	74.1	Confident	56 Å²	56	75 Å²	75	21%	0.211	40%	0.398	C	S	.	.	H	α-helix	trans	-57.7	-52.7	176.3	-172.7	-178	68.8	84.5	4	111	I240 S241 D244 E324 N325 K330 S331 H332	I240-R328 PolarHBondContact O-NH1 3.38Å; S241-R328 PolarHBondContact O-NH2 2.91Å; D244-R328 WeakPolarHBondContact OD1-CD 3.47Å; D244-R328 IonicContact OD1-CZ 2.7Å; D244-R328 IonicContact OD1-NE 2.92Å; D244-R328 IonicContact OD1-NH1 3.65Å; D244-R328 PolarHBondContact OD1-NH1 3.11Å; E324-R328 WeakPolarHBondContact O-CB 3.5Å; E324-R328 PolarHBondContact O-N 2.91Å; N325-R328 PolarHBondContact O-N 3.19Å; N325-R328 PolarHBondContact OD1-NE 3.24Å; N325-R328 PolarHBondContact OD1-NH2 2.72Å; R328-K330 VanDerWaalsContact C-N 3.34Å; R328-K330 PolarHBondContact O-N 3.15Å; R328-S331 PolarHBondContact O-N 3.5Å; R328-S331 VanDerWaalsContact O-N 3.16Å; R328-S331 PolarHBondContact O-OG 2.91Å; R328-H332 PolarHBondContact O-CD2 3.37Å; R328-H332 PolarHBondContact O-N 2.97Å
329	V	80.2	Confident	76.7	Confident	32 Å²	32	68.5 Å²	68.5	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-42	179.1	173.6	0	0	0	0	111.5	I240 N325 E326 S331 H332 V333	I240-V329 HydrophobicContact CG2-CG1 4.45Å; N325-V329 VanDerWaalsContact O-CG2 3.32Å; N325-V329 WeakPolarHBondContact O-CG2 3.42Å; N325-V329 PolarHBondContact O-N 3.35Å; E326-V329 PolarHBondContact O-N 2.91Å; V329-S331 VanDerWaalsContact C-N 3.31Å; V329-S331 PolarHBondContact O-N 3.21Å; V329-H332 PolarHBondContact O-N 3.15Å; V329-V333 HydrophobicContact CG1-CG2 4.28Å; V329-V333 VanDerWaalsContact O-CG2 3.31Å; V329-V333 WeakPolarHBondContact O-CG2 3.33Å; V329-V333 PolarHBondContact O-N 3.5Å
330	K	84.8	Confident	79	Confident	92 Å²	92	62.7 Å²	62.7	40%	0.4	33%	0.33	S	S	.	.	H	α-helix	trans	-58.7	-41.6	176.3	-77.2	172.1	-178	167.4	0	112.4	L277 E326 S327 R328 V333 A334	L277-K330 HydrophobicContact CD1-CG 4.35Å; E326-K330 HydrophobicContact CG-CD 4.46Å; E326-K330 WeakPolarHBondContact O-CB 3.33Å; E326-K330 VanDerWaalsContact O-CG 3.3Å; E326-K330 WeakPolarHBondContact O-CG 3.5Å; E326-K330 PolarHBondContact O-N 3.09Å; E326-K330 WeakPolarHBondContact OE1-CE 3.45Å; E326-K330 IonicContact OE1-NZ 3.74Å; E326-K330 PolarHBondContact OE1-NZ 3.24Å; S327-K330 PolarHBondContact O-N 3.49Å; R328-K330 VanDerWaalsContact C-N 3.34Å; R328-K330 PolarHBondContact O-N 3.15Å; K330-V333 PolarHBondContact O-N 2.93Å; K330-A334 PolarHBondContact O-N 3.35Å
331	S	85.6	Confident	80.5	Confident	68 Å²	68	67.2 Å²	67.2	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-63.7	-44.2	178.3	79.4	0	0	0	0	112.4	S327 R328 V329 A334 A335	S327-S331 PolarHBondContact O-N 2.86Å; R328-S331 PolarHBondContact O-N 3.5Å; R328-S331 VanDerWaalsContact O-N 3.16Å; R328-S331 PolarHBondContact O-OG 2.91Å; V329-S331 VanDerWaalsContact C-N 3.31Å; V329-S331 PolarHBondContact O-N 3.21Å; S331-A334 WeakPolarHBondContact O-CB 3.28Å; S331-A334 PolarHBondContact O-N 3.24Å; S331-A335 PolarHBondContact O-N 3.31Å
332	H	86.3	Confident	82	Confident	21 Å²	21	58.9 Å²	58.9	10%	0.097	30%	0.3	C	S	.	.	H	α-helix	trans	-67.8	-36.1	177.8	-72.2	-67.7	0	0	0	112.7	I240 D244 Y251 R328 V329 A335 L336	I240-H332 HydrophobicContact CB-CB 4.29Å; I240-H332 HydrophobicContact CD1-CB 3.96Å; I240-H332 HydrophobicContact CG1-CB 4.06Å; I240-H332 HydrophobicContact CG2-CB 3.27Å; D244-H332 IonicContact OD1-CE1 3.8Å; D244-H332 IonicContact OD1-NE2 3.87Å; D244-H332 PolarHBondContact OD1-NE2 3.28Å; Y251-H332 AromaticContact CZ-ND1 3.56Å; Y251-H332 WeakPolarHBondContact OH-CA 3.33Å; Y251-H332 PolarHBondContact OH-ND1 3Å; R328-H332 PolarHBondContact O-CD2 3.37Å; R328-H332 PolarHBondContact O-N 2.97Å; V329-H332 PolarHBondContact O-N 3.15Å; H332-A335 WeakPolarHBondContact O-CB 3.25Å; H332-A335 PolarHBondContact O-N 3.14Å; H332-L336 PolarHBondContact O-N 2.98Å
333	V	85.7	Confident	83.3	Confident	9 Å²	9	54.1 Å²	54.1	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-37.9	174.7	176.2	0	0	0	0	111	L273 L277 V329 K330 L336 N337	L273-V333 HydrophobicContact CB-CG1 4.49Å; L277-V333 HydrophobicContact CD1-CB 3.57Å; L277-V333 HydrophobicContact CD1-CG1 3.37Å; L277-V333 HydrophobicContact CD1-CG2 4.23Å; V329-V333 HydrophobicContact CG1-CG2 4.28Å; V329-V333 VanDerWaalsContact O-CG2 3.31Å; V329-V333 WeakPolarHBondContact O-CG2 3.33Å; V329-V333 PolarHBondContact O-N 3.5Å; K330-V333 PolarHBondContact O-N 2.93Å; V333-L336 PolarHBondContact O-N 3.11Å; V333-N337 WeakPolarHBondContact O-CB 3.38Å; V333-N337 PolarHBondContact O-N 3.46Å; V333-N337 PolarHBondContact O-ND2 2.62Å
334	A	87.1	Confident	84.5	Confident	61 Å²	61	50.3 Å²	50.3	50%	0.504	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-42.9	173.3	0	0	0	0	0	111.8	K330 S331 N337 R338	K330-A334 PolarHBondContact O-N 3.35Å; S331-A334 WeakPolarHBondContact O-CB 3.28Å; S331-A334 PolarHBondContact O-N 3.24Å; A334-N337 PolarHBondContact O-N 2.95Å; A334-R338 PolarHBondContact O-N 3.31Å; A334-R338 VanDerWaalsContact O-N 3.07Å
335	A	87.7	Confident	85.6	Confident	17 Å²	17	44.7 Å²	44.7	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-45.1	173.7	0	0	0	0	0	112.2	Y251 S331 H332 N337 R338 I339 L808	Y251-A335 HydrophobicContact CE1-CB 3.91Å; Y251-A335 VanDerWaalsContact OH-CB 3.22Å; Y251-A335 WeakPolarHBondContact OH-CB 3.35Å; S331-A335 PolarHBondContact O-N 3.31Å; H332-A335 WeakPolarHBondContact O-CB 3.25Å; H332-A335 PolarHBondContact O-N 3.14Å; A335-N337 PolarHBondContact O-N 3.38Å; A335-R338 WeakPolarHBondContact O-CB 3.04Å; A335-R338 PolarHBondContact O-N 2.91Å; A335-I339 PolarHBondContact O-N 2.98Å; A335-I339 VanDerWaalsContact O-N 3.16Å; A335-L808 HydrophobicContact CB-CD1 3.61Å; A335-L808 HydrophobicContact CB-CG 4.36Å
336	L	87.8	Confident	86.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-44.2	172.9	-86.1	-173.7	0	0	0	112.5	L236 I240 Y251 A254 L273 H332 V333 R338 I339 V340	L236-L336 HydrophobicContact CB-CD1 3.88Å; I240-L336 HydrophobicContact CD1-CD1 3.06Å; I240-L336 HydrophobicContact CD1-CD2 4.4Å; I240-L336 HydrophobicContact CD1-CG 3.51Å; I240-L336 HydrophobicContact CG1-CD1 4.43Å; Y251-L336 HydrophobicContact CD1-CD2 3.73Å; Y251-L336 HydrophobicContact CD1-CG 4.12Å; Y251-L336 HydrophobicContact CE1-CD2 4.21Å; Y251-L336 HydrophobicContact CE1-CG 4.07Å; A254-L336 HydrophobicContact CB-CD2 3.68Å; L273-L336 HydrophobicContact CD1-CB 4.11Å; L273-L336 HydrophobicContact CD1-CD1 4.24Å; L273-L336 HydrophobicContact CD2-CD1 4.19Å; H332-L336 PolarHBondContact O-N 2.98Å; V333-L336 PolarHBondContact O-N 3.11Å; L336-R338 PolarHBondContact O-N 3.47Å; L336-I339 CarbonylContact O-C 3.51Å; L336-I339 WeakPolarHBondContact O-CB 3.05Å; L336-I339 PolarHBondContact O-N 3.32Å; L336-V340 WeakPolarHBondContact O-CB 3.45Å; L336-V340 VanDerWaalsContact O-CG2 3.29Å; L336-V340 WeakPolarHBondContact O-CG2 3.43Å; L336-V340 PolarHBondContact O-N 3.42Å
337	N	89.1	Confident	86.9	Confident	25 Å²	25	40.9 Å²	40.9	13%	0.134	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-37.1	178.7	-83.4	-41.9	0	0	0	111.6	V333 A334 A335 V340 R341	V333-N337 WeakPolarHBondContact O-CB 3.38Å; V333-N337 PolarHBondContact O-N 3.46Å; V333-N337 PolarHBondContact O-ND2 2.62Å; A334-N337 PolarHBondContact O-N 2.95Å; A335-N337 PolarHBondContact O-N 3.38Å; N337-V340 PolarHBondContact O-N 3.45Å; N337-R341 VanDerWaalsContact O-CB 3.32Å; N337-R341 WeakPolarHBondContact O-CB 3.49Å; N337-R341 VanDerWaalsContact O-CG 3.22Å; N337-R341 WeakPolarHBondContact O-CG 3.48Å; N337-R341 PolarHBondContact O-N 2.93Å
338	R	89.8	Confident	87.4	Confident	82 Å²	82	37.8 Å²	37.8	31%	0.309	19%	0.192	S	C	.	.	H	α-helix	trans	-62.3	-40.4	173.3	-169.2	-175.8	172	-166.2	-1.6	112	A334 A335 L336 G342 D343 L344 E347	A334-R338 PolarHBondContact O-N 3.31Å; A334-R338 VanDerWaalsContact O-N 3.07Å; A335-R338 WeakPolarHBondContact O-CB 3.04Å; A335-R338 PolarHBondContact O-N 2.91Å; L336-R338 PolarHBondContact O-N 3.47Å; R338-G342 CarbonylContact O-C 3.5Å; R338-G342 PolarHBondContact O-N 3.29Å; R338-D343 HydrophobicContact CG-CB 3.9Å; R338-D343 PolarHBondContact O-N 3.49Å; R338-L344 HydrophobicContact CG-CB 4.23Å; R338-E347 IonicContact CZ-OE2 3.88Å; R338-E347 IonicContact NH2-OE1 3.73Å; R338-E347 IonicContact NH2-OE2 2.64Å; R338-E347 PolarHBondContact NH2-OE2 3.44Å
339	I	90.5	Very high	88	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-70.3	-44.4	176.2	-64.1	169	0	0	0	111.5	Y251 A254 L255 A335 L336 G342 L344 Q345 L808	Y251-I339 HydrophobicContact CD1-CD1 3.95Å; Y251-I339 HydrophobicContact CG-CD1 4.01Å; A254-I339 HydrophobicContact CB-CG2 3.75Å; L255-I339 HydrophobicContact CD2-CG2 3.79Å; L255-I339 HydrophobicContact CG-CG2 3.84Å; A335-I339 PolarHBondContact O-N 2.98Å; A335-I339 VanDerWaalsContact O-N 3.16Å; L336-I339 CarbonylContact O-C 3.51Å; L336-I339 WeakPolarHBondContact O-CB 3.05Å; L336-I339 PolarHBondContact O-N 3.32Å; I339-G342 VanDerWaalsContact O-CA 3.25Å; I339-G342 WeakPolarHBondContact O-CA 3.45Å; I339-G342 PolarHBondContact O-N 2.82Å; I339-L344 HydrophobicContact CD1-CD2 4.46Å; I339-L344 HydrophobicContact CG1-CD2 3.82Å; I339-Q345 PolarHBondContact O-NE2 2.93Å; I339-Q345 PolarHBondContact O-OE1 3.45Å; I339-L808 HydrophobicContact CD1-CD1 4.33Å; I339-L808 HydrophobicContact CD1-CD2 3.97Å; I339-L808 HydrophobicContact CG1-CD1 4.32Å
340	V	88.4	Confident	88.5	Confident	5 Å²	5	36 Å²	36	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-38.4	-175.9	165.5	0	0	0	0	111.5	M266 I269 L273 L336 N337 G342	M266-V340 HydrophobicContact CE-CB 4.15Å; M266-V340 HydrophobicContact CE-CG1 4.02Å; M266-V340 HydrophobicContact CE-CG2 4.14Å; M266-V340 WeakPolarHBondContact O-CG1 3.48Å; I269-V340 HydrophobicContact CB-CG1 4.17Å; I269-V340 HydrophobicContact CG2-CG1 4.12Å; I269-V340 HydrophobicContact CG2-CG2 3.96Å; L273-V340 HydrophobicContact CD1-CG2 4.04Å; L336-V340 WeakPolarHBondContact O-CB 3.45Å; L336-V340 VanDerWaalsContact O-CG2 3.29Å; L336-V340 WeakPolarHBondContact O-CG2 3.43Å; L336-V340 PolarHBondContact O-N 3.42Å; N337-V340 PolarHBondContact O-N 3.45Å; V340-G342 PolarHBondContact O-N 3.13Å
341	R	85.2	Confident	88.6	Confident	147 Å²	147	32.3 Å²	32.3	56%	0.555	17%	0.167	S	C	*	.	H	α-helix	trans	-68.1	-23.4	169.5	-70.7	174.7	-178.6	-172.9	1.6	112.3	N337 D343 R465	N337-R341 VanDerWaalsContact O-CB 3.32Å; N337-R341 WeakPolarHBondContact O-CB 3.49Å; N337-R341 VanDerWaalsContact O-CG 3.22Å; N337-R341 WeakPolarHBondContact O-CG 3.48Å; N337-R341 PolarHBondContact O-N 2.93Å; R341-D343 WeakPolarHBondContact CB-OD2 3.18Å; R341-R465 PolarHBondContact O-NH1 2.79Å; R341-R465 PolarHBondContact O-NH2 2.84Å
342	G	87.3	Confident	88.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	1.2	-179.8	0	0	0	0	0	113.8	R338 I339 V340 L344 Q345 T346 R465	R338-G342 CarbonylContact O-C 3.5Å; R338-G342 PolarHBondContact O-N 3.29Å; I339-G342 VanDerWaalsContact O-CA 3.25Å; I339-G342 WeakPolarHBondContact O-CA 3.45Å; I339-G342 PolarHBondContact O-N 2.82Å; V340-G342 PolarHBondContact O-N 3.13Å; G342-L344 PolarHBondContact O-N 3.16Å; G342-Q345 PolarHBondContact O-N 3.48Å; G342-Q345 PolarHBondContact O-OE1 3.23Å; G342-T346 PolarHBondContact O-N 2.9Å; G342-R465 VanDerWaalsContact C-CZ 3.5Å; G342-R465 PolarHBondContact O-NH1 3.34Å
343	D	88.5	Confident	89.2	Confident	61 Å²	61	30 Å²	30	33%	0.326	15%	0.148	S	C	.	.	H	α-helix	trans	-54.7	-42.4	-169.1	-62.4	-42.3	0	0	0	110.6	R338 R341 T346 E347 R465	R338-D343 HydrophobicContact CG-CB 3.9Å; R338-D343 PolarHBondContact O-N 3.49Å; R341-D343 WeakPolarHBondContact CB-OD2 3.18Å; D343-T346 PolarHBondContact O-N 3.41Å; D343-E347 WeakPolarHBondContact O-CB 3.27Å; D343-E347 PolarHBondContact O-N 2.88Å; D343-E347 VanDerWaalsContact O-N 3.11Å; D343-R465 IonicContact OD1-CZ 2.98Å; D343-R465 IonicContact OD1-NH2 3.94Å; D343-R465 PolarHBondContact OD1-NH2 3.17Å
344	L	90.1	Very high	89.3	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-49.1	175.8	-179.1	67.7	0	0	0	112.1	R338 I339 G342 T346 E347 L348 I804 L808	R338-L344 HydrophobicContact CG-CB 4.23Å; I339-L344 HydrophobicContact CD1-CD2 4.46Å; I339-L344 HydrophobicContact CG1-CD2 3.82Å; G342-L344 PolarHBondContact O-N 3.16Å; L344-T346 PolarHBondContact O-N 3.45Å; L344-E347 PolarHBondContact O-N 3.39Å; L344-L348 HydrophobicContact CD1-CD1 3.85Å; L344-L348 HydrophobicContact CD1-CG 4.16Å; L344-L348 HydrophobicContact CD2-CD1 4.38Å; L344-L348 HydrophobicContact CG-CD1 3.72Å; L344-L348 HydrophobicContact CG-CG 4.37Å; L344-L348 WeakPolarHBondContact O-CB 3.4Å; L344-L348 VanDerWaalsContact O-CG 3.23Å; L344-L348 WeakPolarHBondContact O-CG 3.48Å; L344-L348 PolarHBondContact O-N 2.87Å; L344-I804 HydrophobicContact CD2-CD1 3.82Å; L344-L808 HydrophobicContact CD1-CB 4.15Å; L344-L808 HydrophobicContact CD2-CB 4.15Å; L344-L808 HydrophobicContact CD2-CD1 4.19Å; L344-L808 HydrophobicContact CD2-CD2 4Å; L344-L808 HydrophobicContact CD2-CG 4.35Å
345	Q	90.7	Very high	89.3	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-63.8	-43	-176.6	-62.5	89.6	-48.5	0	0	111.1	L255 H258 I339 G342 L348 Y349 I917	L255-Q345 HydrophobicContact CD2-CG 3.71Å; H258-Q345 PolarHBondContact ND1-NE2 3.07Å; I339-Q345 PolarHBondContact O-NE2 2.93Å; I339-Q345 PolarHBondContact O-OE1 3.45Å; G342-Q345 PolarHBondContact O-N 3.48Å; G342-Q345 PolarHBondContact O-OE1 3.23Å; Q345-L348 PolarHBondContact O-N 2.86Å; Q345-Y349 HydrophobicContact CB-CD2 4.36Å; Q345-Y349 HydrophobicContact CB-CE2 4.01Å; Q345-Y349 WeakPolarHBondContact O-CB 3.46Å; Q345-Y349 WeakPolarHBondContact O-CD2 3.4Å; Q345-Y349 PolarHBondContact O-N 3.05Å; Q345-I917 HydrophobicContact CB-CD1 3.95Å; Q345-I917 HydrophobicContact CG-CD1 3.68Å
346	T	89.9	Confident	89.3	Confident	28 Å²	28	33.7 Å²	33.7	17%	0.172	15%	0.153	C	C	.	.	H	α-helix	trans	-61.3	-46.8	177.1	-66.9	0	0	0	0	111.1	G342 D343 L344 Y349 L350 G425 R465	G342-T346 PolarHBondContact O-N 2.9Å; D343-T346 PolarHBondContact O-N 3.41Å; L344-T346 PolarHBondContact O-N 3.45Å; T346-Y349 PolarHBondContact O-N 3.45Å; T346-L350 VanDerWaalsContact O-CB 3.23Å; T346-L350 WeakPolarHBondContact O-CB 3.43Å; T346-L350 PolarHBondContact O-N 3.19Å; T346-G425 VanDerWaalsContact CG2-CA 3.49Å; T346-G425 WeakPolarHBondContact CG2-O 3.39Å; T346-R465 PolarHBondContact OG1-NH1 3.08Å
347	E	89.9	Confident	89.3	Confident	74 Å²	74	36.1 Å²	36.1	35%	0.346	17%	0.165	S	C	.	.	H	α-helix	trans	-61.4	-47.6	179.1	-176	-177.6	171	0	0	111.8	R338 D343 L344 L350 Q351	R338-E347 IonicContact CZ-OE2 3.88Å; R338-E347 IonicContact NH2-OE1 3.73Å; R338-E347 IonicContact NH2-OE2 2.64Å; R338-E347 PolarHBondContact NH2-OE2 3.44Å; D343-E347 WeakPolarHBondContact O-CB 3.27Å; D343-E347 PolarHBondContact O-N 2.88Å; D343-E347 VanDerWaalsContact O-N 3.11Å; L344-E347 PolarHBondContact O-N 3.39Å; E347-L350 WeakPolarHBondContact O-CB 3.47Å; E347-L350 PolarHBondContact O-N 3.16Å; E347-Q351 WeakPolarHBondContact O-CG 3.4Å; E347-Q351 PolarHBondContact O-N 3.42Å
348	L	90.7	Very high	89.2	Confident	13 Å²	13	38.7 Å²	38.7	7%	0.068	18%	0.177	C	C	.	.	H	α-helix	trans	-64.4	-42.9	179.9	-68.9	172.4	0	0	0	112.2	L344 Q345 Q351 F352 I802 I804 M810 I917	L344-L348 HydrophobicContact CD1-CD1 3.85Å; L344-L348 HydrophobicContact CD1-CG 4.16Å; L344-L348 HydrophobicContact CD2-CD1 4.38Å; L344-L348 HydrophobicContact CG-CD1 3.72Å; L344-L348 HydrophobicContact CG-CG 4.37Å; L344-L348 WeakPolarHBondContact O-CB 3.4Å; L344-L348 VanDerWaalsContact O-CG 3.23Å; L344-L348 WeakPolarHBondContact O-CG 3.48Å; L344-L348 PolarHBondContact O-N 2.87Å; Q345-L348 PolarHBondContact O-N 2.86Å; L348-Q351 PolarHBondContact O-N 2.83Å; L348-F352 WeakPolarHBondContact O-CB 3.42Å; L348-F352 PolarHBondContact O-N 3.08Å; L348-I802 HydrophobicContact CB-CD1 4.02Å; L348-I802 HydrophobicContact CD1-CG2 4.35Å; L348-I802 HydrophobicContact CD2-CG2 4.21Å; L348-I804 HydrophobicContact CD1-CG2 3.71Å; L348-I804 HydrophobicContact CD2-CG2 4.28Å; L348-M810 HydrophobicContact CD2-SD 4.4Å; L348-I917 HydrophobicContact CB-CD1 4.42Å; L348-I917 HydrophobicContact CD1-CD1 3.88Å; L348-I917 HydrophobicContact CD1-CG1 4.21Å; L348-I917 HydrophobicContact CD1-CG2 4.09Å
349	Y	92.2	Very high	89.1	Confident	30 Å²	30	35.6 Å²	35.6	12%	0.118	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-37.6	176.1	-65.1	-36.9	0	0	0	112	Q345 T346 F352 Y353 R764 P798 I802 I917	Q345-Y349 HydrophobicContact CB-CD2 4.36Å; Q345-Y349 HydrophobicContact CB-CE2 4.01Å; Q345-Y349 WeakPolarHBondContact O-CB 3.46Å; Q345-Y349 WeakPolarHBondContact O-CD2 3.4Å; Q345-Y349 PolarHBondContact O-N 3.05Å; T346-Y349 PolarHBondContact O-N 3.45Å; Y349-F352 WeakPolarHBondContact O-CB 3.24Å; Y349-F352 PolarHBondContact O-N 3.32Å; Y349-Y353 WeakPolarHBondContact O-CD2 3.49Å; Y349-Y353 VanDerWaalsContact O-CG 3.31Å; Y349-Y353 PolarHBondContact O-N 2.97Å; Y349-R764 PolarHBondContact OH-NH2 3.27Å; Y349-R764 VanDerWaalsContact OH-NH2 3.17Å; Y349-P798 HydrophobicContact CD1-CB 3.98Å; Y349-P798 HydrophobicContact CD1-CG 3.7Å; Y349-P798 HydrophobicContact CD2-CG 4.04Å; Y349-P798 HydrophobicContact CE1-CB 4.13Å; Y349-P798 HydrophobicContact CE1-CG 3.55Å; Y349-P798 HydrophobicContact CE2-CG 3.91Å; Y349-P798 HydrophobicContact CG-CB 4.43Å; Y349-P798 HydrophobicContact CG-CG 3.96Å; Y349-I802 HydrophobicContact CD1-CD1 4.13Å; Y349-I802 HydrophobicContact CE1-CD1 4.39Å; Y349-I917 HydrophobicContact CE1-CD1 4.01Å; Y349-I917 HydrophobicContact CE1-CG1 4.1Å; Y349-I917 HydrophobicContact CE2-CD1 4.43Å
350	L	90.2	Very high	88.9	Confident	21 Å²	21	36.8 Å²	36.8	11%	0.11	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-47.4	174.9	-173	66.8	0	0	0	111	T346 E347 F352 Y353 M354 G390 T392 H426	T346-L350 VanDerWaalsContact O-CB 3.23Å; T346-L350 WeakPolarHBondContact O-CB 3.43Å; T346-L350 PolarHBondContact O-N 3.19Å; E347-L350 WeakPolarHBondContact O-CB 3.47Å; E347-L350 PolarHBondContact O-N 3.16Å; L350-F352 VanDerWaalsContact C-N 3.31Å; L350-F352 PolarHBondContact O-N 2.9Å; L350-Y353 PolarHBondContact O-N 3.26Å; L350-M354 HydrophobicContact CD1-CE 3.56Å; L350-M354 HydrophobicContact CD2-CE 3.91Å; L350-M354 HydrophobicContact CG-CE 3.49Å; L350-M354 VanDerWaalsContact CG-CE 3.49Å; L350-M354 HydrophobicContact CG-SD 4.2Å; L350-M354 VanDerWaalsContact O-CG 3.31Å; L350-M354 WeakPolarHBondContact O-CG 3.45Å; L350-M354 PolarHBondContact O-N 3.05Å; L350-G390 WeakPolarHBondContact CD1-O 3.42Å; L350-T392 HydrophobicContact CD1-CG2 4.06Å; L350-H426 HydrophobicContact CD1-CB 4.41Å; L350-H426 HydrophobicContact CD2-CB 4.35Å
351	Q	88.8	Confident	88.8	Confident	13 Å²	13	38.2 Å²	38.2	6%	0.061	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-44.2	173.9	-72.6	-60.9	-41	0	0	112.1	E347 L348 K355 V935	E347-Q351 WeakPolarHBondContact O-CG 3.4Å; E347-Q351 PolarHBondContact O-N 3.42Å; L348-Q351 PolarHBondContact O-N 2.83Å; Q351-K355 WeakPolarHBondContact O-CB 3.38Å; Q351-K355 WeakPolarHBondContact O-CG 3.5Å; Q351-K355 PolarHBondContact O-N 3.38Å; Q351-K355 VanDerWaalsContact O-N 3.07Å; Q351-V935 PolarHBondContact NE2-O 3.3Å; Q351-V935 PolarHBondContact OE1-O 3.46Å
352	F	91.8	Very high	89	Confident	26 Å²	26	33 Å²	33	11%	0.114	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-47.5	177.9	165.6	-109.6	0	0	0	112.3	L348 Y349 L350 K355 N356 N756 C800 I802	L348-F352 WeakPolarHBondContact O-CB 3.42Å; L348-F352 PolarHBondContact O-N 3.08Å; Y349-F352 WeakPolarHBondContact O-CB 3.24Å; Y349-F352 PolarHBondContact O-N 3.32Å; L350-F352 VanDerWaalsContact C-N 3.31Å; L350-F352 PolarHBondContact O-N 2.9Å; F352-K355 PolarHBondContact O-N 3.46Å; F352-N356 HydrophobicContact CD2-CB 4.49Å; F352-N356 WeakPolarHBondContact CD2-ND2 3.38Å; F352-N356 HydrophobicContact CE2-CB 4.18Å; F352-N356 WeakPolarHBondContact O-CB 3.47Å; F352-N356 PolarHBondContact O-N 3.05Å; F352-N356 PolarHBondContact O-ND2 3.32Å; F352-N356 VanDerWaalsContact O-ND2 3.11Å; F352-N756 HydrophobicContact CE1-CB 3.47Å; F352-N756 VanDerWaalsContact CE1-CB 3.47Å; F352-N756 HydrophobicContact CZ-CB 3.51Å; F352-C800 HydrophobicContact CD1-CB 3.9Å; F352-C800 HydrophobicContact CD2-CB 3.78Å; F352-C800 HydrophobicContact CE1-CB 3.64Å; F352-C800 HydrophobicContact CE2-CB 3.56Å; F352-C800 HydrophobicContact CG-CB 3.95Å; F352-C800 HydrophobicContact CZ-CB 3.47Å; F352-C800 VanDerWaalsContact CZ-CB 3.47Å; F352-I802 HydrophobicContact CB-CD1 4.22Å
353	Y	91.5	Very high	89.1	Confident	14 Å²	14	33.3 Å²	33.3	6%	0.055	17%	0.166	C	C	.	.	H	α-helix	trans	-64.6	-41	179.6	-67.8	-48.1	0	0	0	112.7	Y349 L350 N357 G390 N756 V757 P798	Y349-Y353 WeakPolarHBondContact O-CD2 3.49Å; Y349-Y353 VanDerWaalsContact O-CG 3.31Å; Y349-Y353 PolarHBondContact O-N 2.97Å; L350-Y353 PolarHBondContact O-N 3.26Å; Y353-N357 PolarHBondContact O-N 3.19Å; Y353-G390 WeakPolarHBondContact CB-O 3.38Å; Y353-N756 HydrophobicContact CD1-CB 4.34Å; Y353-N756 HydrophobicContact CE1-CB 4.35Å; Y353-V757 HydrophobicContact CE1-CG1 3.46Å; Y353-V757 VanDerWaalsContact CE1-CG1 3.46Å; Y353-V757 VanDerWaalsContact OH-CG1 3.31Å; Y353-V757 WeakPolarHBondContact OH-CG1 3.4Å; Y353-P798 HydrophobicContact CE1-CB 4.33Å; Y353-P798 WeakPolarHBondContact OH-CB 3.48Å
354	M	88.2	Confident	89.2	Confident	28 Å²	28	30.4 Å²	30.4	14%	0.138	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-47.3	178.1	-72.2	172.4	179.4	0	0	111.8	L350 T392 P937	L350-M354 HydrophobicContact CD1-CE 3.56Å; L350-M354 HydrophobicContact CD2-CE 3.91Å; L350-M354 HydrophobicContact CG-CE 3.49Å; L350-M354 VanDerWaalsContact CG-CE 3.49Å; L350-M354 HydrophobicContact CG-SD 4.2Å; L350-M354 VanDerWaalsContact O-CG 3.31Å; L350-M354 WeakPolarHBondContact O-CG 3.45Å; L350-M354 PolarHBondContact O-N 3.05Å; M354-T392 HydrophobicContact CE-CG2 3.23Å; M354-T392 VanDerWaalsContact CE-OG1 3.3Å; M354-T392 WeakPolarHBondContact CE-OG1 3.32Å; M354-P937 HydrophobicContact CE-CB 3.63Å; M354-P937 HydrophobicContact CE-CG 3.67Å; M354-P937 HydrophobicContact SD-CB 4.32Å; M354-P937 HydrophobicContact SD-CG 4.27Å
355	K	87.4	Confident	89.3	Confident	83 Å²	83	34.7 Å²	34.7	36%	0.361	17%	0.169	S	C	.	.	H	α-helix	trans	-70.1	-34.9	-177.2	-73.3	-176.5	174.6	-164.6	0	113.5	Q351 F352 E933 V935	Q351-K355 WeakPolarHBondContact O-CB 3.38Å; Q351-K355 WeakPolarHBondContact O-CG 3.5Å; Q351-K355 PolarHBondContact O-N 3.38Å; Q351-K355 VanDerWaalsContact O-N 3.07Å; F352-K355 PolarHBondContact O-N 3.46Å; K355-E933 WeakPolarHBondContact CE-O 3.5Å; K355-E933 PolarHBondContact NZ-O 3.15Å; K355-V935 HydrophobicContact CD-CG2 4.37Å; K355-V935 VanDerWaalsContact CE-CG2 3.4Å; K355-V935 HydrophobicContact CG-CG2 3.98Å
356	N	86.9	Confident	89.3	Confident	55 Å²	55	35.9 Å²	35.9	29%	0.294	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	32.9	-172.8	-61.5	-76.1	0	0	0	112.5	F352 H358 N756	F352-N356 HydrophobicContact CD2-CB 4.49Å; F352-N356 WeakPolarHBondContact CD2-ND2 3.38Å; F352-N356 HydrophobicContact CE2-CB 4.18Å; F352-N356 WeakPolarHBondContact O-CB 3.47Å; F352-N356 PolarHBondContact O-N 3.05Å; F352-N356 PolarHBondContact O-ND2 3.32Å; F352-N356 VanDerWaalsContact O-ND2 3.11Å; N356-H358 PolarHBondContact O-N 2.95Å; N356-H358 PolarHBondContact O-ND1 3.46Å; N356-N756 PolarHBondContact O-ND2 3.42Å
357	N	87.6	Confident	89.4	Confident	50 Å²	50	34.6 Å²	34.6	27%	0.267	17%	0.168	S	C	.	.			trans	-73.2	97.3	178.8	-178.6	16.2	0	0	0	111.8	Y353 S359 T391	Y353-N357 PolarHBondContact O-N 3.19Å; N357-S359 PolarHBondContact ND2-OG 3.41Å; N357-S359 VanDerWaalsContact OD1-CB 3.28Å; N357-S359 WeakPolarHBondContact OD1-CB 3.47Å; N357-S359 PolarHBondContact OD1-N 3.49Å; N357-S359 VanDerWaalsContact OD1-N 3.17Å; N357-S359 PolarHBondContact OD1-OG 2.99Å; N357-T391 HydrophobicContact CB-CG2 4.13Å
358	H	88.3	Confident	89.5	Confident	80 Å²	80	33.3 Å²	33.3	37%	0.37	16%	0.161	S	C	.	.			trans	-102.7	31	176.1	-58.2	83.3	0	0	0	112.3	N356 G754 Y826	N356-H358 PolarHBondContact O-N 2.95Å; N356-H358 PolarHBondContact O-ND1 3.46Å; H358-G754 PolarHBondContact N-O 3.39Å; H358-Y826 HydrophobicContact CB-CD1 3.97Å; H358-Y826 HydrophobicContact CB-CE1 4.29Å; H358-Y826 HydrophobicContact CB-CG 4.15Å; H358-Y826 AromaticContact CD2-CD2 3.62Å; H358-Y826 AromaticContact CD2-CE2 3.99Å; H358-Y826 AromaticContact CD2-CG 3.91Å; H358-Y826 AromaticContact CE1-CD2 3.68Å; H358-Y826 AromaticContact CE1-CE2 3.22Å; H358-Y826 WeakPolarHBondContact CE1-CE2 3.49Å; H358-Y826 AromaticContact CE1-CZ 3.61Å; H358-Y826 AromaticContact CG-CD1 3.93Å; H358-Y826 AromaticContact CG-CD2 3.79Å; H358-Y826 AromaticContact CG-CE2 3.92Å; H358-Y826 AromaticContact CG-CG 3.8Å; H358-Y826 AromaticContact ND1-CD2 3.81Å; H358-Y826 AromaticContact ND1-CE1 3.73Å; H358-Y826 AromaticContact ND1-CE2 3.44Å; H358-Y826 WeakPolarHBondContact ND1-CE2 3.5Å; H358-Y826 AromaticContact ND1-CZ 3.39Å; H358-Y826 AromaticContact NE2-CD2 3.56Å; H358-Y826 AromaticContact NE2-CE2 3.57Å
359	S	86.2	Confident	89.5	Confident	17 Å²	17	38.1 Å²	38.1	12%	0.119	19%	0.187	C	C	.	.			trans	-69.8	132	175	54.1	0	0	0	0	111.1	N357 I361 H388	N357-S359 PolarHBondContact ND2-OG 3.41Å; N357-S359 VanDerWaalsContact OD1-CB 3.28Å; N357-S359 WeakPolarHBondContact OD1-CB 3.47Å; N357-S359 PolarHBondContact OD1-N 3.49Å; N357-S359 VanDerWaalsContact OD1-N 3.17Å; N357-S359 PolarHBondContact OD1-OG 2.99Å; S359-I361 PolarHBondContact O-N 3.47Å; S359-H388 PolarHBondContact OG-CE1 3.29Å; S359-H388 PolarHBondContact OG-ND1 3.4Å
360	D	87.4	Confident	89.2	Confident	25 Å²	25	41.3 Å²	41.3	13%	0.134	20%	0.2	C	C	.	.			trans	-91.4	99.1	-179.3	-174.8	-9.5	0	0	0	110.9	L362 I363 M387 M830	D360-L362 PolarHBondContact O-N 2.85Å; D360-L362 WeakPolarHBondContact OD1-CA 3.19Å; D360-L362 WeakPolarHBondContact OD1-CB 3.32Å; D360-L362 PolarHBondContact OD1-N 2.86Å; D360-I363 HydrophobicContact CB-CD1 3.78Å; D360-I363 HydrophobicContact CB-CG1 3.96Å; D360-I363 WeakPolarHBondContact O-CB 3.28Å; D360-I363 PolarHBondContact O-N 2.95Å; D360-M387 WeakPolarHBondContact O-CE 3.37Å; D360-M830 VanDerWaalsContact OD2-CB 3.25Å; D360-M830 WeakPolarHBondContact OD2-CB 3.31Å; D360-M830 PolarHBondContact OD2-N 2.91Å
361	I	87.1	Confident	88.9	Confident	35 Å²	35	41.1 Å²	41.1	18%	0.179	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-25.4	179	-57.9	175	0	0	0	111.4	S359 I363 L364 K365 E395	S359-I361 PolarHBondContact O-N 3.47Å; I361-I363 VanDerWaalsContact C-N 3.28Å; I361-I363 PolarHBondContact O-N 3.49Å; I361-L364 PolarHBondContact O-N 3.45Å; I361-L364 VanDerWaalsContact O-N 3.17Å; I361-K365 HydrophobicContact CG2-CD 4.3Å; I361-K365 HydrophobicContact CG2-CG 4.32Å; I361-K365 WeakPolarHBondContact O-CG 3.27Å; I361-K365 PolarHBondContact O-N 3.36Å; I361-E395 WeakPolarHBondContact CD1-OE2 3.44Å
362	L	88.2	Confident	88.5	Confident	38 Å²	38	51.2 Å²	51.2	20%	0.199	24%	0.237	C	C	.	.	H	α-helix	trans	-67.9	-31	179	-172.4	62.1	0	0	0	112	D360 K365 T366 M830 E832	D360-L362 PolarHBondContact O-N 2.85Å; D360-L362 WeakPolarHBondContact OD1-CA 3.19Å; D360-L362 WeakPolarHBondContact OD1-CB 3.32Å; D360-L362 PolarHBondContact OD1-N 2.86Å; L362-K365 HydrophobicContact CD1-CB 4.5Å; L362-K365 HydrophobicContact CD1-CD 4.48Å; L362-K365 PolarHBondContact O-N 3.15Å; L362-T366 WeakPolarHBondContact O-CB 3.24Å; L362-T366 PolarHBondContact O-N 3.02Å; L362-T366 PolarHBondContact O-OG1 3.34Å; L362-M830 HydrophobicContact CB-CB 4.49Å; L362-M830 HydrophobicContact CD2-CB 3.88Å; L362-M830 HydrophobicContact CD2-CG 3.98Å; L362-M830 WeakPolarHBondContact CD2-O 3.42Å; L362-M830 HydrophobicContact CD2-SD 4.45Å; L362-M830 HydrophobicContact CG-CB 4.42Å; L362-M830 HydrophobicContact CG-SD 4.44Å; L362-E832 HydrophobicContact CD1-CG 4.45Å; L362-E832 HydrophobicContact CD2-CB 4.48Å; L362-E832 HydrophobicContact CD2-CG 3.92Å
363	I	89.8	Confident	88.2	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-59.3	-50.5	170.6	-64	176.1	0	0	0	109.2	D360 I361 K365 T366 I367 H747 D751 M830	D360-I363 HydrophobicContact CB-CD1 3.78Å; D360-I363 HydrophobicContact CB-CG1 3.96Å; D360-I363 WeakPolarHBondContact O-CB 3.28Å; D360-I363 PolarHBondContact O-N 2.95Å; I361-I363 VanDerWaalsContact C-N 3.28Å; I361-I363 PolarHBondContact O-N 3.49Å; I363-K365 PolarHBondContact O-N 2.9Å; I363-T366 WeakPolarHBondContact O-CB 3.42Å; I363-T366 PolarHBondContact O-N 3.21Å; I363-I367 HydrophobicContact CG2-CD1 3.79Å; I363-I367 HydrophobicContact CG2-CG1 4.36Å; I363-I367 VanDerWaalsContact O-CG1 3.25Å; I363-I367 WeakPolarHBondContact O-CG1 3.41Å; I363-I367 PolarHBondContact O-N 3.08Å; I363-H747 HydrophobicContact CG2-CB 4.44Å; I363-D751 VanDerWaalsContact CD1-OD2 3.28Å; I363-D751 WeakPolarHBondContact CD1-OD2 3.38Å; I363-M830 HydrophobicContact CG1-CE 3.81Å
364	L	91.3	Very high	88	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-41.2	179.9	-68.5	172.7	0	0	0	112.6	I361 I367 K368 N384 M387 F396	I361-L364 PolarHBondContact O-N 3.45Å; I361-L364 VanDerWaalsContact O-N 3.17Å; L364-I367 PolarHBondContact O-N 3.39Å; L364-K368 VanDerWaalsContact O-CB 3.31Å; L364-K368 WeakPolarHBondContact O-CB 3.35Å; L364-K368 PolarHBondContact O-N 3.47Å; L364-N384 HydrophobicContact CD1-CB 4Å; L364-N384 WeakPolarHBondContact CD1-OD1 3.41Å; L364-N384 HydrophobicContact CD2-CB 3.98Å; L364-M387 HydrophobicContact CD1-CE 4.22Å; L364-M387 HydrophobicContact CD1-SD 4.1Å; L364-M387 HydrophobicContact CD2-CE 4.48Å; L364-M387 HydrophobicContact CD2-SD 3.57Å; L364-M387 VanDerWaalsContact CD2-SD 3.57Å; L364-M387 HydrophobicContact CG-CE 3.98Å; L364-M387 HydrophobicContact CG-SD 3.73Å; L364-F396 HydrophobicContact CB-CD2 3.76Å; L364-F396 HydrophobicContact CB-CE2 3.66Å; L364-F396 HydrophobicContact CB-CG 4.36Å; L364-F396 HydrophobicContact CB-CZ 4.18Å; L364-F396 HydrophobicContact CD1-CB 4.3Å; L364-F396 HydrophobicContact CD1-CD1 4.49Å; L364-F396 HydrophobicContact CD1-CD2 4.25Å; L364-F396 HydrophobicContact CD1-CG 4.09Å
365	K	91.3	Very high	88.1	Confident	91 Å²	91	55.7 Å²	55.7	40%	0.396	27%	0.27	S	S	.	.	H	α-helix	trans	-59.3	-47.3	173.2	-72.7	172.9	178.3	169.8	0	111	I361 L362 I363 I367 K368 D369	I361-K365 HydrophobicContact CG2-CD 4.3Å; I361-K365 HydrophobicContact CG2-CG 4.32Å; I361-K365 WeakPolarHBondContact O-CG 3.27Å; I361-K365 PolarHBondContact O-N 3.36Å; L362-K365 HydrophobicContact CD1-CB 4.5Å; L362-K365 HydrophobicContact CD1-CD 4.48Å; L362-K365 PolarHBondContact O-N 3.15Å; I363-K365 PolarHBondContact O-N 2.9Å; K365-I367 PolarHBondContact O-N 2.93Å; K365-K368 WeakPolarHBondContact O-CB 3.18Å; K365-K368 PolarHBondContact O-N 3.28Å; K365-D369 VanDerWaalsContact O-CG 3.3Å; K365-D369 PolarHBondContact O-N 2.93Å
366	T	91.1	Very high	88.2	Confident	27 Å²	27	51.9 Å²	51.9	17%	0.166	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-47.1	176.8	-59.2	0	0	0	0	111	L362 I363 K368 D369 Y370	L362-T366 WeakPolarHBondContact O-CB 3.24Å; L362-T366 PolarHBondContact O-N 3.02Å; L362-T366 PolarHBondContact O-OG1 3.34Å; I363-T366 WeakPolarHBondContact O-CB 3.42Å; I363-T366 PolarHBondContact O-N 3.21Å; T366-K368 PolarHBondContact O-N 3.5Å; T366-D369 PolarHBondContact O-N 3.21Å; T366-Y370 HydrophobicContact CG2-CD2 4.43Å; T366-Y370 HydrophobicContact CG2-CE2 4.4Å; T366-Y370 VanDerWaalsContact O-CD2 3.3Å; T366-Y370 WeakPolarHBondContact O-CD2 3.38Å; T366-Y370 PolarHBondContact O-N 2.92Å
367	I	92.1	Very high	88.5	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.2	-49.6	177.5	-64.6	170.3	0	0	0	110	I363 L364 K365 D369 Y370 V371 T380 I730 I744 H747	I363-I367 HydrophobicContact CG2-CD1 3.79Å; I363-I367 HydrophobicContact CG2-CG1 4.36Å; I363-I367 VanDerWaalsContact O-CG1 3.25Å; I363-I367 WeakPolarHBondContact O-CG1 3.41Å; I363-I367 PolarHBondContact O-N 3.08Å; L364-I367 PolarHBondContact O-N 3.39Å; K365-I367 PolarHBondContact O-N 2.93Å; I367-D369 VanDerWaalsContact C-N 3.29Å; I367-D369 PolarHBondContact O-N 3.5Å; I367-Y370 PolarHBondContact O-N 3.4Å; I367-V371 HydrophobicContact CG2-CG2 3.81Å; I367-V371 WeakPolarHBondContact O-CB 3.41Å; I367-V371 WeakPolarHBondContact O-CG2 3.3Å; I367-V371 PolarHBondContact O-N 3.27Å; I367-V371 VanDerWaalsContact O-N 3.09Å; I367-T380 HydrophobicContact CB-CG2 4.46Å; I367-T380 HydrophobicContact CG2-CG2 3.96Å; I367-T380 VanDerWaalsContact CG2-OG1 3.24Å; I367-T380 WeakPolarHBondContact CG2-OG1 3.18Å; I367-I730 HydrophobicContact CD1-CD1 4.27Å; I367-I730 HydrophobicContact CG1-CD1 4.03Å; I367-I730 HydrophobicContact CG1-CG2 4.29Å; I367-I730 HydrophobicContact CG2-CG2 4.35Å; I367-I744 HydrophobicContact CD1-CG2 4.38Å; I367-I744 HydrophobicContact CG2-CD1 3.81Å; I367-I744 HydrophobicContact CG2-CG1 3.74Å; I367-I744 HydrophobicContact CG2-CG2 4.19Å; I367-H747 HydrophobicContact CD1-CB 4.39Å
368	K	91.3	Very high	88.7	Confident	48 Å²	48	48 Å²	48	21%	0.209	23%	0.233	C	C	.	.	H	α-helix	trans	-53.8	-43.5	179.4	173.7	-179.3	161.3	-115.3	0	112.3	L364 K365 T366 Y370 V371 F396 N400 W403	L364-K368 VanDerWaalsContact O-CB 3.31Å; L364-K368 WeakPolarHBondContact O-CB 3.35Å; L364-K368 PolarHBondContact O-N 3.47Å; K365-K368 WeakPolarHBondContact O-CB 3.18Å; K365-K368 PolarHBondContact O-N 3.28Å; T366-K368 PolarHBondContact O-N 3.5Å; K368-Y370 VanDerWaalsContact C-N 3.3Å; K368-Y370 PolarHBondContact O-N 2.88Å; K368-V371 PolarHBondContact O-N 3.02Å; K368-F396 HydrophobicContact CB-CE2 4.48Å; K368-F396 HydrophobicContact CB-CZ 4.23Å; K368-F396 HydrophobicContact CD-CE2 4.28Å; K368-F396 HydrophobicContact CD-CZ 4.19Å; K368-N400 HydrophobicContact CD-CB 4.42Å; K368-N400 WeakPolarHBondContact CD-OD1 3.13Å; K368-N400 WeakPolarHBondContact CE-OD1 2.94Å; K368-N400 PolarHBondContact NZ-OD1 3Å; K368-W403 HydrophobicContact CD-CD2 4.05Å; K368-W403 HydrophobicContact CD-CE3 4.41Å; K368-W403 HydrophobicContact CD-CG 4.14Å; K368-W403 HydrophobicContact CG-CD2 4.11Å; K368-W403 HydrophobicContact CG-CG 4.31Å; K368-W403 HydrophobicContact CG-CZ2 4.29Å
369	D	90	Very high	89	Confident	114 Å²	114	44.1 Å²	44.1	61%	0.61	22%	0.215	S	C	*	.	H	α-helix	trans	-67.3	-27.9	-175.4	-71	-15.5	0	0	0	113.6	K365 T366 I367	K365-D369 VanDerWaalsContact O-CG 3.3Å; K365-D369 PolarHBondContact O-N 2.93Å; T366-D369 PolarHBondContact O-N 3.21Å; I367-D369 VanDerWaalsContact C-N 3.29Å; I367-D369 PolarHBondContact O-N 3.5Å
370	Y	87.1	Confident	89.5	Confident	97 Å²	97	43.3 Å²	43.3	38%	0.38	21%	0.21	S	C	.	.	H	α-helix	trans	-97.7	-10.5	179.1	-71.4	-96.4	0	0	0	113.5	T366 I367 K368 C731	T366-Y370 HydrophobicContact CG2-CD2 4.43Å; T366-Y370 HydrophobicContact CG2-CE2 4.4Å; T366-Y370 VanDerWaalsContact O-CD2 3.3Å; T366-Y370 WeakPolarHBondContact O-CD2 3.38Å; T366-Y370 PolarHBondContact O-N 2.92Å; I367-Y370 PolarHBondContact O-N 3.4Å; K368-Y370 VanDerWaalsContact C-N 3.3Å; K368-Y370 PolarHBondContact O-N 2.88Å; Y370-C731 HydrophobicContact CD1-CB 3.94Å; Y370-C731 HydrophobicContact CE1-CB 3.95Å; Y370-C731 HydrophobicContact CG-CB 4.32Å
371	V	82.8	Confident	89.8	Confident	17 Å²	17	42.2 Å²	42.2	10%	0.103	20%	0.204	C	C	.	.			trans	-87.7	122.3	-177.9	162.6	0	0	0	0	111.7	I367 K368 C376 H377 I744	I367-V371 HydrophobicContact CG2-CG2 3.81Å; I367-V371 WeakPolarHBondContact O-CB 3.41Å; I367-V371 WeakPolarHBondContact O-CG2 3.3Å; I367-V371 PolarHBondContact O-N 3.27Å; I367-V371 VanDerWaalsContact O-N 3.09Å; K368-V371 PolarHBondContact O-N 3.02Å; V371-C376 HydrophobicContact CB-CB 4.18Å; V371-C376 VanDerWaalsContact CG1-C 3.46Å; V371-C376 HydrophobicContact CG1-CB 3.53Å; V371-C376 HydrophobicContact CG2-CB 3.64Å; V371-H377 HydrophobicContact CG1-CB 4.39Å; V371-I744 HydrophobicContact CG2-CD1 3.84Å
372	R	80.8	Confident	90.3	Very high	225 Å²	225	40.5 Å²	40.5	85%	0.849	20%	0.195	S	C	*	.			trans	-123	-21.8	-178.9	-61.2	-175.9	-178.4	-164.9	-3.7	114.9
373	N	85.8	Confident	90.6	Very high	51 Å²	51	38.7 Å²	38.7	27%	0.273	19%	0.185	S	C	.	.	S	Bend	trans	-94.9	160.8	-177.4	67.2	31.2	0	0	0	111	V375 C376 H377 S737	N373-V375 VanDerWaalsContact C-N 3.32Å; N373-V375 PolarHBondContact O-N 3.42Å; N373-V375 PolarHBondContact OD1-N 2.86Å; N373-C376 WeakPolarHBondContact OD1-CA 3.37Å; N373-C376 WeakPolarHBondContact OD1-CB 3.22Å; N373-C376 PolarHBondContact OD1-N 3.46Å; N373-C376 PolarHBondContact OD1-SG 2.9Å; N373-H377 WeakPolarHBondContact O-CB 3.31Å; N373-H377 PolarHBondContact O-N 3.35Å; N373-S737 WeakPolarHBondContact ND2-CB 3.45Å; N373-S737 PolarHBondContact ND2-OG 2.87Å
374	S	86.6	Confident	91	Very high	69 Å²	69	38.4 Å²	38.4	48%	0.483	18%	0.184	S	C	.	.	H	α-helix	trans	-67.3	-31.8	-178.1	-171.3	0	0	0	0	113.2	H377 S378	S374-H377 PolarHBondContact O-N 2.78Å; S374-S378 PolarHBondContact O-N 3.08Å; S374-S378 VanDerWaalsContact O-N 3.07Å; S374-S378 PolarHBondContact O-OG 3.35Å
375	V	90.2	Very high	91.2	Very high	42 Å²	42	38.4 Å²	38.4	26%	0.255	18%	0.184	S	C	.	.	H	α-helix	trans	-67.3	-48.3	-178	174.6	0	0	0	0	110.6	N373 H377 S378 A379 F741 F786	N373-V375 VanDerWaalsContact C-N 3.32Å; N373-V375 PolarHBondContact O-N 3.42Å; N373-V375 PolarHBondContact OD1-N 2.86Å; V375-H377 VanDerWaalsContact C-N 3.34Å; V375-S378 PolarHBondContact O-N 3.09Å; V375-A379 PolarHBondContact O-N 3Å; V375-F741 HydrophobicContact CG1-CB 4.23Å; V375-F741 HydrophobicContact CG1-CD2 3.65Å; V375-F741 HydrophobicContact CG1-CE2 4.5Å; V375-F741 HydrophobicContact CG1-CG 4.32Å; V375-F786 HydrophobicContact CG1-CE2 4.14Å; V375-F786 HydrophobicContact CG1-CZ 3.86Å; V375-F786 HydrophobicContact CG2-CE2 4.18Å; V375-F786 HydrophobicContact CG2-CZ 4.4Å
376	C	91.1	Very high	91.5	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-70.8	-30.8	176.4	-61.9	0	0	0	0	111.4	V371 N373 A379 T380 I744	V371-C376 HydrophobicContact CB-CB 4.18Å; V371-C376 VanDerWaalsContact CG1-C 3.46Å; V371-C376 HydrophobicContact CG1-CB 3.53Å; V371-C376 HydrophobicContact CG2-CB 3.64Å; N373-C376 WeakPolarHBondContact OD1-CA 3.37Å; N373-C376 WeakPolarHBondContact OD1-CB 3.22Å; N373-C376 PolarHBondContact OD1-N 3.46Å; N373-C376 PolarHBondContact OD1-SG 2.9Å; C376-A379 WeakPolarHBondContact O-CB 3.44Å; C376-A379 PolarHBondContact O-N 3.35Å; C376-T380 PolarHBondContact O-N 3.13Å; C376-T380 PolarHBondContact O-OG1 2.99Å; C376-I744 HydrophobicContact CB-CD1 3.8Å
377	H	92	Very high	91.7	Very high	16 Å²	16	32.8 Å²	32.8	7%	0.074	16%	0.157	C	C	.	.	H	α-helix	trans	-57.3	-49.9	170.9	175.9	-77.2	0	0	0	110.9	V371 N373 S374 V375 A379 T380 V381 W403	V371-H377 HydrophobicContact CG1-CB 4.39Å; N373-H377 WeakPolarHBondContact O-CB 3.31Å; N373-H377 PolarHBondContact O-N 3.35Å; S374-H377 PolarHBondContact O-N 2.78Å; V375-H377 VanDerWaalsContact C-N 3.34Å; H377-A379 VanDerWaalsContact C-N 3.33Å; H377-A379 PolarHBondContact O-N 3.25Å; H377-T380 PolarHBondContact O-N 3.24Å; H377-V381 WeakPolarHBondContact O-CG2 3.43Å; H377-V381 PolarHBondContact O-N 3.36Å; H377-V381 VanDerWaalsContact O-N 3.11Å; H377-W403 HydrophobicContact CB-CZ2 4.46Å; H377-W403 AromaticContact CD2-CD2 4Å; H377-W403 AromaticContact CD2-CE2 3.38Å; H377-W403 AromaticContact CD2-CH2 3.72Å; H377-W403 AromaticContact CD2-CZ2 3.24Å; H377-W403 WeakPolarHBondContact CD2-CZ2 3.15Å; H377-W403 AromaticContact CD2-NE1 3.81Å; H377-W403 AromaticContact CG-CZ2 3.97Å; H377-W403 AromaticContact NE2-CD2 3.87Å; H377-W403 AromaticContact NE2-CE2 3.74Å; H377-W403 AromaticContact NE2-CE3 3.96Å; H377-W403 AromaticContact NE2-CH2 3.77Å; H377-W403 AromaticContact NE2-CZ2 3.71Å; H377-W403 AromaticContact NE2-CZ3 3.9Å; H377-W403 PolarHBondContact NE2-O 3.33Å
378	S	92.7	Very high	91.9	Very high	7 Å²	7	32.8 Å²	32.8	5%	0.049	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-39.1	174.7	-59.5	0	0	0	0	112.1	S374 V375 T380 V381 I382	S374-S378 PolarHBondContact O-N 3.08Å; S374-S378 VanDerWaalsContact O-N 3.07Å; S374-S378 PolarHBondContact O-OG 3.35Å; V375-S378 PolarHBondContact O-N 3.09Å; S378-T380 PolarHBondContact O-N 3.29Å; S378-V381 PolarHBondContact O-N 3.45Å; S378-I382 WeakPolarHBondContact O-CB 2.95Å; S378-I382 WeakPolarHBondContact O-CD1 3.38Å; S378-I382 VanDerWaalsContact O-CG1 3.23Å; S378-I382 WeakPolarHBondContact O-CG1 3.44Å; S378-I382 PolarHBondContact O-N 3.33Å
379	A	94.7	Very high	92	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-43.6	174.9	0	0	0	0	0	112.1	V375 C376 H377 V381 I382 S383 F741 I744 I745	V375-A379 PolarHBondContact O-N 3Å; C376-A379 WeakPolarHBondContact O-CB 3.44Å; C376-A379 PolarHBondContact O-N 3.35Å; H377-A379 VanDerWaalsContact C-N 3.33Å; H377-A379 PolarHBondContact O-N 3.25Å; A379-V381 VanDerWaalsContact C-N 3.34Å; A379-V381 PolarHBondContact O-N 2.99Å; A379-I382 PolarHBondContact O-N 2.69Å; A379-S383 VanDerWaalsContact O-CB 3.3Å; A379-S383 WeakPolarHBondContact O-CB 3.42Å; A379-S383 PolarHBondContact O-N 3.35Å; A379-F741 HydrophobicContact CB-CD2 3.48Å; A379-F741 VanDerWaalsContact CB-CD2 3.48Å; A379-F741 HydrophobicContact CB-CE2 3.82Å; A379-F741 HydrophobicContact CB-CG 4.11Å; A379-I744 VanDerWaalsContact C-CG2 3.42Å; A379-I744 HydrophobicContact CB-CB 3.97Å; A379-I744 HydrophobicContact CB-CD1 4.05Å; A379-I744 HydrophobicContact CB-CG2 3.71Å; A379-I744 WeakPolarHBondContact O-CG2 3.3Å; A379-I745 HydrophobicContact CB-CD1 4.41Å
380	T	95.2	Very high	92.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.1	-42.3	178.4	-55.1	0	0	0	0	111	I367 C376 H377 S378 S383 N384 F396 W403	I367-T380 HydrophobicContact CB-CG2 4.46Å; I367-T380 HydrophobicContact CG2-CG2 3.96Å; I367-T380 VanDerWaalsContact CG2-OG1 3.24Å; I367-T380 WeakPolarHBondContact CG2-OG1 3.18Å; C376-T380 PolarHBondContact O-N 3.13Å; C376-T380 PolarHBondContact O-OG1 2.99Å; H377-T380 PolarHBondContact O-N 3.24Å; S378-T380 PolarHBondContact O-N 3.29Å; T380-S383 PolarHBondContact O-N 3.32Å; T380-N384 WeakPolarHBondContact O-CB 3.37Å; T380-N384 PolarHBondContact O-N 2.75Å; T380-F396 HydrophobicContact CG2-CE1 4.26Å; T380-F396 HydrophobicContact CG2-CZ 4.05Å; T380-W403 HydrophobicContact CG2-CH2 3.75Å; T380-W403 HydrophobicContact CG2-CZ2 4.26Å
381	V	95.1	Very high	92.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-44.8	175.6	167.3	0	0	0	0	111.4	H377 S378 A379 N384 A385 W403 T414 A415 S418	H377-V381 WeakPolarHBondContact O-CG2 3.43Å; H377-V381 PolarHBondContact O-N 3.36Å; H377-V381 VanDerWaalsContact O-N 3.11Å; S378-V381 PolarHBondContact O-N 3.45Å; A379-V381 VanDerWaalsContact C-N 3.34Å; A379-V381 PolarHBondContact O-N 2.99Å; V381-N384 WeakPolarHBondContact O-CB 3.19Å; V381-N384 PolarHBondContact O-N 3.28Å; V381-A385 PolarHBondContact O-N 2.86Å; V381-W403 HydrophobicContact CG2-CH2 4.05Å; V381-W403 HydrophobicContact CG2-CZ3 4.05Å; V381-T414 HydrophobicContact CG1-CG2 4.47Å; V381-A415 VanDerWaalsContact CG1-CA 3.5Å; V381-A415 HydrophobicContact CG1-CB 3.94Å; V381-A415 HydrophobicContact CG2-CB 4.49Å; V381-S418 WeakPolarHBondContact CG1-OG 3.47Å
382	I	96.1	Very high	92.6	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.3	-45.4	176.1	-67.1	160.3	0	0	0	110.2	S378 A379 N384 A385 L386 T414 I745 F786	S378-I382 WeakPolarHBondContact O-CB 2.95Å; S378-I382 WeakPolarHBondContact O-CD1 3.38Å; S378-I382 VanDerWaalsContact O-CG1 3.23Å; S378-I382 WeakPolarHBondContact O-CG1 3.44Å; S378-I382 PolarHBondContact O-N 3.33Å; A379-I382 PolarHBondContact O-N 2.69Å; I382-N384 VanDerWaalsContact C-N 3.33Å; I382-N384 PolarHBondContact O-N 3.28Å; I382-A385 WeakPolarHBondContact O-CA 3.41Å; I382-A385 VanDerWaalsContact O-CB 3.22Å; I382-A385 WeakPolarHBondContact O-CB 3.28Å; I382-A385 PolarHBondContact O-N 3Å; I382-L386 HydrophobicContact CG2-CD1 4.25Å; I382-L386 HydrophobicContact CG2-CG 4.35Å; I382-L386 WeakPolarHBondContact O-CG 3.43Å; I382-L386 PolarHBondContact O-N 3.36Å; I382-T414 HydrophobicContact CD1-CG2 4Å; I382-T414 HydrophobicContact CG1-CG2 3.72Å; I382-I745 HydrophobicContact CB-CD1 3.88Å; I382-I745 HydrophobicContact CG2-CD1 3.53Å; I382-F786 HydrophobicContact CD1-CB 4.26Å
383	S	96.5	Very high	93	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.1	-46.9	176.7	-176.6	0	0	0	0	111.2	A379 T380 A385 L386 M387 I744 G748	A379-S383 VanDerWaalsContact O-CB 3.3Å; A379-S383 WeakPolarHBondContact O-CB 3.42Å; A379-S383 PolarHBondContact O-N 3.35Å; T380-S383 PolarHBondContact O-N 3.32Å; S383-A385 VanDerWaalsContact C-N 3.31Å; S383-A385 PolarHBondContact O-N 2.87Å; S383-L386 PolarHBondContact O-N 3.03Å; S383-M387 WeakPolarHBondContact O-CB 3.39Å; S383-M387 WeakPolarHBondContact O-CG 3.23Å; S383-M387 PolarHBondContact O-N 3.5Å; S383-I744 PolarHBondContact OG-O 3.17Å; S383-G748 WeakPolarHBondContact OG-CA 3.42Å; S383-G748 PolarHBondContact OG-N 3.47Å
384	N	96.3	Very high	93	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-55.7	-46.4	172.9	176	77.9	0	0	0	111.4	L364 T380 V381 I382 L386 M387 H388 F396	L364-N384 HydrophobicContact CD1-CB 4Å; L364-N384 WeakPolarHBondContact CD1-OD1 3.41Å; L364-N384 HydrophobicContact CD2-CB 3.98Å; T380-N384 WeakPolarHBondContact O-CB 3.37Å; T380-N384 PolarHBondContact O-N 2.75Å; V381-N384 WeakPolarHBondContact O-CB 3.19Å; V381-N384 PolarHBondContact O-N 3.28Å; I382-N384 VanDerWaalsContact C-N 3.33Å; I382-N384 PolarHBondContact O-N 3.28Å; N384-L386 VanDerWaalsContact C-N 3.34Å; N384-L386 PolarHBondContact O-N 2.71Å; N384-M387 PolarHBondContact O-N 3.11Å; N384-H388 WeakPolarHBondContact O-CB 3.39Å; N384-H388 PolarHBondContact O-CD2 3.06Å; N384-H388 VanDerWaalsContact O-CD2 3.24Å; N384-H388 PolarHBondContact O-N 3.32Å; N384-H388 PolarHBondContact OD1-CD2 3.41Å; N384-F396 HydrophobicContact CB-CD1 4.03Å; N384-F396 HydrophobicContact CB-CE1 4.42Å; N384-F396 VanDerWaalsContact OD1-CB 3.24Å; N384-F396 WeakPolarHBondContact OD1-CB 3.39Å; N384-F396 WeakPolarHBondContact OD1-CD1 3.47Å
385	A	96.6	Very high	93.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-58	-45.4	178.1	0	0	0	0	0	112.5	V381 I382 S383 H389 V421	V381-A385 PolarHBondContact O-N 2.86Å; I382-A385 WeakPolarHBondContact O-CA 3.41Å; I382-A385 VanDerWaalsContact O-CB 3.22Å; I382-A385 WeakPolarHBondContact O-CB 3.28Å; I382-A385 PolarHBondContact O-N 3Å; S383-A385 VanDerWaalsContact C-N 3.31Å; S383-A385 PolarHBondContact O-N 2.87Å; A385-H389 PolarHBondContact O-N 2.91Å; A385-H389 VanDerWaalsContact O-N 3.17Å; A385-V421 HydrophobicContact CB-CB 4.02Å; A385-V421 HydrophobicContact CB-CG1 4.3Å; A385-V421 HydrophobicContact CB-CG2 4.35Å; A385-V421 VanDerWaalsContact O-CG1 3.27Å; A385-V421 WeakPolarHBondContact O-CG1 3.43Å
386	L	97.3	Very high	93.1	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-67	-45.1	178.8	-60.5	178.5	0	0	0	111.2	I382 S383 N384 H388 H389 G748 I749 A752 G753 L792 F796	I382-L386 HydrophobicContact CG2-CD1 4.25Å; I382-L386 HydrophobicContact CG2-CG 4.35Å; I382-L386 WeakPolarHBondContact O-CG 3.43Å; I382-L386 PolarHBondContact O-N 3.36Å; S383-L386 PolarHBondContact O-N 3.03Å; N384-L386 VanDerWaalsContact C-N 3.34Å; N384-L386 PolarHBondContact O-N 2.71Å; L386-H388 VanDerWaalsContact C-N 3.28Å; L386-H388 PolarHBondContact O-N 2.9Å; L386-H389 WeakPolarHBondContact O-CB 3.46Å; L386-H389 PolarHBondContact O-N 3.3Å; L386-G748 WeakPolarHBondContact CB-O 3.03Å; L386-I749 HydrophobicContact CD1-CG1 4.22Å; L386-A752 CarbonylContact O-C 3.4Å; L386-A752 VanDerWaalsContact O-CA 3.26Å; L386-A752 WeakPolarHBondContact O-CA 3.42Å; L386-G753 PolarHBondContact O-N 3.05Å; L386-L792 HydrophobicContact CD1-CD2 4.04Å; L386-L792 HydrophobicContact CD2-CB 4.24Å; L386-L792 HydrophobicContact CD2-CD2 4.4Å; L386-F796 HydrophobicContact CB-CE2 4.25Å; L386-F796 HydrophobicContact CB-CZ 4.21Å; L386-F796 HydrophobicContact CD2-CE2 3.75Å; L386-F796 HydrophobicContact CD2-CZ 3.76Å; L386-F796 HydrophobicContact CG-CZ 4.41Å
387	M	95.7	Very high	93	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-58.8	-39.5	178.5	-71.6	173.6	69.5	0	0	112.3	D360 L364 S383 N384 D751 G753 G754	D360-M387 WeakPolarHBondContact O-CE 3.37Å; L364-M387 HydrophobicContact CD1-CE 4.22Å; L364-M387 HydrophobicContact CD1-SD 4.1Å; L364-M387 HydrophobicContact CD2-CE 4.48Å; L364-M387 HydrophobicContact CD2-SD 3.57Å; L364-M387 VanDerWaalsContact CD2-SD 3.57Å; L364-M387 HydrophobicContact CG-CE 3.98Å; L364-M387 HydrophobicContact CG-SD 3.73Å; S383-M387 WeakPolarHBondContact O-CB 3.39Å; S383-M387 WeakPolarHBondContact O-CG 3.23Å; S383-M387 PolarHBondContact O-N 3.5Å; N384-M387 PolarHBondContact O-N 3.11Å; M387-D751 WeakPolarHBondContact CA-O 3.47Å; M387-D751 HydrophobicContact CE-CB 4Å; M387-D751 HydrophobicContact CG-CB 3.93Å; M387-D751 HydrophobicContact SD-CB 4.48Å; M387-G753 CarbonylContact O-C 3.58Å; M387-G753 PolarHBondContact O-N 3.25Å; M387-G754 PolarHBondContact O-N 2.96Å
388	H	95.6	Very high	92.7	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	16.3	-176	-68	-75.4	0	0	0	113.8	S359 N384 L386 G390 T391 S393 I422	S359-H388 PolarHBondContact OG-CE1 3.29Å; S359-H388 PolarHBondContact OG-ND1 3.4Å; N384-H388 WeakPolarHBondContact O-CB 3.39Å; N384-H388 PolarHBondContact O-CD2 3.06Å; N384-H388 VanDerWaalsContact O-CD2 3.24Å; N384-H388 PolarHBondContact O-N 3.32Å; N384-H388 PolarHBondContact OD1-CD2 3.41Å; L386-H388 VanDerWaalsContact C-N 3.28Å; L386-H388 PolarHBondContact O-N 2.9Å; H388-G390 PolarHBondContact O-N 2.95Å; H388-G390 VanDerWaalsContact O-N 3.16Å; H388-T391 WeakPolarHBondContact CA-OG1 3.46Å; H388-T391 WeakPolarHBondContact CB-OG1 3.31Å; H388-T391 PolarHBondContact O-N 3.1Å; H388-T391 PolarHBondContact O-OG1 2.54Å; H388-S393 WeakPolarHBondContact CB-O 3.43Å; H388-I422 HydrophobicContact CB-CD1 4.48Å; H388-I422 HydrophobicContact CB-CG1 3.95Å; H388-I422 HydrophobicContact CB-CG2 4.27Å; H388-I422 WeakPolarHBondContact O-CA 3.33Å
389	H	94.9	Very high	92.6	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.019	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	119.5	179.1	176.6	82.2	0	0	0	113.1	A385 L386 T391 V421 K424 S793 F796	A385-H389 PolarHBondContact O-N 2.91Å; A385-H389 VanDerWaalsContact O-N 3.17Å; L386-H389 WeakPolarHBondContact O-CB 3.46Å; L386-H389 PolarHBondContact O-N 3.3Å; H389-T391 PolarHBondContact O-N 2.91Å; H389-V421 WeakPolarHBondContact CA-O 3.28Å; H389-V421 HydrophobicContact CB-CG1 4.28Å; H389-K424 WeakPolarHBondContact CE1-CD 3.38Å; H389-S793 PolarHBondContact CE1-O 3.31Å; H389-F796 HydrophobicContact CB-CD2 4.07Å; H389-F796 HydrophobicContact CB-CE2 4.25Å; H389-F796 AromaticContact CD2-CD2 3.89Å; H389-F796 AromaticContact CE1-CD2 3.93Å; H389-F796 AromaticContact CG-CD2 3.69Å; H389-F796 AromaticContact ND1-CD2 3.8Å
390	G	91.1	Very high	92.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	-1.6	178.9	0	0	0	0	0	115.5	L350 Y353 H388 T392 V421 I422	L350-G390 WeakPolarHBondContact CD1-O 3.42Å; Y353-G390 WeakPolarHBondContact CB-O 3.38Å; H388-G390 PolarHBondContact O-N 2.95Å; H388-G390 VanDerWaalsContact O-N 3.16Å; G390-T392 VanDerWaalsContact C-N 3.3Å; G390-T392 PolarHBondContact O-N 2.78Å; G390-V421 PolarHBondContact N-O 3.45Å; G390-I422 CarbonylContact C-O 3.39Å; G390-I422 VanDerWaalsContact CA-O 3.24Å; G390-I422 WeakPolarHBondContact CA-O 3.08Å; G390-I422 PolarHBondContact N-O 3.43Å; G390-I422 VanDerWaalsContact N-O 3.07Å
391	T	91.2	Very high	91.8	Very high	4 Å²	4	24 Å²	24	3%	0.025	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-12.6	-177.1	66.5	0	0	0	0	112.9	N357 H388 H389 S393 I422	N357-T391 HydrophobicContact CB-CG2 4.13Å; H388-T391 WeakPolarHBondContact CA-OG1 3.46Å; H388-T391 WeakPolarHBondContact CB-OG1 3.31Å; H388-T391 PolarHBondContact O-N 3.1Å; H388-T391 PolarHBondContact O-OG1 2.54Å; H389-T391 PolarHBondContact O-N 2.91Å; T391-S393 PolarHBondContact O-N 3.23Å; T391-S393 PolarHBondContact OG1-N 3.41Å; T391-I422 PolarHBondContact N-O 3.32Å
392	T	89.7	Confident	91.4	Very high	20 Å²	20	31.7 Å²	31.7	12%	0.123	16%	0.159	C	C	.	.			trans	58.3	5	-171.5	65.9	0	0	0	0	115.6	L350 M354 G390 D394 I422 H426	L350-T392 HydrophobicContact CD1-CG2 4.06Å; M354-T392 HydrophobicContact CE-CG2 3.23Å; M354-T392 VanDerWaalsContact CE-OG1 3.3Å; M354-T392 WeakPolarHBondContact CE-OG1 3.32Å; G390-T392 VanDerWaalsContact C-N 3.3Å; G390-T392 PolarHBondContact O-N 2.78Å; T392-D394 PolarHBondContact O-N 3.38Å; T392-I422 PolarHBondContact N-O 3.05Å; T392-I422 VanDerWaalsContact N-O 3.13Å; T392-H426 HydrophobicContact CG2-CB 4.39Å; T392-H426 WeakPolarHBondContact CG2-ND1 3.45Å
393	S	88	Confident	90.9	Very high	24 Å²	24	33 Å²	33	17%	0.168	16%	0.164	C	C	.	.			trans	-84	100.9	177.8	-178.5	0	0	0	0	109.8	H388 T391 I422	H388-S393 WeakPolarHBondContact CB-O 3.43Å; T391-S393 PolarHBondContact O-N 3.23Å; T391-S393 PolarHBondContact OG1-N 3.41Å; S393-I422 WeakPolarHBondContact O-CG2 3.3Å
394	D	86.6	Confident	90.3	Very high	29 Å²	29	34.2 Å²	34.2	16%	0.155	17%	0.171	C	C	.	.			trans	-102.5	15.2	174.2	70.6	-23.6	0	0	0	112.4	T392 F396 L397 R398 L419 I422	T392-D394 PolarHBondContact O-N 3.38Å; D394-F396 VanDerWaalsContact C-N 3.27Å; D394-F396 PolarHBondContact O-N 3.31Å; D394-L397 PolarHBondContact O-N 3.48Å; D394-R398 PolarHBondContact O-N 2.76Å; D394-R398 VanDerWaalsContact O-N 3.15Å; D394-R398 IonicContact OD1-CZ 3.32Å; D394-R398 IonicContact OD1-NE 3.79Å; D394-R398 PolarHBondContact OD1-NE 3.05Å; D394-R398 IonicContact OD1-NH2 3.13Å; D394-R398 PolarHBondContact OD1-NH2 3.48Å; D394-R398 WeakPolarHBondContact OD2-CD 3.48Å; D394-R398 IonicContact OD2-NE 2.74Å; D394-R398 PolarHBondContact OD2-NE 3.35Å; D394-L419 HydrophobicContact CB-CD2 4.11Å; D394-I422 HydrophobicContact CB-CD1 4.48Å; D394-I422 HydrophobicContact CB-CG2 4.43Å
395	E	89.5	Confident	89.8	Confident	84 Å²	84	38 Å²	38	39%	0.393	20%	0.198	S	C	.	.	H	α-helix	trans	-48.7	-47.4	-175.3	-175.8	-170.8	153.4	0	0	111.8	I361 L397 R398 T399	I361-E395 WeakPolarHBondContact CD1-OE2 3.44Å; E395-L397 VanDerWaalsContact C-N 3.27Å; E395-L397 PolarHBondContact O-N 3.04Å; E395-R398 PolarHBondContact O-N 3.14Å; E395-R398 VanDerWaalsContact O-N 3.11Å; E395-T399 PolarHBondContact O-N 2.68Å; E395-T399 PolarHBondContact O-OG1 2.92Å
396	F	89.8	Confident	89.2	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-57.5	-39.1	-179.7	177	-99.3	0	0	0	112.9	L364 K368 T380 N384 D394 N400 W403	L364-F396 HydrophobicContact CB-CD2 3.76Å; L364-F396 HydrophobicContact CB-CE2 3.66Å; L364-F396 HydrophobicContact CB-CG 4.36Å; L364-F396 HydrophobicContact CB-CZ 4.18Å; L364-F396 HydrophobicContact CD1-CB 4.3Å; L364-F396 HydrophobicContact CD1-CD1 4.49Å; L364-F396 HydrophobicContact CD1-CD2 4.25Å; L364-F396 HydrophobicContact CD1-CG 4.09Å; K368-F396 HydrophobicContact CB-CE2 4.48Å; K368-F396 HydrophobicContact CB-CZ 4.23Å; K368-F396 HydrophobicContact CD-CE2 4.28Å; K368-F396 HydrophobicContact CD-CZ 4.19Å; T380-F396 HydrophobicContact CG2-CE1 4.26Å; T380-F396 HydrophobicContact CG2-CZ 4.05Å; N384-F396 HydrophobicContact CB-CD1 4.03Å; N384-F396 HydrophobicContact CB-CE1 4.42Å; N384-F396 VanDerWaalsContact OD1-CB 3.24Å; N384-F396 WeakPolarHBondContact OD1-CB 3.39Å; N384-F396 WeakPolarHBondContact OD1-CD1 3.47Å; D394-F396 VanDerWaalsContact C-N 3.27Å; D394-F396 PolarHBondContact O-N 3.31Å; F396-N400 VanDerWaalsContact O-CB 3.31Å; F396-N400 WeakPolarHBondContact O-CB 3.35Å; F396-N400 PolarHBondContact O-N 3.02Å; F396-N400 PolarHBondContact O-ND2 3.42Å; F396-W403 HydrophobicContact CE1-CH2 4.38Å; F396-W403 AromaticContact CE1-CZ3 3.82Å; F396-W403 HydrophobicContact CE1-CZ3 3.82Å; F396-W403 HydrophobicContact CZ-CH2 4.47Å; F396-W403 HydrophobicContact CZ-CZ3 4.09Å
397	L	88.4	Confident	88.6	Confident	12 Å²	12	45.8 Å²	45.8	6%	0.063	23%	0.233	C	C	.	.	H	α-helix	trans	-71.4	-41.5	178.1	-62.5	177.6	0	0	0	110.8	D394 E395 N400 L401 V404 L419 I422	D394-L397 PolarHBondContact O-N 3.48Å; E395-L397 VanDerWaalsContact C-N 3.27Å; E395-L397 PolarHBondContact O-N 3.04Å; L397-N400 CarbonylContact O-C 3.17Å; L397-N400 PolarHBondContact O-N 2.97Å; L397-L401 PolarHBondContact O-N 3.24Å; L397-L401 VanDerWaalsContact O-N 3.15Å; L397-V404 HydrophobicContact CD2-CG2 3.87Å; L397-L419 HydrophobicContact CD1-CD2 3.75Å; L397-L419 HydrophobicContact CD1-CG 4.44Å; L397-I422 HydrophobicContact CD1-CD1 4.1Å
398	R	86.4	Confident	88.2	Confident	109 Å²	109	49.1 Å²	49.1	41%	0.411	26%	0.256	S	S	.	.	H	α-helix	trans	-66.6	-44.8	179.2	-68.9	-168.3	-76	164.7	-4.4	112.8	D394 E395 N400 L401 D940	D394-R398 PolarHBondContact O-N 2.76Å; D394-R398 VanDerWaalsContact O-N 3.15Å; D394-R398 IonicContact OD1-CZ 3.32Å; D394-R398 IonicContact OD1-NE 3.79Å; D394-R398 PolarHBondContact OD1-NE 3.05Å; D394-R398 IonicContact OD1-NH2 3.13Å; D394-R398 PolarHBondContact OD1-NH2 3.48Å; D394-R398 WeakPolarHBondContact OD2-CD 3.48Å; D394-R398 IonicContact OD2-NE 2.74Å; D394-R398 PolarHBondContact OD2-NE 3.35Å; E395-R398 PolarHBondContact O-N 3.14Å; E395-R398 VanDerWaalsContact O-N 3.11Å; R398-N400 PolarHBondContact O-N 3.13Å; R398-L401 VanDerWaalsContact O-CG 3.3Å; R398-L401 WeakPolarHBondContact O-CG 3.15Å; R398-D940 IonicContact CZ-OD2 2.93Å; R398-D940 IonicContact NH1-OD2 2.85Å; R398-D940 PolarHBondContact NH1-OD2 3.16Å
399	T	89.3	Confident	87.9	Confident	95 Å²	95	53.3 Å²	53.3	58%	0.583	28%	0.278	S	S	*	.	H	α-helix	trans	-66.6	-23.6	176.8	-50.1	0	0	0	0	112.2	E395	E395-T399 PolarHBondContact O-N 2.68Å; E395-T399 PolarHBondContact O-OG1 2.92Å
400	N	87.8	Confident	87.8	Confident	19 Å²	19	56.5 Å²	56.5	10%	0.102	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	30.3	-174	-60.9	-82.5	0	0	0	113.1	K368 F396 L397 R398 E402 W403 V404	K368-N400 HydrophobicContact CD-CB 4.42Å; K368-N400 WeakPolarHBondContact CD-OD1 3.13Å; K368-N400 WeakPolarHBondContact CE-OD1 2.94Å; K368-N400 PolarHBondContact NZ-OD1 3Å; F396-N400 VanDerWaalsContact O-CB 3.31Å; F396-N400 WeakPolarHBondContact O-CB 3.35Å; F396-N400 PolarHBondContact O-N 3.02Å; F396-N400 PolarHBondContact O-ND2 3.42Å; L397-N400 CarbonylContact O-C 3.17Å; L397-N400 PolarHBondContact O-N 2.97Å; R398-N400 PolarHBondContact O-N 3.13Å; N400-E402 VanDerWaalsContact C-N 3.25Å; N400-E402 PolarHBondContact O-N 2.94Å; N400-W403 HydrophobicContact CB-CB 4.26Å; N400-W403 HydrophobicContact CB-CE3 4.35Å; N400-W403 WeakPolarHBondContact O-CA 3.5Å; N400-W403 WeakPolarHBondContact O-CB 3.17Å; N400-W403 PolarHBondContact O-N 2.94Å; N400-V404 WeakPolarHBondContact O-CG2 3.25Å; N400-V404 PolarHBondContact O-N 2.96Å
401	L	86.3	Confident	87.8	Confident	101 Å²	101	56.9 Å²	56.9	53%	0.529	29%	0.293	S	S	.	.	H	α-helix	trans	-52.8	-39.7	-178.4	-74.2	169.4	0	0	0	113.3	L397 R398 W403 V404 S405	L397-L401 PolarHBondContact O-N 3.24Å; L397-L401 VanDerWaalsContact O-N 3.15Å; R398-L401 VanDerWaalsContact O-CG 3.3Å; R398-L401 WeakPolarHBondContact O-CG 3.15Å; L401-W403 VanDerWaalsContact C-N 3.27Å; L401-W403 PolarHBondContact O-N 2.89Å; L401-V404 PolarHBondContact O-N 3.48Å; L401-S405 VanDerWaalsContact O-CB 3.29Å; L401-S405 WeakPolarHBondContact O-CB 3.25Å; L401-S405 PolarHBondContact O-N 2.91Å; L401-S405 PolarHBondContact O-OG 2.89Å
402	E	85.9	Confident	87.8	Confident	164 Å²	164	60 Å²	60	77%	0.766	31%	0.307	S	S	*	.	H	α-helix	trans	-63.8	-30	175.4	-66.6	-173.3	174.2	0	0	113.6	N400 S405 K406	N400-E402 VanDerWaalsContact C-N 3.25Å; N400-E402 PolarHBondContact O-N 2.94Å; E402-S405 PolarHBondContact O-OG 3.43Å; E402-K406 WeakPolarHBondContact O-CG 3.37Å
403	W	86.8	Confident	88	Confident	27 Å²	27	59.1 Å²	59.1	10%	0.102	30%	0.301	C	S	.	.	H	α-helix	trans	-82.9	-36	176.2	173.1	86.6	0	0	0	111.3	K368 H377 T380 V381 F396 N400 L401 K406	K368-W403 HydrophobicContact CD-CD2 4.05Å; K368-W403 HydrophobicContact CD-CE3 4.41Å; K368-W403 HydrophobicContact CD-CG 4.14Å; K368-W403 HydrophobicContact CG-CD2 4.11Å; K368-W403 HydrophobicContact CG-CG 4.31Å; K368-W403 HydrophobicContact CG-CZ2 4.29Å; H377-W403 HydrophobicContact CB-CZ2 4.46Å; H377-W403 AromaticContact CD2-CD2 4Å; H377-W403 AromaticContact CD2-CE2 3.38Å; H377-W403 AromaticContact CD2-CH2 3.72Å; H377-W403 AromaticContact CD2-CZ2 3.24Å; H377-W403 WeakPolarHBondContact CD2-CZ2 3.15Å; H377-W403 AromaticContact CD2-NE1 3.81Å; H377-W403 AromaticContact CG-CZ2 3.97Å; H377-W403 AromaticContact NE2-CD2 3.87Å; H377-W403 AromaticContact NE2-CE2 3.74Å; H377-W403 AromaticContact NE2-CE3 3.96Å; H377-W403 AromaticContact NE2-CH2 3.77Å; H377-W403 AromaticContact NE2-CZ2 3.71Å; H377-W403 AromaticContact NE2-CZ3 3.9Å; H377-W403 PolarHBondContact NE2-O 3.33Å; T380-W403 HydrophobicContact CG2-CH2 3.75Å; T380-W403 HydrophobicContact CG2-CZ2 4.26Å; V381-W403 HydrophobicContact CG2-CH2 4.05Å; V381-W403 HydrophobicContact CG2-CZ3 4.05Å; F396-W403 HydrophobicContact CE1-CH2 4.38Å; F396-W403 AromaticContact CE1-CZ3 3.82Å; F396-W403 HydrophobicContact CE1-CZ3 3.82Å; F396-W403 HydrophobicContact CZ-CH2 4.47Å; F396-W403 HydrophobicContact CZ-CZ3 4.09Å; N400-W403 HydrophobicContact CB-CB 4.26Å; N400-W403 HydrophobicContact CB-CE3 4.35Å; N400-W403 WeakPolarHBondContact O-CA 3.5Å; N400-W403 WeakPolarHBondContact O-CB 3.17Å; N400-W403 PolarHBondContact O-N 2.94Å; L401-W403 VanDerWaalsContact C-N 3.27Å; L401-W403 PolarHBondContact O-N 2.89Å; W403-K406 WeakPolarHBondContact O-CB 3.47Å; W403-K406 PolarHBondContact O-N 2.87Å
404	V	83.6	Confident	88.3	Confident	25 Å²	25	58.1 Å²	58.1	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-38.8	173.5	179	0	0	0	0	110.7	L397 N400 L401 K406 A407 A415	L397-V404 HydrophobicContact CD2-CG2 3.87Å; N400-V404 WeakPolarHBondContact O-CG2 3.25Å; N400-V404 PolarHBondContact O-N 2.96Å; L401-V404 PolarHBondContact O-N 3.48Å; V404-K406 PolarHBondContact O-N 2.83Å; V404-A407 WeakPolarHBondContact O-CB 3.42Å; V404-A407 PolarHBondContact O-N 3.21Å; V404-A415 HydrophobicContact CG1-CB 3.94Å
405	S	84.8	Confident	88.6	Confident	80 Å²	80	57 Å²	57	56%	0.559	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.5	-179.1	72.9	0	0	0	0	113.9	L401 E402 A407	L401-S405 VanDerWaalsContact O-CB 3.29Å; L401-S405 WeakPolarHBondContact O-CB 3.25Å; L401-S405 PolarHBondContact O-N 2.91Å; L401-S405 PolarHBondContact O-OG 2.89Å; E402-S405 PolarHBondContact O-OG 3.43Å; S405-A407 PolarHBondContact O-N 3.05Å
406	K	85.4	Confident	88.8	Confident	158 Å²	158	53.3 Å²	53.3	69%	0.687	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.4	171.6	-67.7	171.7	-172.6	176.3	0	113.1	E402 W403 V404	E402-K406 WeakPolarHBondContact O-CG 3.37Å; W403-K406 WeakPolarHBondContact O-CB 3.47Å; W403-K406 PolarHBondContact O-N 2.87Å; V404-K406 PolarHBondContact O-N 2.83Å
407	A	83.9	Confident	89.1	Confident	6 Å²	6	53.2 Å²	53.2	5%	0.05	27%	0.272	C	S	.	.			trans	-58.3	142.4	173.4	0	0	0	0	0	110.4	V404 S405 A411 K412	V404-A407 WeakPolarHBondContact O-CB 3.42Å; V404-A407 PolarHBondContact O-N 3.21Å; S405-A407 PolarHBondContact O-N 3.05Å; A407-A411 HydrophobicContact CB-CB 3.79Å; A407-K412 HydrophobicContact CB-CG 3.91Å; A407-K412 WeakPolarHBondContact O-CE 3.49Å; A407-K412 WeakPolarHBondContact O-CG 3.42Å
408	S	86.1	Confident	89.4	Confident	69 Å²	69	52.7 Å²	52.7	48%	0.483	27%	0.269	S	S	.	.			trans	-119	145	176.1	59.9	0	0	0	0	111.1	W410 A411	S408-W410 PolarHBondContact O-N 3.35Å; S408-W410 VanDerWaalsContact O-N 3.14Å; S408-A411 WeakPolarHBondContact O-CB 3.31Å; S408-A411 PolarHBondContact O-N 3.39Å
409	N	90.3	Very high	89.8	Confident	89 Å²	89	48 Å²	48	48%	0.476	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	-114.9	173.1	-55	-23.8	0	0	0	113.3	A411 K412 F413 Y449	N409-A411 PolarHBondContact O-N 2.82Å; N409-K412 WeakPolarHBondContact O-CB 3.37Å; N409-K412 PolarHBondContact O-N 3.04Å; N409-F413 PolarHBondContact O-N 3.39Å; N409-F413 VanDerWaalsContact O-N 3.15Å; N409-Y449 HydrophobicContact CB-CD1 4.5Å; N409-Y449 HydrophobicContact CB-CD2 4.35Å; N409-Y449 HydrophobicContact CB-CE1 4.18Å; N409-Y449 HydrophobicContact CB-CE2 4Å
410	W	92.6	Very high	90	Very high	71 Å²	71	43.5 Å²	43.5	27%	0.269	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-23.7	179.9	-66.7	110.5	0	0	0	114.6	S408 F413 T414 Y449 V485 H488 V520 W785	S408-W410 PolarHBondContact O-N 3.35Å; S408-W410 VanDerWaalsContact O-N 3.14Å; W410-F413 HydrophobicContact CE3-CB 4.09Å; W410-F413 HydrophobicContact CE3-CD1 4.1Å; W410-F413 HydrophobicContact CE3-CD2 4.31Å; W410-F413 AromaticContact CE3-CG 3.91Å; W410-F413 HydrophobicContact CE3-CG 3.91Å; W410-F413 HydrophobicContact CZ3-CD1 4.38Å; W410-F413 HydrophobicContact CZ3-CD2 4.11Å; W410-F413 HydrophobicContact CZ3-CE2 4.32Å; W410-F413 HydrophobicContact CZ3-CG 4.16Å; W410-F413 WeakPolarHBondContact O-CB 3.3Å; W410-F413 PolarHBondContact O-N 3.38Å; W410-T414 PolarHBondContact O-N 3.23Å; W410-T414 PolarHBondContact O-OG1 3.08Å; W410-Y449 HydrophobicContact CD2-CD1 4.2Å; W410-Y449 AromaticContact CD2-CE1 3.71Å; W410-Y449 HydrophobicContact CD2-CE1 3.71Å; W410-Y449 AromaticContact CE2-CE1 3.68Å; W410-Y449 HydrophobicContact CE3-CD1 4.21Å; W410-Y449 HydrophobicContact CE3-CE1 4.08Å; W410-Y449 HydrophobicContact CG-CE1 4.07Å; W410-Y449 HydrophobicContact CH2-CE1 4.43Å; W410-Y449 HydrophobicContact CZ2-CE1 4.07Å; W410-Y449 HydrophobicContact CZ3-CE1 4.42Å; W410-Y449 AromaticContact NE1-CE1 3.96Å; W410-V485 HydrophobicContact CH2-CG1 4.16Å; W410-V485 HydrophobicContact CH2-CG2 4.49Å; W410-V485 HydrophobicContact CZ2-CG2 4.44Å; W410-V485 HydrophobicContact CZ3-CG1 4.28Å; W410-H488 AromaticContact CH2-CD2 3.87Å; W410-H488 AromaticContact CZ3-CD2 3.87Å; W410-V520 HydrophobicContact CH2-CG1 3.7Å; W410-V520 HydrophobicContact CZ2-CG1 3.73Å; W410-W785 AromaticContact CD2-NE1 3.96Å; W410-W785 AromaticContact CE3-CZ2 3.64Å; W410-W785 HydrophobicContact CE3-CZ2 3.64Å; W410-W785 AromaticContact CE3-NE1 3.88Å; W410-W785 HydrophobicContact CH2-CZ2 4.34Å; W410-W785 HydrophobicContact CZ3-CH2 4.45Å; W410-W785 AromaticContact CZ3-CZ2 3.52Å; W410-W785 HydrophobicContact CZ3-CZ2 3.52Å
411	A	90.4	Very high	90.4	Very high	7 Å²	7	42.6 Å²	42.6	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-70.4	-35.7	172.2	0	0	0	0	0	111.3	A407 S408 N409 T414 A415	A407-A411 HydrophobicContact CB-CB 3.79Å; S408-A411 WeakPolarHBondContact O-CB 3.31Å; S408-A411 PolarHBondContact O-N 3.39Å; N409-A411 PolarHBondContact O-N 2.82Å; A411-T414 PolarHBondContact O-N 2.92Å; A411-A415 PolarHBondContact O-N 3.38Å
412	K	91.8	Very high	90.9	Very high	71 Å²	71	37.8 Å²	37.8	31%	0.309	19%	0.194	S	C	.	.	H	α-helix	trans	-64.4	-44.7	171.2	-66.3	-170.7	177.8	-173.9	0	110.8	A407 N409 T414 A415 V416 L450	A407-K412 HydrophobicContact CB-CG 3.91Å; A407-K412 WeakPolarHBondContact O-CE 3.49Å; A407-K412 WeakPolarHBondContact O-CG 3.42Å; N409-K412 WeakPolarHBondContact O-CB 3.37Å; N409-K412 PolarHBondContact O-N 3.04Å; K412-T414 VanDerWaalsContact C-N 3.3Å; K412-T414 PolarHBondContact O-N 3.23Å; K412-A415 PolarHBondContact O-N 2.83Å; K412-V416 PolarHBondContact O-N 3.44Å; K412-L450 HydrophobicContact CB-CD2 3.87Å; K412-L450 HydrophobicContact CD-CD2 4.27Å; K412-L450 HydrophobicContact CD-CG 4.49Å; K412-L450 HydrophobicContact CG-CD2 4.48Å
413	F	94.2	Very high	91.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-54.2	-47.2	173.5	175.9	-82.8	0	0	0	111.4	N409 W410 A415 V416 A417 Y449 A452 G453 Y456 L492 W785 P787	N409-F413 PolarHBondContact O-N 3.39Å; N409-F413 VanDerWaalsContact O-N 3.15Å; W410-F413 HydrophobicContact CE3-CB 4.09Å; W410-F413 HydrophobicContact CE3-CD1 4.1Å; W410-F413 HydrophobicContact CE3-CD2 4.31Å; W410-F413 AromaticContact CE3-CG 3.91Å; W410-F413 HydrophobicContact CE3-CG 3.91Å; W410-F413 HydrophobicContact CZ3-CD1 4.38Å; W410-F413 HydrophobicContact CZ3-CD2 4.11Å; W410-F413 HydrophobicContact CZ3-CE2 4.32Å; W410-F413 HydrophobicContact CZ3-CG 4.16Å; W410-F413 WeakPolarHBondContact O-CB 3.3Å; W410-F413 PolarHBondContact O-N 3.38Å; F413-A415 PolarHBondContact O-N 3.46Å; F413-V416 PolarHBondContact O-N 2.89Å; F413-A417 VanDerWaalsContact O-CB 3.22Å; F413-A417 WeakPolarHBondContact O-CB 3.27Å; F413-A417 PolarHBondContact O-N 3.43Å; F413-Y449 WeakPolarHBondContact CA-O 3.13Å; F413-Y449 HydrophobicContact CB-CD1 4.32Å; F413-A452 HydrophobicContact CD2-CB 3.79Å; F413-A452 VanDerWaalsContact CE2-C 3.44Å; F413-A452 HydrophobicContact CE2-CB 3.78Å; F413-A452 WeakPolarHBondContact CE2-O 3.37Å; F413-G453 VanDerWaalsContact CD2-N 3.31Å; F413-Y456 AromaticContact CE1-CD1 3.56Å; F413-Y456 HydrophobicContact CE1-CD1 3.56Å; F413-Y456 HydrophobicContact CE1-CE1 4.2Å; F413-Y456 HydrophobicContact CE1-CG 4.4Å; F413-Y456 AromaticContact CZ-CD1 3.61Å; F413-Y456 HydrophobicContact CZ-CD1 3.61Å; F413-Y456 HydrophobicContact CZ-CG 4.01Å; F413-L492 HydrophobicContact CZ-CD1 4.32Å; F413-W785 HydrophobicContact CD1-CH2 4.44Å; F413-W785 HydrophobicContact CD1-CZ2 4.14Å; F413-W785 AromaticContact CE1-CH2 3.6Å; F413-W785 HydrophobicContact CE1-CH2 3.6Å; F413-W785 AromaticContact CE1-CZ2 3.73Å; F413-W785 HydrophobicContact CE1-CZ2 3.73Å; F413-W785 AromaticContact CZ-CH2 3.96Å; F413-W785 HydrophobicContact CZ-CH2 3.96Å; F413-W785 HydrophobicContact CZ-CZ2 4.28Å; F413-P787 HydrophobicContact CD1-CB 3.99Å; F413-P787 HydrophobicContact CD1-CG 4.06Å; F413-P787 HydrophobicContact CE1-CB 3.8Å; F413-P787 HydrophobicContact CE1-CG 4.3Å
414	T	94.3	Very high	91.5	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-40.9	179.5	-50.4	0	0	0	0	112.3	V381 I382 W410 A411 K412 A417 S418 P787 H790	V381-T414 HydrophobicContact CG1-CG2 4.47Å; I382-T414 HydrophobicContact CD1-CG2 4Å; I382-T414 HydrophobicContact CG1-CG2 3.72Å; W410-T414 PolarHBondContact O-N 3.23Å; W410-T414 PolarHBondContact O-OG1 3.08Å; A411-T414 PolarHBondContact O-N 2.92Å; K412-T414 VanDerWaalsContact C-N 3.3Å; K412-T414 PolarHBondContact O-N 3.23Å; T414-A417 PolarHBondContact O-N 2.96Å; T414-S418 PolarHBondContact O-N 3.26Å; T414-P787 WeakPolarHBondContact OG1-CG 3.36Å; T414-H790 PolarHBondContact O-NE2 3.03Å
415	A	92.8	Very high	91.6	Very high	7 Å²	7	30.7 Å²	30.7	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-69.8	-37.2	-179.6	0	0	0	0	0	113.5	V381 V404 A411 K412 F413 S418	V381-A415 VanDerWaalsContact CG1-CA 3.5Å; V381-A415 HydrophobicContact CG1-CB 3.94Å; V381-A415 HydrophobicContact CG2-CB 4.49Å; V404-A415 HydrophobicContact CG1-CB 3.94Å; A411-A415 PolarHBondContact O-N 3.38Å; K412-A415 PolarHBondContact O-N 2.83Å; F413-A415 PolarHBondContact O-N 3.46Å; A415-S418 PolarHBondContact O-OG 3.25Å
416	V	93.6	Very high	91.7	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-71.2	-42.7	171.4	-179.4	0	0	0	0	110.1	K412 F413 S418 L419 Y437 L450 G454	K412-V416 PolarHBondContact O-N 3.44Å; F413-V416 PolarHBondContact O-N 2.89Å; V416-S418 PolarHBondContact O-N 3.32Å; V416-L419 VanDerWaalsContact O-CB 3.29Å; V416-L419 WeakPolarHBondContact O-CB 3.41Å; V416-L419 PolarHBondContact O-N 2.9Å; V416-Y437 HydrophobicContact CG1-CD1 4.05Å; V416-Y437 HydrophobicContact CG1-CD2 4.26Å; V416-Y437 HydrophobicContact CG1-CG 3.73Å; V416-Y437 HydrophobicContact CG2-CD1 3.7Å; V416-Y437 HydrophobicContact CG2-CE1 4Å; V416-Y437 HydrophobicContact CG2-CG 4.24Å; V416-L450 HydrophobicContact CG2-CB 4.37Å; V416-L450 HydrophobicContact CG2-CD2 3.48Å; V416-L450 VanDerWaalsContact CG2-CD2 3.48Å; V416-G454 VanDerWaalsContact CG1-N 3.31Å
417	A	95.7	Very high	91.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-31.5	177.8	0	0	0	0	0	113.3	F413 T414 L419 G420 Y456 L460	F413-A417 VanDerWaalsContact O-CB 3.22Å; F413-A417 WeakPolarHBondContact O-CB 3.27Å; F413-A417 PolarHBondContact O-N 3.43Å; T414-A417 PolarHBondContact O-N 2.96Å; A417-L419 PolarHBondContact O-N 3.45Å; A417-G420 PolarHBondContact O-N 2.98Å; A417-Y456 HydrophobicContact CB-CD1 3.45Å; A417-Y456 VanDerWaalsContact CB-CD1 3.45Å; A417-Y456 HydrophobicContact CB-CE1 3.98Å; A417-Y456 HydrophobicContact CB-CG 4.34Å; A417-L460 WeakPolarHBondContact O-CD1 3.44Å
418	S	95.6	Very high	91.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-28.7	175.7	46.6	0	0	0	0	113.7	V381 T414 A415 V416 G420 V421 I422 H790	V381-S418 WeakPolarHBondContact CG1-OG 3.47Å; T414-S418 PolarHBondContact O-N 3.26Å; A415-S418 PolarHBondContact O-OG 3.25Å; V416-S418 PolarHBondContact O-N 3.32Å; S418-G420 PolarHBondContact O-N 3.29Å; S418-V421 PolarHBondContact O-N 2.92Å; S418-I422 WeakPolarHBondContact O-CG1 3.42Å; S418-I422 PolarHBondContact O-N 3.43Å; S418-I422 VanDerWaalsContact O-N 3.09Å; S418-H790 PolarHBondContact N-NE2 3.39Å
419	L	94.6	Very high	91.6	Very high	11 Å²	11	25.6 Å²	25.6	6%	0.058	14%	0.143	C	C	.	.	H	α-helix	trans	-59.4	-33.9	173.9	-63.9	173.4	0	0	0	111.1	D394 L397 V416 A417 V421 I422 H423 L434 Y437	D394-L419 HydrophobicContact CB-CD2 4.11Å; L397-L419 HydrophobicContact CD1-CD2 3.75Å; L397-L419 HydrophobicContact CD1-CG 4.44Å; V416-L419 VanDerWaalsContact O-CB 3.29Å; V416-L419 WeakPolarHBondContact O-CB 3.41Å; V416-L419 PolarHBondContact O-N 2.9Å; A417-L419 PolarHBondContact O-N 3.45Å; L419-V421 VanDerWaalsContact C-N 3.29Å; L419-V421 PolarHBondContact O-N 3.01Å; L419-I422 PolarHBondContact O-N 2.97Å; L419-H423 WeakPolarHBondContact O-CB 3.43Å; L419-H423 PolarHBondContact O-CD2 3.36Å; L419-H423 VanDerWaalsContact O-CD2 3.31Å; L419-H423 PolarHBondContact O-N 3.18Å; L419-L434 HydrophobicContact CB-CD2 4.16Å; L419-L434 HydrophobicContact CD1-CD2 4.26Å; L419-Y437 HydrophobicContact CD1-CD2 3.9Å; L419-Y437 HydrophobicContact CD1-CE2 3.57Å
420	G	94.1	Very high	91.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-68.3	-27.4	177.7	0	0	0	0	0	114.1	A417 S418 K424 A457	A417-G420 PolarHBondContact O-N 2.98Å; S418-G420 PolarHBondContact O-N 3.29Å; G420-K424 PolarHBondContact O-N 2.92Å; G420-A457 WeakPolarHBondContact CA-O 3.36Å
421	V	96.2	Very high	91.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-76.7	-41.2	172.6	-176	0	0	0	0	110.7	A385 H389 G390 S418 L419 K424 L460 H790	A385-V421 HydrophobicContact CB-CB 4.02Å; A385-V421 HydrophobicContact CB-CG1 4.3Å; A385-V421 HydrophobicContact CB-CG2 4.35Å; A385-V421 VanDerWaalsContact O-CG1 3.27Å; A385-V421 WeakPolarHBondContact O-CG1 3.43Å; H389-V421 WeakPolarHBondContact CA-O 3.28Å; H389-V421 HydrophobicContact CB-CG1 4.28Å; G390-V421 PolarHBondContact N-O 3.45Å; S418-V421 PolarHBondContact O-N 2.92Å; L419-V421 VanDerWaalsContact C-N 3.29Å; L419-V421 PolarHBondContact O-N 3.01Å; V421-K424 WeakPolarHBondContact O-CB 3.31Å; V421-K424 PolarHBondContact O-N 3.36Å; V421-L460 HydrophobicContact CG2-CD1 4.01Å; V421-H790 HydrophobicContact CG2-CB 3.79Å
422	I	95.5	Very high	91	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.4	-42.7	-179.6	-64.5	170.6	0	0	0	111.2	H388 G390 T391 T392 S393 D394 L397 S418 L419	H388-I422 HydrophobicContact CB-CD1 4.48Å; H388-I422 HydrophobicContact CB-CG1 3.95Å; H388-I422 HydrophobicContact CB-CG2 4.27Å; H388-I422 WeakPolarHBondContact O-CA 3.33Å; G390-I422 CarbonylContact C-O 3.39Å; G390-I422 VanDerWaalsContact CA-O 3.24Å; G390-I422 WeakPolarHBondContact CA-O 3.08Å; G390-I422 PolarHBondContact N-O 3.43Å; G390-I422 VanDerWaalsContact N-O 3.07Å; T391-I422 PolarHBondContact N-O 3.32Å; T392-I422 PolarHBondContact N-O 3.05Å; T392-I422 VanDerWaalsContact N-O 3.13Å; S393-I422 WeakPolarHBondContact O-CG2 3.3Å; D394-I422 HydrophobicContact CB-CD1 4.48Å; D394-I422 HydrophobicContact CB-CG2 4.43Å; L397-I422 HydrophobicContact CD1-CD1 4.1Å; S418-I422 WeakPolarHBondContact O-CG1 3.42Å; S418-I422 PolarHBondContact O-N 3.43Å; S418-I422 VanDerWaalsContact O-N 3.09Å; L419-I422 PolarHBondContact O-N 2.97Å
423	H	93.9	Very high	90.7	Very high	10 Å²	10	24 Å²	24	5%	0.046	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	22.5	-179.6	-66.4	-86.2	0	0	0	113.2	L419 G425 H426 I461	L419-H423 WeakPolarHBondContact O-CB 3.43Å; L419-H423 PolarHBondContact O-CD2 3.36Å; L419-H423 VanDerWaalsContact O-CD2 3.31Å; L419-H423 PolarHBondContact O-N 3.18Å; H423-G425 PolarHBondContact O-N 3.44Å; H423-H426 HydrophobicContact CB-CB 4.2Å; H423-H426 VanDerWaalsContact O-CB 3.25Å; H423-H426 WeakPolarHBondContact O-CB 3.38Å; H423-H426 PolarHBondContact O-N 3.4Å; H423-I461 HydrophobicContact CB-CD1 4.04Å; H423-I461 HydrophobicContact CB-CG1 4.22Å; H423-I461 WeakPolarHBondContact O-CG2 3.37Å
424	K	91.1	Very high	90.4	Very high	43 Å²	43	24 Å²	24	19%	0.187	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	130	179.1	-171.3	-175.4	-177.7	-166.7	0	110.9	H389 G420 V421 H426 S463 S793	H389-K424 WeakPolarHBondContact CE1-CD 3.38Å; G420-K424 PolarHBondContact O-N 2.92Å; V421-K424 WeakPolarHBondContact O-CB 3.31Å; V421-K424 PolarHBondContact O-N 3.36Å; K424-H426 PolarHBondContact O-N 3.49Å; K424-S463 WeakPolarHBondContact CE-OG 2.84Å; K424-S793 PolarHBondContact NZ-O 3.41Å
425	G	86	Confident	90.1	Very high	15 Å²	15	29.4 Å²	29.4	16%	0.155	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-8.4	-177.7	0	0	0	0	0	114.8	T346 H423 E427 I461	T346-G425 VanDerWaalsContact CG2-CA 3.49Å; T346-G425 WeakPolarHBondContact CG2-O 3.39Å; H423-G425 PolarHBondContact O-N 3.44Å; G425-E427 PolarHBondContact O-N 3.45Å; G425-I461 PolarHBondContact N-O 3.05Å
426	H	88	Confident	89.9	Confident	6 Å²	6	35.1 Å²	35.1	3%	0.028	19%	0.189	C	C	.	.			trans	-80.2	67.4	173.4	-162.2	126.7	0	0	0	110.5	L350 T392 H423 K424 E429 A430 P937	L350-H426 HydrophobicContact CD1-CB 4.41Å; L350-H426 HydrophobicContact CD2-CB 4.35Å; T392-H426 HydrophobicContact CG2-CB 4.39Å; T392-H426 WeakPolarHBondContact CG2-ND1 3.45Å; H423-H426 HydrophobicContact CB-CB 4.2Å; H423-H426 VanDerWaalsContact O-CB 3.25Å; H423-H426 WeakPolarHBondContact O-CB 3.38Å; H423-H426 PolarHBondContact O-N 3.4Å; K424-H426 PolarHBondContact O-N 3.49Å; H426-E429 IonicContact CD2-OE2 2.73Å; H426-E429 IonicContact CE1-OE2 3.45Å; H426-E429 PolarHBondContact CE1-OE2 3.25Å; H426-E429 VanDerWaalsContact NE2-CB 3.35Å; H426-E429 WeakPolarHBondContact NE2-CB 3.31Å; H426-E429 IonicContact NE2-OE2 3.57Å; H426-E429 PolarHBondContact NE2-OE2 2.98Å; H426-A430 WeakPolarHBondContact O-CB 3.48Å; H426-A430 PolarHBondContact O-N 2.84Å; H426-P937 WeakPolarHBondContact CE1-CB 3.34Å; H426-P937 WeakPolarHBondContact CE1-CG 3.34Å
427	E	85	Confident	89.6	Confident	46 Å²	46	38.4 Å²	38.4	22%	0.215	20%	0.201	C	C	.	.			trans	-72.6	-39.2	-170.7	-67	-177.2	-169	0	0	112.3	G425 E429 A430 F462 R465	G425-E427 PolarHBondContact O-N 3.45Å; E427-E429 PolarHBondContact O-N 3.33Å; E427-A430 WeakPolarHBondContact O-CB 3.14Å; E427-A430 PolarHBondContact O-N 2.91Å; E427-F462 HydrophobicContact CB-CD1 4.26Å; E427-F462 HydrophobicContact CB-CE1 3.52Å; E427-F462 HydrophobicContact CB-CZ 3.84Å; E427-F462 HydrophobicContact CG-CD1 3.75Å; E427-F462 HydrophobicContact CG-CE1 3.55Å; E427-F462 HydrophobicContact CG-CZ 4.15Å; E427-F462 WeakPolarHBondContact O-CZ 3.36Å; E427-R465 WeakPolarHBondContact OE1-CD 3.23Å; E427-R465 IonicContact OE1-NE 2.82Å; E427-R465 PolarHBondContact OE1-NE 3.21Å; E427-R465 VanDerWaalsContact OE1-NE 3.14Å
428	A	83.5	Confident	89.3	Confident	104 Å²	104	39 Å²	39	86%	0.86	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-41.2	-172.5	0	0	0	0	0	113.6
429	E	83.8	Confident	88.7	Confident	49 Å²	49	40.2 Å²	40.2	23%	0.229	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	12	-177.3	-44.4	178.1	111.1	0	0	112.8	H426 E427 M431 R432 V433 I939	H426-E429 IonicContact CD2-OE2 2.73Å; H426-E429 IonicContact CE1-OE2 3.45Å; H426-E429 PolarHBondContact CE1-OE2 3.25Å; H426-E429 VanDerWaalsContact NE2-CB 3.35Å; H426-E429 WeakPolarHBondContact NE2-CB 3.31Å; H426-E429 IonicContact NE2-OE2 3.57Å; H426-E429 PolarHBondContact NE2-OE2 2.98Å; E427-E429 PolarHBondContact O-N 3.33Å; E429-M431 PolarHBondContact O-N 3.16Å; E429-M431 VanDerWaalsContact O-N 3.17Å; E429-R432 HydrophobicContact CB-CB 4.38Å; E429-R432 WeakPolarHBondContact O-CA 3.32Å; E429-R432 WeakPolarHBondContact O-CB 3.46Å; E429-R432 PolarHBondContact O-N 2.6Å; E429-R432 IonicContact OE1-NH1 2.73Å; E429-V433 WeakPolarHBondContact O-CG2 3.42Å; E429-V433 PolarHBondContact O-N 2.99Å; E429-I939 HydrophobicContact CB-CD1 3.35Å; E429-I939 HydrophobicContact CG-CD1 3.94Å; E429-I939 WeakPolarHBondContact OE2-CD1 3.49Å; E429-I939 WeakPolarHBondContact OE2-CG1 3.36Å
430	A	86.2	Confident	87.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-51.8	-42.4	-178.7	0	0	0	0	0	112.8	H426 E427 R432 L434 L458 I461 F462	H426-A430 WeakPolarHBondContact O-CB 3.48Å; H426-A430 PolarHBondContact O-N 2.84Å; E427-A430 WeakPolarHBondContact O-CB 3.14Å; E427-A430 PolarHBondContact O-N 2.91Å; A430-R432 VanDerWaalsContact C-N 3.34Å; A430-L434 WeakPolarHBondContact O-CB 3.5Å; A430-L434 WeakPolarHBondContact O-CG 3.45Å; A430-L434 PolarHBondContact O-N 3.35Å; A430-L434 VanDerWaalsContact O-N 3.13Å; A430-L458 HydrophobicContact CB-CD1 4.21Å; A430-I461 HydrophobicContact CB-CD1 4.01Å; A430-I461 HydrophobicContact CB-CG2 3.84Å; A430-F462 HydrophobicContact CB-CD2 4.47Å; A430-F462 HydrophobicContact CB-CE2 3.47Å; A430-F462 VanDerWaalsContact CB-CE2 3.47Å; A430-F462 HydrophobicContact CB-CZ 3.97Å
431	M	87.2	Confident	86.2	Confident	82 Å²	82	54.2 Å²	54.2	40%	0.404	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-33.7	178.8	-67.3	-64.4	-71.7	0	0	112.4	E429 E435 L438 L458 Y473	E429-M431 PolarHBondContact O-N 3.16Å; E429-M431 VanDerWaalsContact O-N 3.17Å; M431-E435 WeakPolarHBondContact O-CA 3.45Å; M431-E435 PolarHBondContact O-N 3.49Å; M431-E435 VanDerWaalsContact O-N 3.07Å; M431-L438 HydrophobicContact CE-CD1 3.71Å; M431-L438 HydrophobicContact SD-CD1 3.87Å; M431-L458 HydrophobicContact SD-CD1 4.02Å; M431-L458 HydrophobicContact SD-CD2 4.1Å; M431-Y473 HydrophobicContact CE-CE1 4.44Å; M431-Y473 HydrophobicContact CE-CE2 4.36Å
432	R	87.4	Confident	84.1	Confident	96 Å²	96	59.8 Å²	59.8	36%	0.362	31%	0.314	S	S	.	.	H	α-helix	trans	-71.9	-47.6	177.3	-174	-176.3	179.3	-170.1	1.7	110.8	E429 A430 L434 E435	E429-R432 HydrophobicContact CB-CB 4.38Å; E429-R432 WeakPolarHBondContact O-CA 3.32Å; E429-R432 WeakPolarHBondContact O-CB 3.46Å; E429-R432 PolarHBondContact O-N 2.6Å; E429-R432 IonicContact OE1-NH1 2.73Å; A430-R432 VanDerWaalsContact C-N 3.34Å; R432-L434 PolarHBondContact O-N 3.46Å; R432-E435 WeakPolarHBondContact O-CB 3.25Å; R432-E435 PolarHBondContact O-N 2.92Å
433	V	86	Confident	82	Confident	28 Å²	28	62.1 Å²	62.1	17%	0.17	33%	0.333	C	S	.	.	H	α-helix	trans	-57.1	-41.3	177.2	175.6	0	0	0	0	111.2	E429 I939	E429-V433 WeakPolarHBondContact O-CG2 3.42Å; E429-V433 PolarHBondContact O-N 2.99Å; V433-I939 HydrophobicContact CG2-CD1 3.49Å; V433-I939 VanDerWaalsContact CG2-CD1 3.49Å; V433-I939 HydrophobicContact CG2-CG1 4.35Å
434	L	88.6	Confident	79.9	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	0.6	-176.1	-63	177.8	0	0	0	114.1	L419 A430 R432 N436 Y437 L438 A457 L458 I461	L419-L434 HydrophobicContact CB-CD2 4.16Å; L419-L434 HydrophobicContact CD1-CD2 4.26Å; A430-L434 WeakPolarHBondContact O-CB 3.5Å; A430-L434 WeakPolarHBondContact O-CG 3.45Å; A430-L434 PolarHBondContact O-N 3.35Å; A430-L434 VanDerWaalsContact O-N 3.13Å; R432-L434 PolarHBondContact O-N 3.46Å; L434-N436 VanDerWaalsContact C-N 3.27Å; L434-N436 PolarHBondContact O-N 2.96Å; L434-N436 VanDerWaalsContact O-N 3.11Å; L434-Y437 CarbonylContact O-C 3.46Å; L434-Y437 WeakPolarHBondContact O-CA 3.24Å; L434-Y437 PolarHBondContact O-N 3Å; L434-L438 HydrophobicContact CB-CD1 4.25Å; L434-L438 HydrophobicContact CB-CD2 4.45Å; L434-L438 HydrophobicContact CB-CG 4.04Å; L434-L438 WeakPolarHBondContact O-CG 3.4Å; L434-L438 PolarHBondContact O-N 3.25Å; L434-A457 HydrophobicContact CD1-CB 3.9Å; L434-A457 HydrophobicContact CD2-CB 3.88Å; L434-L458 HydrophobicContact CD1-CB 3.9Å; L434-L458 HydrophobicContact CD1-CD1 4.17Å; L434-I461 HydrophobicContact CD1-CD1 3.75Å; L434-I461 HydrophobicContact CG-CD1 4.28Å
435	E	88.5	Confident	78	Confident	115 Å²	115	68.5 Å²	68.5	54%	0.537	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-51.8	-43.1	-170.3	-173.2	-177.2	173.1	0	0	113.2	M431 R432 Y437 L438	M431-E435 WeakPolarHBondContact O-CA 3.45Å; M431-E435 PolarHBondContact O-N 3.49Å; M431-E435 VanDerWaalsContact O-N 3.07Å; R432-E435 WeakPolarHBondContact O-CB 3.25Å; R432-E435 PolarHBondContact O-N 2.92Å; E435-Y437 PolarHBondContact O-N 3.17Å; E435-L438 PolarHBondContact O-N 3.14Å
436	N	86.8	Confident	76.5	Confident	128 Å²	128	74 Å²	74	68%	0.684	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-71.5	-15.2	179.6	-71.5	-37.6	0	0	0	114.2	L434	L434-N436 VanDerWaalsContact C-N 3.27Å; L434-N436 PolarHBondContact O-N 2.96Å; L434-N436 VanDerWaalsContact O-N 3.11Å
437	Y	88.6	Confident	75.5	Confident	73 Å²	73	75.8 Å²	75.8	29%	0.286	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-114.2	7.2	-179.5	-51.3	-70.4	0	0	0	112.7	V416 L419 L434 E435 E451	V416-Y437 HydrophobicContact CG1-CD1 4.05Å; V416-Y437 HydrophobicContact CG1-CD2 4.26Å; V416-Y437 HydrophobicContact CG1-CG 3.73Å; V416-Y437 HydrophobicContact CG2-CD1 3.7Å; V416-Y437 HydrophobicContact CG2-CE1 4Å; V416-Y437 HydrophobicContact CG2-CG 4.24Å; L419-Y437 HydrophobicContact CD1-CD2 3.9Å; L419-Y437 HydrophobicContact CD1-CE2 3.57Å; L434-Y437 CarbonylContact O-C 3.46Å; L434-Y437 WeakPolarHBondContact O-CA 3.24Å; L434-Y437 PolarHBondContact O-N 3Å; E435-Y437 PolarHBondContact O-N 3.17Å; Y437-E451 VanDerWaalsContact O-CA 3.26Å; Y437-E451 WeakPolarHBondContact O-CA 3.38Å
438	L	88.1	Confident	75.6	Confident	13 Å²	13	73.8 Å²	73.8	7%	0.068	43%	0.426	C	S	.	.	S	Bend	trans	-94.4	145.1	173.6	-72.5	177	0	0	0	110.3	M431 L434 E435 K440 L455 L458 Y473	M431-L438 HydrophobicContact CE-CD1 3.71Å; M431-L438 HydrophobicContact SD-CD1 3.87Å; L434-L438 HydrophobicContact CB-CD1 4.25Å; L434-L438 HydrophobicContact CB-CD2 4.45Å; L434-L438 HydrophobicContact CB-CG 4.04Å; L434-L438 WeakPolarHBondContact O-CG 3.4Å; L434-L438 PolarHBondContact O-N 3.25Å; E435-L438 PolarHBondContact O-N 3.14Å; L438-K440 PolarHBondContact O-N 2.88Å; L438-K440 VanDerWaalsContact O-N 3.17Å; L438-L455 HydrophobicContact CD2-CD2 4.27Å; L438-L458 HydrophobicContact CD2-CD2 4.48Å; L438-Y473 HydrophobicContact CD2-CE1 4.17Å
439	P	83.7	Confident	75.9	Confident	25 Å²	25	70.8 Å²	70.8	16%	0.162	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-59.2	121.4	178.5	19.8	-29.8	0	0	0	111.6	E451 L455 Q477 M486	P439-E451 HydrophobicContact CB-CB 4.39Å; P439-L455 HydrophobicContact CG-CD2 4.2Å; P439-Q477 HydrophobicContact CG-CB 4.4Å; P439-Q477 HydrophobicContact CG-CG 4Å; P439-M486 HydrophobicContact CB-CE 3.69Å; P439-M486 HydrophobicContact CG-CE 3.71Å
440	K	76.3	Confident	76.2	Confident	121 Å²	121	71.3 Å²	71.3	53%	0.526	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-91	140	174.9	-60	-175.3	-179.3	-174.4	0	109.7	L438 S442 A443	L438-K440 PolarHBondContact O-N 2.88Å; L438-K440 VanDerWaalsContact O-N 3.17Å; K440-S442 PolarHBondContact O-N 2.9Å; K440-A443 HydrophobicContact CB-CB 3.99Å; K440-A443 PolarHBondContact O-N 3.21Å; K440-A443 VanDerWaalsContact O-N 3.11Å
441	E	59.9	Low	76.5	Confident	185 Å²	185	72.6 Å²	72.6	86%	0.864	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.7	-171.5	-156.3	142.1	-152.5	0	0	114.3
442	S	52.7	Low	76.8	Confident	117 Å²	117	68.7 Å²	68.7	82%	0.818	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	1.6	179.6	-58.8	0	0	0	0	115.1	K440 S444	K440-S442 PolarHBondContact O-N 2.9Å; S442-S444 PolarHBondContact O-N 3.36Å
443	A	50.5	Low	77.1	Confident	48 Å²	48	64.1 Å²	64.1	40%	0.397	37%	0.366	S	S	.	.			trans	-92.8	97.2	-174.8	0	0	0	0	0	111.2	K440 S445	K440-A443 HydrophobicContact CB-CB 3.99Å; K440-A443 PolarHBondContact O-N 3.21Å; K440-A443 VanDerWaalsContact O-N 3.11Å; A443-S445 PolarHBondContact O-N 2.81Å
444	S	49.9	Very low	77.5	Confident	122 Å²	122	62.8 Å²	62.8	85%	0.853	36%	0.358	S	S	*	.			trans	-70.4	37.6	162.1	44.8	0	0	0	0	112.1	S442 S446	S442-S444 PolarHBondContact O-N 3.36Å; S444-S446 PolarHBondContact O-N 2.93Å
445	S	51.5	Low	77.8	Confident	66 Å²	66	62.8 Å²	62.8	46%	0.462	36%	0.358	S	S	.	.			trans	-53.8	115.1	174.1	-67.2	0	0	0	0	108.9	A443 S447 E451	A443-S445 PolarHBondContact O-N 2.81Å; S445-S447 PolarHBondContact O-N 3.33Å; S445-E451 WeakPolarHBondContact CB-OE1 3.49Å; S445-E451 PolarHBondContact OG-OE1 3.49Å
446	S	55.3	Low	78.2	Confident	129 Å²	129	57.3 Å²	57.3	90%	0.902	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	4.6	-151	48.7	0	0	0	0	116.9	S444	S444-S446 PolarHBondContact O-N 2.93Å
447	S	67	Low	78.7	Confident	45 Å²	45	51.2 Å²	51.2	32%	0.315	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-25.6	-177.8	76.9	0	0	0	0	115.4	S445 Y449 N483	S445-S447 PolarHBondContact O-N 3.33Å; S447-Y449 WeakPolarHBondContact O-CD2 3.31Å; S447-Y449 PolarHBondContact O-N 3.49Å; S447-Y449 VanDerWaalsContact O-N 3.09Å; S447-N483 PolarHBondContact O-ND2 3.47Å
448	G	85.5	Confident	79	Confident	4 Å²	4	47.7 Å²	47.7	4%	0.041	29%	0.286	C	S	.	.			trans	65.9	1	178.3	0	0	0	0	0	116.3	E451 A452	G448-E451 VanDerWaalsContact CA-OE2 3.24Å; G448-E451 WeakPolarHBondContact CA-OE2 3.35Å; G448-A452 WeakPolarHBondContact O-CB 3.42Å; G448-A452 PolarHBondContact O-N 3.33Å
449	Y	90.8	Very high	79.3	Confident	41 Å²	41	47.1 Å²	47.1	16%	0.161	28%	0.283	C	S	.	.	H	α-helix	trans	-72.4	-34.5	-177.1	-75.1	-81.7	0	0	0	113.3	N409 W410 F413 S447 G453 V485	N409-Y449 HydrophobicContact CB-CD1 4.5Å; N409-Y449 HydrophobicContact CB-CD2 4.35Å; N409-Y449 HydrophobicContact CB-CE1 4.18Å; N409-Y449 HydrophobicContact CB-CE2 4Å; W410-Y449 HydrophobicContact CD2-CD1 4.2Å; W410-Y449 AromaticContact CD2-CE1 3.71Å; W410-Y449 HydrophobicContact CD2-CE1 3.71Å; W410-Y449 AromaticContact CE2-CE1 3.68Å; W410-Y449 HydrophobicContact CE3-CD1 4.21Å; W410-Y449 HydrophobicContact CE3-CE1 4.08Å; W410-Y449 HydrophobicContact CG-CE1 4.07Å; W410-Y449 HydrophobicContact CH2-CE1 4.43Å; W410-Y449 HydrophobicContact CZ2-CE1 4.07Å; W410-Y449 HydrophobicContact CZ3-CE1 4.42Å; W410-Y449 AromaticContact NE1-CE1 3.96Å; F413-Y449 WeakPolarHBondContact CA-O 3.13Å; F413-Y449 HydrophobicContact CB-CD1 4.32Å; S447-Y449 WeakPolarHBondContact O-CD2 3.31Å; S447-Y449 PolarHBondContact O-N 3.49Å; S447-Y449 VanDerWaalsContact O-N 3.09Å; Y449-G453 PolarHBondContact O-N 3.06Å; Y449-V485 HydrophobicContact CD1-CG1 3.46Å; Y449-V485 VanDerWaalsContact CD1-CG1 3.46Å; Y449-V485 HydrophobicContact CD1-CG2 4.4Å; Y449-V485 HydrophobicContact CE1-CB 4.35Å; Y449-V485 HydrophobicContact CE1-CG1 3.61Å; Y449-V485 HydrophobicContact CE1-CG2 3.75Å; Y449-V485 HydrophobicContact CE2-CG2 4.4Å; Y449-V485 HydrophobicContact CG-CG1 4.01Å
450	L	90.7	Very high	79.9	Confident	60 Å²	60	46 Å²	46	31%	0.314	28%	0.275	S	S	.	.	H	α-helix	trans	-69.1	-47.9	177.3	-68.3	172.8	0	0	0	109.3	K412 V416 A452 G453 G454	K412-L450 HydrophobicContact CB-CD2 3.87Å; K412-L450 HydrophobicContact CD-CD2 4.27Å; K412-L450 HydrophobicContact CD-CG 4.49Å; K412-L450 HydrophobicContact CG-CD2 4.48Å; V416-L450 HydrophobicContact CG2-CB 4.37Å; V416-L450 HydrophobicContact CG2-CD2 3.48Å; V416-L450 VanDerWaalsContact CG2-CD2 3.48Å; L450-A452 PolarHBondContact O-N 2.94Å; L450-G453 CarbonylContact O-C 3.56Å; L450-G453 WeakPolarHBondContact O-CA 3.46Å; L450-G453 PolarHBondContact O-N 3.09Å; L450-G453 VanDerWaalsContact O-N 3.13Å; L450-G454 PolarHBondContact O-N 3Å
451	E	91.9	Very high	80.7	Confident	26 Å²	26	40.3 Å²	40.3	12%	0.121	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-41.7	-179.6	-60.6	86.2	167.8	0	0	111.7	Y437 P439 S445 G448 G453 G454 L455 M486	Y437-E451 VanDerWaalsContact O-CA 3.26Å; Y437-E451 WeakPolarHBondContact O-CA 3.38Å; P439-E451 HydrophobicContact CB-CB 4.39Å; S445-E451 WeakPolarHBondContact CB-OE1 3.49Å; S445-E451 PolarHBondContact OG-OE1 3.49Å; G448-E451 VanDerWaalsContact CA-OE2 3.24Å; G448-E451 WeakPolarHBondContact CA-OE2 3.35Å; E451-G453 VanDerWaalsContact C-N 3.35Å; E451-G454 PolarHBondContact O-N 3.47Å; E451-L455 WeakPolarHBondContact O-CG 3Å; E451-L455 PolarHBondContact O-N 2.91Å; E451-M486 HydrophobicContact CB-CE 3.76Å; E451-M486 HydrophobicContact CB-SD 3.44Å; E451-M486 WeakPolarHBondContact CB-SD 3.48Å
452	A	92.9	Very high	82.2	Confident	0 Å²	0	32 Å²	32	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-39.3	173	0	0	0	0	0	112.4	F413 G448 L450 G454 L455 Y456 V485 M486 G489	F413-A452 HydrophobicContact CD2-CB 3.79Å; F413-A452 VanDerWaalsContact CE2-C 3.44Å; F413-A452 HydrophobicContact CE2-CB 3.78Å; F413-A452 WeakPolarHBondContact CE2-O 3.37Å; G448-A452 WeakPolarHBondContact O-CB 3.42Å; G448-A452 PolarHBondContact O-N 3.33Å; L450-A452 PolarHBondContact O-N 2.94Å; A452-G454 VanDerWaalsContact C-N 3.28Å; A452-L455 PolarHBondContact O-N 3.33Å; A452-Y456 PolarHBondContact O-N 3.33Å; A452-V485 HydrophobicContact CB-CG1 3.76Å; A452-V485 WeakPolarHBondContact CB-O 3.41Å; A452-M486 HydrophobicContact CB-SD 4.03Å; A452-M486 PolarHBondContact N-SD 3.35Å; A452-M486 VanDerWaalsContact N-SD 3.38Å; A452-G489 WeakPolarHBondContact O-CA 3.31Å
453	G	93.5	Very high	83.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-36.3	173.8	0	0	0	0	0	111.7	F413 Y449 L450 E451 Y456 A457	F413-G453 VanDerWaalsContact CD2-N 3.31Å; Y449-G453 PolarHBondContact O-N 3.06Å; L450-G453 CarbonylContact O-C 3.56Å; L450-G453 WeakPolarHBondContact O-CA 3.46Å; L450-G453 PolarHBondContact O-N 3.09Å; L450-G453 VanDerWaalsContact O-N 3.13Å; E451-G453 VanDerWaalsContact C-N 3.35Å; G453-Y456 PolarHBondContact O-N 3.45Å; G453-A457 WeakPolarHBondContact O-CB 3.42Å; G453-A457 PolarHBondContact O-N 3.22Å
454	G	94.6	Very high	85.4	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-41.1	174.5	0	0	0	0	0	112.7	V416 L450 E451 A452 Y456 A457 L458	V416-G454 VanDerWaalsContact CG1-N 3.31Å; L450-G454 PolarHBondContact O-N 3Å; E451-G454 PolarHBondContact O-N 3.47Å; A452-G454 VanDerWaalsContact C-N 3.28Å; G454-Y456 VanDerWaalsContact C-N 3.33Å; G454-Y456 PolarHBondContact O-N 2.82Å; G454-A457 WeakPolarHBondContact O-CB 3.48Å; G454-A457 PolarHBondContact O-N 3.02Å; G454-L458 WeakPolarHBondContact O-CB 3.3Å; G454-L458 PolarHBondContact O-N 2.96Å
455	L	95.6	Very high	87	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-39.5	173.2	-64.2	176.8	0	0	0	112	L438 P439 E451 A452 L458 G459 Y473 L474 Q477 M486 G493	L438-L455 HydrophobicContact CD2-CD2 4.27Å; P439-L455 HydrophobicContact CG-CD2 4.2Å; E451-L455 WeakPolarHBondContact O-CG 3Å; E451-L455 PolarHBondContact O-N 2.91Å; A452-L455 PolarHBondContact O-N 3.33Å; L455-L458 PolarHBondContact O-N 2.82Å; L455-G459 PolarHBondContact O-N 3.17Å; L455-Y473 HydrophobicContact CD2-CE1 4Å; L455-L474 HydrophobicContact CB-CD2 4.23Å; L455-L474 HydrophobicContact CD2-CD2 3.96Å; L455-Q477 HydrophobicContact CD1-CB 4.29Å; L455-Q477 HydrophobicContact CD2-CB 4.13Å; L455-Q477 HydrophobicContact CD2-CG 4.28Å; L455-M486 HydrophobicContact CD1-CE 3.76Å; L455-G493 WeakPolarHBondContact O-CA 3.35Å
456	Y	97	Very high	88.4	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68	-42.2	175.3	-177.3	-145.7	0	0	0	111.7	F413 A417 A452 G453 G454 L458 G459 L460 L492 L496 P787 H790 F791	F413-Y456 AromaticContact CE1-CD1 3.56Å; F413-Y456 HydrophobicContact CE1-CD1 3.56Å; F413-Y456 HydrophobicContact CE1-CE1 4.2Å; F413-Y456 HydrophobicContact CE1-CG 4.4Å; F413-Y456 AromaticContact CZ-CD1 3.61Å; F413-Y456 HydrophobicContact CZ-CD1 3.61Å; F413-Y456 HydrophobicContact CZ-CG 4.01Å; A417-Y456 HydrophobicContact CB-CD1 3.45Å; A417-Y456 VanDerWaalsContact CB-CD1 3.45Å; A417-Y456 HydrophobicContact CB-CE1 3.98Å; A417-Y456 HydrophobicContact CB-CG 4.34Å; A452-Y456 PolarHBondContact O-N 3.33Å; G453-Y456 PolarHBondContact O-N 3.45Å; G454-Y456 VanDerWaalsContact C-N 3.33Å; G454-Y456 PolarHBondContact O-N 2.82Å; Y456-L458 VanDerWaalsContact C-N 3.33Å; Y456-L458 PolarHBondContact O-N 2.77Å; Y456-G459 PolarHBondContact O-N 3.22Å; Y456-L460 HydrophobicContact CD1-CD1 4.39Å; Y456-L460 HydrophobicContact CD2-CD1 4.38Å; Y456-L460 HydrophobicContact CD2-CG 4.35Å; Y456-L460 HydrophobicContact CE1-CD1 4.12Å; Y456-L460 HydrophobicContact CE2-CD1 4.14Å; Y456-L460 HydrophobicContact CE2-CD2 4.33Å; Y456-L460 HydrophobicContact CE2-CG 4.06Å; Y456-L460 HydrophobicContact CG-CD1 4.49Å; Y456-L460 PolarHBondContact O-N 3.26Å; Y456-L492 HydrophobicContact CD1-CD1 4.45Å; Y456-L492 HydrophobicContact CD2-CB 3.47Å; Y456-L492 VanDerWaalsContact CD2-CB 3.47Å; Y456-L492 HydrophobicContact CD2-CD1 4.17Å; Y456-L492 HydrophobicContact CD2-CG 4.46Å; Y456-L492 HydrophobicContact CE2-CB 3.8Å; Y456-L492 HydrophobicContact CE2-CD1 4.23Å; Y456-L492 HydrophobicContact CG-CB 4.18Å; Y456-L492 HydrophobicContact CG-CD1 4.3Å; Y456-L496 HydrophobicContact CD2-CD1 3.9Å; Y456-L496 HydrophobicContact CE2-CD1 3.43Å; Y456-L496 VanDerWaalsContact CE2-CD1 3.43Å; Y456-P787 PolarHBondContact OH-O 2.81Å; Y456-H790 HydrophobicContact CE1-CB 4.39Å; Y456-F791 AromaticContact CE2-CE2 3.89Å; Y456-F791 HydrophobicContact CE2-CE2 3.89Å; Y456-F791 HydrophobicContact CE2-CZ 4.49Å; Y456-F791 AromaticContact CZ-CE2 3.84Å; Y456-F791 WeakPolarHBondContact OH-CD2 3.41Å; Y456-F791 WeakPolarHBondContact OH-CE2 3.36Å
457	A	96.4	Very high	89.8	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-57.3	-45.4	173.4	0	0	0	0	0	111.4	G420 L434 G453 G454 G459 L460 I461	G420-A457 WeakPolarHBondContact CA-O 3.36Å; L434-A457 HydrophobicContact CD1-CB 3.9Å; L434-A457 HydrophobicContact CD2-CB 3.88Å; G453-A457 WeakPolarHBondContact O-CB 3.42Å; G453-A457 PolarHBondContact O-N 3.22Å; G454-A457 WeakPolarHBondContact O-CB 3.48Å; G454-A457 PolarHBondContact O-N 3.02Å; A457-G459 VanDerWaalsContact C-N 3.29Å; A457-G459 PolarHBondContact O-N 3.33Å; A457-L460 WeakPolarHBondContact O-CB 3.25Å; A457-L460 PolarHBondContact O-N 2.95Å; A457-I461 WeakPolarHBondContact O-CG1 3.48Å; A457-I461 PolarHBondContact O-N 3.29Å
458	L	95.4	Very high	90.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.3	-42.7	177.7	-172.5	63.8	0	0	0	111.3	A430 M431 L434 L438 G454 L455 Y456 I461 F462 V470 Y473 L474	A430-L458 HydrophobicContact CB-CD1 4.21Å; M431-L458 HydrophobicContact SD-CD1 4.02Å; M431-L458 HydrophobicContact SD-CD2 4.1Å; L434-L458 HydrophobicContact CD1-CB 3.9Å; L434-L458 HydrophobicContact CD1-CD1 4.17Å; L438-L458 HydrophobicContact CD2-CD2 4.48Å; G454-L458 WeakPolarHBondContact O-CB 3.3Å; G454-L458 PolarHBondContact O-N 2.96Å; L455-L458 PolarHBondContact O-N 2.82Å; Y456-L458 VanDerWaalsContact C-N 3.33Å; Y456-L458 PolarHBondContact O-N 2.77Å; L458-I461 PolarHBondContact O-N 3.26Å; L458-F462 HydrophobicContact CD1-CD2 3.79Å; L458-F462 HydrophobicContact CD1-CE2 3.64Å; L458-F462 HydrophobicContact CG-CD2 4.29Å; L458-F462 WeakPolarHBondContact O-CD2 3.3Å; L458-F462 PolarHBondContact O-N 3.14Å; L458-F462 VanDerWaalsContact O-N 3.08Å; L458-V470 HydrophobicContact CD2-CG1 4.06Å; L458-V470 HydrophobicContact CG-CG1 4.02Å; L458-Y473 HydrophobicContact CD2-CD1 3.88Å; L458-Y473 HydrophobicContact CD2-CE1 4.04Å; L458-L474 HydrophobicContact CD2-CD2 4.02Å; L458-L474 HydrophobicContact CD2-CG 4.23Å
459	G	94.4	Very high	90.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.4	-32.5	174.4	0	0	0	0	0	114.4	L455 Y456 A457 F462 S463 G493 L496	L455-G459 PolarHBondContact O-N 3.17Å; Y456-G459 PolarHBondContact O-N 3.22Å; A457-G459 VanDerWaalsContact C-N 3.29Å; A457-G459 PolarHBondContact O-N 3.33Å; G459-F462 CarbonylContact O-C 3.34Å; G459-S463 VanDerWaalsContact O-CA 3.31Å; G459-S463 WeakPolarHBondContact O-CA 3.38Å; G459-S463 PolarHBondContact O-N 3.3Å; G459-G493 WeakPolarHBondContact CA-O 3.26Å; G459-L496 VanDerWaalsContact O-CB 3.31Å; G459-L496 WeakPolarHBondContact O-CB 3.39Å
460	L	95.7	Very high	90.9	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-66.9	-39.6	173.3	-73.4	164.5	0	0	0	111.4	A417 V421 Y456 A457 S463 L496 H790	A417-L460 WeakPolarHBondContact O-CD1 3.44Å; V421-L460 HydrophobicContact CG2-CD1 4.01Å; Y456-L460 HydrophobicContact CD1-CD1 4.39Å; Y456-L460 HydrophobicContact CD2-CD1 4.38Å; Y456-L460 HydrophobicContact CD2-CG 4.35Å; Y456-L460 HydrophobicContact CE1-CD1 4.12Å; Y456-L460 HydrophobicContact CE2-CD1 4.14Å; Y456-L460 HydrophobicContact CE2-CD2 4.33Å; Y456-L460 HydrophobicContact CE2-CG 4.06Å; Y456-L460 HydrophobicContact CG-CD1 4.49Å; Y456-L460 PolarHBondContact O-N 3.26Å; A457-L460 WeakPolarHBondContact O-CB 3.25Å; A457-L460 PolarHBondContact O-N 2.95Å; L460-S463 WeakPolarHBondContact O-CB 3.38Å; L460-S463 PolarHBondContact O-N 3.23Å; L460-S463 PolarHBondContact O-OG 3.29Å; L460-L496 HydrophobicContact CB-CD1 4.38Å; L460-L496 HydrophobicContact CD2-CD1 3.5Å; L460-L496 VanDerWaalsContact CD2-CD1 3.5Å; L460-L496 HydrophobicContact CG-CD1 3.61Å; L460-H790 HydrophobicContact CD1-CB 3.92Å; L460-H790 HydrophobicContact CD2-CB 4.37Å
461	I	94.5	Very high	91	Very high	2 Å²	2	20 Å²	20	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-61.3	-50.8	175.6	-64	173	0	0	0	110.6	H423 G425 A430 L434 A457 L458 S463	H423-I461 HydrophobicContact CB-CD1 4.04Å; H423-I461 HydrophobicContact CB-CG1 4.22Å; H423-I461 WeakPolarHBondContact O-CG2 3.37Å; G425-I461 PolarHBondContact N-O 3.05Å; A430-I461 HydrophobicContact CB-CD1 4.01Å; A430-I461 HydrophobicContact CB-CG2 3.84Å; L434-I461 HydrophobicContact CD1-CD1 3.75Å; L434-I461 HydrophobicContact CG-CD1 4.28Å; A457-I461 WeakPolarHBondContact O-CG1 3.48Å; A457-I461 PolarHBondContact O-N 3.29Å; L458-I461 PolarHBondContact O-N 3.26Å; I461-S463 PolarHBondContact O-N 3.49Å
462	F	90.9	Very high	91.1	Very high	10 Å²	10	22.3 Å²	22.3	4%	0.044	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	22.5	-179.6	-71.8	-85.4	0	0	0	113.5	E427 A430 L458 G459 N464 R465 G466 V470	E427-F462 HydrophobicContact CB-CD1 4.26Å; E427-F462 HydrophobicContact CB-CE1 3.52Å; E427-F462 HydrophobicContact CB-CZ 3.84Å; E427-F462 HydrophobicContact CG-CD1 3.75Å; E427-F462 HydrophobicContact CG-CE1 3.55Å; E427-F462 HydrophobicContact CG-CZ 4.15Å; E427-F462 WeakPolarHBondContact O-CZ 3.36Å; A430-F462 HydrophobicContact CB-CD2 4.47Å; A430-F462 HydrophobicContact CB-CE2 3.47Å; A430-F462 VanDerWaalsContact CB-CE2 3.47Å; A430-F462 HydrophobicContact CB-CZ 3.97Å; L458-F462 HydrophobicContact CD1-CD2 3.79Å; L458-F462 HydrophobicContact CD1-CE2 3.64Å; L458-F462 HydrophobicContact CG-CD2 4.29Å; L458-F462 WeakPolarHBondContact O-CD2 3.3Å; L458-F462 PolarHBondContact O-N 3.14Å; L458-F462 VanDerWaalsContact O-N 3.08Å; G459-F462 CarbonylContact O-C 3.34Å; F462-N464 PolarHBondContact O-N 3.11Å; F462-R465 CarbonylContact O-C 3.59Å; F462-R465 PolarHBondContact O-N 2.84Å; F462-G466 PolarHBondContact O-N 2.94Å; F462-V470 HydrophobicContact CB-CG1 4.47Å; F462-V470 HydrophobicContact CD1-CG2 4.35Å; F462-V470 HydrophobicContact CD2-CB 4.5Å; F462-V470 HydrophobicContact CD2-CG1 3.93Å; F462-V470 HydrophobicContact CD2-CG2 4.02Å; F462-V470 HydrophobicContact CE1-CG2 4.01Å; F462-V470 HydrophobicContact CE2-CG1 4.38Å; F462-V470 HydrophobicContact CE2-CG2 3.67Å; F462-V470 HydrophobicContact CG-CG1 4.15Å; F462-V470 HydrophobicContact CG-CG2 4.35Å; F462-V470 HydrophobicContact CZ-CG2 3.67Å
463	S	88.3	Confident	91.1	Very high	11 Å²	11	24.8 Å²	24.8	8%	0.077	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	132.1	-176.8	65.8	0	0	0	0	110.7	K424 G459 L460 I461 R465	K424-S463 WeakPolarHBondContact CE-OG 2.84Å; G459-S463 VanDerWaalsContact O-CA 3.31Å; G459-S463 WeakPolarHBondContact O-CA 3.38Å; G459-S463 PolarHBondContact O-N 3.3Å; L460-S463 WeakPolarHBondContact O-CB 3.38Å; L460-S463 PolarHBondContact O-N 3.23Å; L460-S463 PolarHBondContact O-OG 3.29Å; I461-S463 PolarHBondContact O-N 3.49Å; S463-R465 PolarHBondContact O-N 2.95Å
464	N	81.4	Confident	91.1	Very high	37 Å²	37	24.8 Å²	24.8	20%	0.198	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	-10.7	-176	-151.5	45	0	0	0	114.7	Q263 F462 L496	Q263-N464 HydrophobicContact CG-CB 4.44Å; Q263-N464 WeakPolarHBondContact CG-ND2 3.28Å; Q263-N464 VanDerWaalsContact CG-O 3.32Å; Q263-N464 WeakPolarHBondContact CG-O 3.47Å; Q263-N464 WeakPolarHBondContact CG-OD1 3.41Å; Q263-N464 PolarHBondContact NE2-ND2 2.9Å; Q263-N464 PolarHBondContact NE2-O 3.33Å; Q263-N464 PolarHBondContact OE1-O 3.48Å; F462-N464 PolarHBondContact O-N 3.11Å; N464-L496 PolarHBondContact N-O 3.15Å
465	R	83.4	Confident	91.1	Very high	34 Å²	34	27.7 Å²	27.7	13%	0.128	16%	0.156	C	C	.	.			trans	-135.1	37.2	-169.3	-60.9	173.6	64	117.5	12.8	114.1	R341 G342 D343 T346 E427 F462 S463 S467	R341-R465 PolarHBondContact O-NH1 2.79Å; R341-R465 PolarHBondContact O-NH2 2.84Å; G342-R465 VanDerWaalsContact C-CZ 3.5Å; G342-R465 PolarHBondContact O-NH1 3.34Å; D343-R465 IonicContact OD1-CZ 2.98Å; D343-R465 IonicContact OD1-NH2 3.94Å; D343-R465 PolarHBondContact OD1-NH2 3.17Å; T346-R465 PolarHBondContact OG1-NH1 3.08Å; E427-R465 WeakPolarHBondContact OE1-CD 3.23Å; E427-R465 IonicContact OE1-NE 2.82Å; E427-R465 PolarHBondContact OE1-NE 3.21Å; E427-R465 VanDerWaalsContact OE1-NE 3.14Å; F462-R465 CarbonylContact O-C 3.59Å; F462-R465 PolarHBondContact O-N 2.84Å; S463-R465 PolarHBondContact O-N 2.95Å; R465-S467 PolarHBondContact O-N 2.98Å
466	G	81.3	Confident	91	Very high	11 Å²	11	33.9 Å²	33.9	11%	0.113	18%	0.183	C	C	.	.			trans	-55.9	118.3	179.1	0	0	0	0	0	112.4	F462 I471 A497	F462-G466 PolarHBondContact O-N 2.94Å; G466-I471 VanDerWaalsContact O-CD1 3.26Å; G466-I471 WeakPolarHBondContact O-CD1 3.38Å; G466-A497 VanDerWaalsContact CA-O 3.25Å; G466-A497 WeakPolarHBondContact CA-O 3.45Å; G466-A497 PolarHBondContact N-O 3.38Å
467	S	84.2	Confident	90.6	Very high	42 Å²	42	35.7 Å²	35.7	29%	0.294	19%	0.191	S	C	.	.			trans	-66.1	155	168.4	72.2	0	0	0	0	110.2	R465 E469 V470 I471	R465-S467 PolarHBondContact O-N 2.98Å; S467-E469 PolarHBondContact O-N 3.46Å; S467-V470 PolarHBondContact O-N 2.97Å; S467-V470 WeakPolarHBondContact OG-CB 3.33Å; S467-V470 VanDerWaalsContact OG-CG2 3.26Å; S467-V470 WeakPolarHBondContact OG-CG2 3.44Å; S467-V470 PolarHBondContact OG-N 3.39Å; S467-I471 WeakPolarHBondContact O-CB 3.23Å; S467-I471 VanDerWaalsContact O-CG1 3.23Å; S467-I471 WeakPolarHBondContact O-CG1 3.27Å; S467-I471 PolarHBondContact O-N 3.38Å
468	A	86.8	Confident	90.3	Very high	72 Å²	72	35.7 Å²	35.7	60%	0.595	19%	0.191	S	C	*	.	H	α-helix	trans	-58.6	-35.3	179.6	0	0	0	0	0	112.1	S472	A468-S472 VanDerWaalsContact O-CB 3.28Å; A468-S472 WeakPolarHBondContact O-CB 3.34Å; A468-S472 PolarHBondContact O-N 3.25Å; A468-S472 PolarHBondContact O-OG 3.44Å
469	E	89	Confident	89.9	Confident	161 Å²	161	41 Å²	41	75%	0.752	22%	0.218	S	C	*	.	H	α-helix	trans	-66.3	-50.6	177.7	-64.4	174.2	-174.7	0	0	111.8	S467 I471 S472 Y473	S467-E469 PolarHBondContact O-N 3.46Å; E469-I471 PolarHBondContact O-N 3.02Å; E469-S472 PolarHBondContact O-N 3.24Å; E469-Y473 WeakPolarHBondContact O-CB 3.24Å; E469-Y473 PolarHBondContact O-N 2.9Å
470	V	90.2	Very high	89.5	Confident	9 Å²	9	44.8 Å²	44.8	6%	0.055	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-41.8	179.7	170.8	0	0	0	0	111	L458 F462 S467 S472 Y473 L474	L458-V470 HydrophobicContact CD2-CG1 4.06Å; L458-V470 HydrophobicContact CG-CG1 4.02Å; F462-V470 HydrophobicContact CB-CG1 4.47Å; F462-V470 HydrophobicContact CD1-CG2 4.35Å; F462-V470 HydrophobicContact CD2-CB 4.5Å; F462-V470 HydrophobicContact CD2-CG1 3.93Å; F462-V470 HydrophobicContact CD2-CG2 4.02Å; F462-V470 HydrophobicContact CE1-CG2 4.01Å; F462-V470 HydrophobicContact CE2-CG1 4.38Å; F462-V470 HydrophobicContact CE2-CG2 3.67Å; F462-V470 HydrophobicContact CG-CG1 4.15Å; F462-V470 HydrophobicContact CG-CG2 4.35Å; F462-V470 HydrophobicContact CZ-CG2 3.67Å; S467-V470 PolarHBondContact O-N 2.97Å; S467-V470 WeakPolarHBondContact OG-CB 3.33Å; S467-V470 VanDerWaalsContact OG-CG2 3.26Å; S467-V470 WeakPolarHBondContact OG-CG2 3.44Å; S467-V470 PolarHBondContact OG-N 3.39Å; V470-S472 VanDerWaalsContact C-N 3.32Å; V470-S472 PolarHBondContact O-N 3.47Å; V470-Y473 PolarHBondContact O-N 2.89Å; V470-L474 HydrophobicContact CG1-CD1 3.76Å; V470-L474 HydrophobicContact CG1-CG 4.27Å; V470-L474 WeakPolarHBondContact O-CB 3.44Å; V470-L474 VanDerWaalsContact O-CG 3.3Å; V470-L474 WeakPolarHBondContact O-CG 3.42Å; V470-L474 PolarHBondContact O-N 2.95Å
471	I	93	Very high	88.9	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-45.4	175.4	-67.4	167.9	0	0	0	110.4	G466 S467 E469 K475 L494 T498 V506	G466-I471 VanDerWaalsContact O-CD1 3.26Å; G466-I471 WeakPolarHBondContact O-CD1 3.38Å; S467-I471 WeakPolarHBondContact O-CB 3.23Å; S467-I471 VanDerWaalsContact O-CG1 3.23Å; S467-I471 WeakPolarHBondContact O-CG1 3.27Å; S467-I471 PolarHBondContact O-N 3.38Å; E469-I471 PolarHBondContact O-N 3.02Å; I471-K475 VanDerWaalsContact O-CB 3.25Å; I471-K475 WeakPolarHBondContact O-CB 3.45Å; I471-K475 PolarHBondContact O-N 2.88Å; I471-L494 HydrophobicContact CG2-CD1 4Å; I471-T498 HydrophobicContact CB-CG2 4.49Å; I471-T498 HydrophobicContact CD1-CG2 3.69Å; I471-T498 HydrophobicContact CG1-CG2 3.69Å; I471-T498 HydrophobicContact CG2-CG2 4.02Å; I471-V506 HydrophobicContact CG2-CG2 4.22Å
472	S	94.2	Very high	88.3	Confident	73 Å²	73	50.8 Å²	50.8	51%	0.51	29%	0.291	S	S	.	.	H	α-helix	trans	-65.6	-41	179.2	-60.3	0	0	0	0	111.7	A468 E469 V470 K475 K476	A468-S472 VanDerWaalsContact O-CB 3.28Å; A468-S472 WeakPolarHBondContact O-CB 3.34Å; A468-S472 PolarHBondContact O-N 3.25Å; A468-S472 PolarHBondContact O-OG 3.44Å; E469-S472 PolarHBondContact O-N 3.24Å; V470-S472 VanDerWaalsContact C-N 3.32Å; V470-S472 PolarHBondContact O-N 3.47Å; S472-K475 PolarHBondContact O-N 3.02Å; S472-K476 WeakPolarHBondContact O-CB 3.27Å; S472-K476 PolarHBondContact O-N 3.44Å
473	Y	94	Very high	88.2	Confident	52 Å²	52	52.7 Å²	52.7	20%	0.204	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-52.4	175.3	176.2	-96.4	0	0	0	111.6	M431 L438 L455 L458 E469 V470 K475 K476 Q477	M431-Y473 HydrophobicContact CE-CE1 4.44Å; M431-Y473 HydrophobicContact CE-CE2 4.36Å; L438-Y473 HydrophobicContact CD2-CE1 4.17Å; L455-Y473 HydrophobicContact CD2-CE1 4Å; L458-Y473 HydrophobicContact CD2-CD1 3.88Å; L458-Y473 HydrophobicContact CD2-CE1 4.04Å; E469-Y473 WeakPolarHBondContact O-CB 3.24Å; E469-Y473 PolarHBondContact O-N 2.9Å; V470-Y473 PolarHBondContact O-N 2.89Å; Y473-K475 VanDerWaalsContact C-N 3.31Å; Y473-K475 PolarHBondContact O-N 3.22Å; Y473-K476 PolarHBondContact O-N 2.93Å; Y473-K476 VanDerWaalsContact O-N 3.15Å; Y473-Q477 HydrophobicContact CD1-CG 4.23Å; Y473-Q477 HydrophobicContact CD2-CG 4.3Å; Y473-Q477 HydrophobicContact CE1-CG 3.8Å; Y473-Q477 HydrophobicContact CE2-CG 3.89Å; Y473-Q477 HydrophobicContact CG-CG 4.45Å; Y473-Q477 WeakPolarHBondContact O-CG 3.37Å; Y473-Q477 PolarHBondContact O-N 3.13Å
474	L	93.7	Very high	88.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.1	-43.6	178.1	-73.5	168.8	0	0	0	111.5	L455 L458 V470 Q477 M478 L494 A497	L455-L474 HydrophobicContact CB-CD2 4.23Å; L455-L474 HydrophobicContact CD2-CD2 3.96Å; L458-L474 HydrophobicContact CD2-CD2 4.02Å; L458-L474 HydrophobicContact CD2-CG 4.23Å; V470-L474 HydrophobicContact CG1-CD1 3.76Å; V470-L474 HydrophobicContact CG1-CG 4.27Å; V470-L474 WeakPolarHBondContact O-CB 3.44Å; V470-L474 VanDerWaalsContact O-CG 3.3Å; V470-L474 WeakPolarHBondContact O-CG 3.42Å; V470-L474 PolarHBondContact O-N 2.95Å; L474-Q477 PolarHBondContact O-N 3.46Å; L474-M478 VanDerWaalsContact O-CB 3.25Å; L474-M478 WeakPolarHBondContact O-CB 3.32Å; L474-M478 PolarHBondContact O-N 3.33Å; L474-L494 HydrophobicContact CB-CB 4.31Å; L474-L494 HydrophobicContact CB-CD1 4.22Å; L474-A497 HydrophobicContact CD1-CB 4.03Å
475	K	93.9	Very high	88.9	Confident	62 Å²	62	52.7 Å²	52.7	27%	0.27	30%	0.303	S	S	.	.	H	α-helix	trans	-60.6	-46.9	175.6	-173.1	175.4	-178.9	171.1	0	111.7	I471 S472 Y473 M479 D505	I471-K475 VanDerWaalsContact O-CB 3.25Å; I471-K475 WeakPolarHBondContact O-CB 3.45Å; I471-K475 PolarHBondContact O-N 2.88Å; S472-K475 PolarHBondContact O-N 3.02Å; Y473-K475 VanDerWaalsContact C-N 3.31Å; Y473-K475 PolarHBondContact O-N 3.22Å; K475-M479 WeakPolarHBondContact O-CB 3.42Å; K475-M479 VanDerWaalsContact O-CG 3.28Å; K475-M479 WeakPolarHBondContact O-CG 3.49Å; K475-M479 PolarHBondContact O-N 2.7Å; K475-M479 VanDerWaalsContact O-N 3.08Å; K475-D505 PolarHBondContact NZ-O 3.42Å; K475-D505 VanDerWaalsContact NZ-O 3.1Å; K475-D505 IonicContact NZ-OD2 3.01Å; K475-D505 PolarHBondContact NZ-OD2 2.98Å
476	K	92.7	Very high	89.3	Confident	130 Å²	130	51.6 Å²	51.6	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-60.7	-49.3	177.6	-175.9	-177.1	175	-171.3	0	111.2	S472 Y473 M478 M479 A480	S472-K476 WeakPolarHBondContact O-CB 3.27Å; S472-K476 PolarHBondContact O-N 3.44Å; Y473-K476 PolarHBondContact O-N 2.93Å; Y473-K476 VanDerWaalsContact O-N 3.15Å; K476-M478 PolarHBondContact O-N 3.35Å; K476-M479 PolarHBondContact O-N 2.92Å; K476-A480 VanDerWaalsContact O-CB 3.25Å; K476-A480 WeakPolarHBondContact O-CB 3.2Å; K476-A480 PolarHBondContact O-N 2.88Å
477	Q	90	Very high	89.9	Confident	37 Å²	37	53 Å²	53	17%	0.173	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-41	-178.3	-66.5	-58	-21.9	0	0	112.5	P439 L455 Y473 L474 S481	P439-Q477 HydrophobicContact CG-CB 4.4Å; P439-Q477 HydrophobicContact CG-CG 4Å; L455-Q477 HydrophobicContact CD1-CB 4.29Å; L455-Q477 HydrophobicContact CD2-CB 4.13Å; L455-Q477 HydrophobicContact CD2-CG 4.28Å; Y473-Q477 HydrophobicContact CD1-CG 4.23Å; Y473-Q477 HydrophobicContact CD2-CG 4.3Å; Y473-Q477 HydrophobicContact CE1-CG 3.8Å; Y473-Q477 HydrophobicContact CE2-CG 3.89Å; Y473-Q477 HydrophobicContact CG-CG 4.45Å; Y473-Q477 WeakPolarHBondContact O-CG 3.37Å; Y473-Q477 PolarHBondContact O-N 3.13Å; L474-Q477 PolarHBondContact O-N 3.46Å; Q477-S481 WeakPolarHBondContact O-CB 3.38Å; Q477-S481 PolarHBondContact O-N 2.95Å
478	M	89.5	Confident	90.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-42.3	176.4	-176.5	-174.7	73.5	0	0	112	L474 K476 C491 L494 C509 L510 V513	L474-M478 VanDerWaalsContact O-CB 3.25Å; L474-M478 WeakPolarHBondContact O-CB 3.32Å; L474-M478 PolarHBondContact O-N 3.33Å; K476-M478 PolarHBondContact O-N 3.35Å; M478-C491 HydrophobicContact SD-CB 4.41Å; M478-C491 PolarHBondContact SD-SG 3.39Å; M478-L494 HydrophobicContact CE-CD2 3.87Å; M478-L494 HydrophobicContact SD-CD2 4.11Å; M478-C509 HydrophobicContact CE-CB 4.31Å; M478-C509 WeakPolarHBondContact CE-SG 3.19Å; M478-L510 HydrophobicContact CE-CD2 4.23Å; M478-L510 HydrophobicContact SD-CD2 3.84Å; M478-V513 HydrophobicContact CE-CG2 4.03Å; M478-V513 HydrophobicContact CG-CG2 4.28Å; M478-V513 HydrophobicContact SD-CG2 4.11Å
479	M	87.6	Confident	90.8	Very high	112 Å²	112	47.7 Å²	47.7	55%	0.552	26%	0.259	S	S	*	.	H	α-helix	trans	-77.9	-34.6	-178.2	-68.4	-60.9	-68	0	0	113.3	K475 K476 C509	K475-M479 WeakPolarHBondContact O-CB 3.42Å; K475-M479 VanDerWaalsContact O-CG 3.28Å; K475-M479 WeakPolarHBondContact O-CG 3.49Å; K475-M479 PolarHBondContact O-N 2.7Å; K475-M479 VanDerWaalsContact O-N 3.08Å; K476-M479 PolarHBondContact O-N 2.92Å; M479-C509 VanDerWaalsContact CG-SG 3.59Å; M479-C509 PolarHBondContact SD-SG 3.37Å
480	A	85.8	Confident	91.1	Very high	79 Å²	79	40 Å²	40	65%	0.653	22%	0.223	S	C	*	.	H	α-helix	trans	-72.8	-29.2	-179.7	0	0	0	0	0	112.7	K476	K476-A480 VanDerWaalsContact O-CB 3.25Å; K476-A480 WeakPolarHBondContact O-CB 3.2Å; K476-A480 PolarHBondContact O-N 2.88Å
481	S	82.8	Confident	91.4	Very high	24 Å²	24	39.6 Å²	39.6	17%	0.168	22%	0.221	C	C	.	.			trans	-77.6	134.7	-174.8	-162.3	0	0	0	0	112.9	Q477 N483 M486 R487	Q477-S481 WeakPolarHBondContact O-CB 3.38Å; Q477-S481 PolarHBondContact O-N 2.95Å; S481-N483 PolarHBondContact OG-N 2.99Å; S481-M486 WeakPolarHBondContact OG-CB 3.46Å; S481-M486 WeakPolarHBondContact OG-CG 3.2Å; S481-R487 PolarHBondContact O-NE 3.22Å; S481-R487 PolarHBondContact O-NH2 3.47Å
482	S	82.4	Confident	91.6	Very high	105 Å²	105	39.4 Å²	39.4	73%	0.734	22%	0.22	S	C	*	.			trans	-83.3	-20.3	169.5	58.8	0	0	0	0	113.3	R487	S482-R487 PolarHBondContact O-NH1 3.43Å; S482-R487 VanDerWaalsContact O-NH1 3.14Å
483	N	89	Confident	91.7	Very high	50 Å²	50	35.9 Å²	35.9	27%	0.267	20%	0.196	S	C	.	.			trans	-78.3	127.5	-174.5	-176.5	-11	0	0	0	111.1	S447 S481 V485 M486 R487	S447-N483 PolarHBondContact O-ND2 3.47Å; S481-N483 PolarHBondContact OG-N 2.99Å; N483-V485 VanDerWaalsContact C-N 3.29Å; N483-V485 PolarHBondContact O-N 2.8Å; N483-V485 PolarHBondContact OD1-N 2.92Å; N483-M486 HydrophobicContact CB-CB 4.05Å; N483-M486 HydrophobicContact CB-CG 3.87Å; N483-M486 WeakPolarHBondContact O-CB 3.21Å; N483-M486 PolarHBondContact O-N 2.83Å; N483-R487 PolarHBondContact O-N 3.31Å
484	T	91.4	Very high	91.8	Very high	41 Å²	41	33.4 Å²	33.4	25%	0.252	19%	0.186	S	C	.	.	H	α-helix	trans	-62.4	-35.2	-179.5	56.3	0	0	0	0	112.5	R487 H488 D518	T484-R487 PolarHBondContact O-N 2.75Å; T484-H488 VanDerWaalsContact O-CB 3.3Å; T484-H488 WeakPolarHBondContact O-CB 3.31Å; T484-H488 PolarHBondContact O-N 3.31Å; T484-D518 WeakPolarHBondContact CB-OD2 3.39Å; T484-D518 HydrophobicContact CG2-CB 4.29Å; T484-D518 VanDerWaalsContact CG2-CG 3.45Å; T484-D518 WeakPolarHBondContact CG2-OD2 3.3Å
485	V	92.5	Very high	91.9	Very high	8 Å²	8	33.4 Å²	33.4	5%	0.048	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-42.2	177.4	-177.7	0	0	0	0	110.9	W410 Y449 A452 N483 H488 G489	W410-V485 HydrophobicContact CH2-CG1 4.16Å; W410-V485 HydrophobicContact CH2-CG2 4.49Å; W410-V485 HydrophobicContact CZ2-CG2 4.44Å; W410-V485 HydrophobicContact CZ3-CG1 4.28Å; Y449-V485 HydrophobicContact CD1-CG1 3.46Å; Y449-V485 VanDerWaalsContact CD1-CG1 3.46Å; Y449-V485 HydrophobicContact CD1-CG2 4.4Å; Y449-V485 HydrophobicContact CE1-CB 4.35Å; Y449-V485 HydrophobicContact CE1-CG1 3.61Å; Y449-V485 HydrophobicContact CE1-CG2 3.75Å; Y449-V485 HydrophobicContact CE2-CG2 4.4Å; Y449-V485 HydrophobicContact CG-CG1 4.01Å; A452-V485 HydrophobicContact CB-CG1 3.76Å; A452-V485 WeakPolarHBondContact CB-O 3.41Å; N483-V485 VanDerWaalsContact C-N 3.29Å; N483-V485 PolarHBondContact O-N 2.8Å; N483-V485 PolarHBondContact OD1-N 2.92Å; V485-H488 WeakPolarHBondContact O-CB 3.37Å; V485-H488 PolarHBondContact O-N 3.3Å; V485-G489 PolarHBondContact O-N 3.18Å
486	M	91.8	Very high	91.9	Very high	11 Å²	11	30.5 Å²	30.5	5%	0.054	17%	0.173	C	C	.	.	H	α-helix	trans	-62.3	-45.5	175.3	-73.1	-62.9	-64	0	0	111.7	P439 E451 A452 L455 S481 N483 H488 G489 G490	P439-M486 HydrophobicContact CB-CE 3.69Å; P439-M486 HydrophobicContact CG-CE 3.71Å; E451-M486 HydrophobicContact CB-CE 3.76Å; E451-M486 HydrophobicContact CB-SD 3.44Å; E451-M486 WeakPolarHBondContact CB-SD 3.48Å; A452-M486 HydrophobicContact CB-SD 4.03Å; A452-M486 PolarHBondContact N-SD 3.35Å; A452-M486 VanDerWaalsContact N-SD 3.38Å; L455-M486 HydrophobicContact CD1-CE 3.76Å; S481-M486 WeakPolarHBondContact OG-CB 3.46Å; S481-M486 WeakPolarHBondContact OG-CG 3.2Å; N483-M486 HydrophobicContact CB-CB 4.05Å; N483-M486 HydrophobicContact CB-CG 3.87Å; N483-M486 WeakPolarHBondContact O-CB 3.21Å; N483-M486 PolarHBondContact O-N 2.83Å; M486-H488 VanDerWaalsContact C-N 3.27Å; M486-H488 PolarHBondContact O-N 3.49Å; M486-G489 PolarHBondContact O-N 3.34Å; M486-G490 PolarHBondContact O-N 2.79Å
487	R	93.6	Very high	91.9	Very high	39 Å²	39	24.3 Å²	24.3	15%	0.147	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-39.5	173.8	-69	-172	-168.2	120.8	-4	111.8	S481 S482 N483 T484 G490 C491 V513	S481-R487 PolarHBondContact O-NE 3.22Å; S481-R487 PolarHBondContact O-NH2 3.47Å; S482-R487 PolarHBondContact O-NH1 3.43Å; S482-R487 VanDerWaalsContact O-NH1 3.14Å; N483-R487 PolarHBondContact O-N 3.31Å; T484-R487 PolarHBondContact O-N 2.75Å; R487-G490 PolarHBondContact O-N 2.93Å; R487-C491 WeakPolarHBondContact O-CB 3.45Å; R487-C491 PolarHBondContact O-N 3.21Å; R487-C491 PolarHBondContact O-SG 3.37Å; R487-V513 HydrophobicContact CB-CG1 4.39Å
488	H	95	Very high	92	Very high	3 Å²	3	22.5 Å²	22.5	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-51.9	177.8	-176.2	96.2	0	0	0	111.9	W410 T484 V485 M486 G490 C491 L492 V520 A524 W785	W410-H488 AromaticContact CH2-CD2 3.87Å; W410-H488 AromaticContact CZ3-CD2 3.87Å; T484-H488 VanDerWaalsContact O-CB 3.3Å; T484-H488 WeakPolarHBondContact O-CB 3.31Å; T484-H488 PolarHBondContact O-N 3.31Å; V485-H488 WeakPolarHBondContact O-CB 3.37Å; V485-H488 PolarHBondContact O-N 3.3Å; M486-H488 VanDerWaalsContact C-N 3.27Å; M486-H488 PolarHBondContact O-N 3.49Å; H488-G490 VanDerWaalsContact C-N 3.35Å; H488-G490 PolarHBondContact O-N 3.27Å; H488-C491 PolarHBondContact O-N 3.4Å; H488-L492 WeakPolarHBondContact O-CG 3.3Å; H488-L492 PolarHBondContact O-N 3.16Å; H488-L492 VanDerWaalsContact O-N 3.11Å; H488-V520 HydrophobicContact CB-CG1 4.01Å; H488-V520 PolarHBondContact ND1-O 3.32Å; H488-A524 HydrophobicContact CB-CB 4.36Å; H488-A524 VanDerWaalsContact ND1-CB 3.33Å; H488-A524 WeakPolarHBondContact ND1-CB 3.32Å; H488-A524 WeakPolarHBondContact O-CB 3.23Å; H488-W785 AromaticContact CD2-CH2 3.71Å; H488-W785 AromaticContact NE2-CE3 3.99Å; H488-W785 AromaticContact NE2-CH2 2.92Å; H488-W785 WeakPolarHBondContact NE2-CH2 3.47Å; H488-W785 AromaticContact NE2-CZ2 3.32Å; H488-W785 VanDerWaalsContact NE2-CZ2 3.32Å; H488-W785 WeakPolarHBondContact NE2-CZ2 3.34Å; H488-W785 AromaticContact NE2-CZ3 3.28Å; H488-W785 VanDerWaalsContact NE2-CZ3 3.28Å; H488-W785 WeakPolarHBondContact NE2-CZ3 3.28Å
489	G	94.9	Very high	92.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-41.7	175.1	0	0	0	0	0	112.9	A452 V485 M486 L492 G493	A452-G489 WeakPolarHBondContact O-CA 3.31Å; V485-G489 PolarHBondContact O-N 3.18Å; M486-G489 PolarHBondContact O-N 3.34Å; G489-L492 PolarHBondContact O-N 3.17Å; G489-G493 PolarHBondContact O-N 3.45Å
490	G	95.2	Very high	92.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.2	-41.3	174.9	0	0	0	0	0	113.6	M486 R487 H488 G493 L494	M486-G490 PolarHBondContact O-N 2.79Å; R487-G490 PolarHBondContact O-N 2.93Å; H488-G490 VanDerWaalsContact C-N 3.35Å; H488-G490 PolarHBondContact O-N 3.27Å; G490-G493 PolarHBondContact O-N 3.47Å; G490-L494 WeakPolarHBondContact O-CB 3.46Å; G490-L494 PolarHBondContact O-N 3.21Å
491	C	97.2	Very high	92.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.9	-48	176.1	-73.5	0	0	0	0	111.2	M478 R487 H488 L494 G495 L510 A524 A528	M478-C491 HydrophobicContact SD-CB 4.41Å; M478-C491 PolarHBondContact SD-SG 3.39Å; R487-C491 WeakPolarHBondContact O-CB 3.45Å; R487-C491 PolarHBondContact O-N 3.21Å; R487-C491 PolarHBondContact O-SG 3.37Å; H488-C491 PolarHBondContact O-N 3.4Å; C491-L494 PolarHBondContact O-N 3.03Å; C491-G495 PolarHBondContact O-N 3.33Å; C491-L510 HydrophobicContact CB-CD2 4.08Å; C491-A524 HydrophobicContact CB-CB 3.71Å; C491-A528 HydrophobicContact CB-CB 4.36Å; C491-A528 WeakPolarHBondContact O-CB 3.36Å
492	L	96.9	Very high	92.7	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-63.7	-44.6	178.3	-64.6	175.6	0	0	0	111.5	F413 Y456 H488 G489 G495 L496 A524 L527 W785	F413-L492 HydrophobicContact CZ-CD1 4.32Å; Y456-L492 HydrophobicContact CD1-CD1 4.45Å; Y456-L492 HydrophobicContact CD2-CB 3.47Å; Y456-L492 VanDerWaalsContact CD2-CB 3.47Å; Y456-L492 HydrophobicContact CD2-CD1 4.17Å; Y456-L492 HydrophobicContact CD2-CG 4.46Å; Y456-L492 HydrophobicContact CE2-CB 3.8Å; Y456-L492 HydrophobicContact CE2-CD1 4.23Å; Y456-L492 HydrophobicContact CG-CB 4.18Å; Y456-L492 HydrophobicContact CG-CD1 4.3Å; H488-L492 WeakPolarHBondContact O-CG 3.3Å; H488-L492 PolarHBondContact O-N 3.16Å; H488-L492 VanDerWaalsContact O-N 3.11Å; G489-L492 PolarHBondContact O-N 3.17Å; L492-G495 PolarHBondContact O-N 3.49Å; L492-L496 WeakPolarHBondContact O-CB 3.33Å; L492-L496 WeakPolarHBondContact O-CG 3.46Å; L492-L496 PolarHBondContact O-N 3.1Å; L492-A524 HydrophobicContact CD2-CB 3.87Å; L492-A524 HydrophobicContact CG-CB 3.82Å; L492-L527 HydrophobicContact CD2-CD2 3.89Å; L492-W785 HydrophobicContact CD1-CH2 3.52Å; L492-W785 HydrophobicContact CD1-CZ3 3.54Å
493	G	95.7	Very high	93.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.6	-47.9	177.9	0	0	0	0	0	112	L455 G459 G489 G490 L496 A497	L455-G493 WeakPolarHBondContact O-CA 3.35Å; G459-G493 WeakPolarHBondContact CA-O 3.26Å; G489-G493 PolarHBondContact O-N 3.45Å; G490-G493 PolarHBondContact O-N 3.47Å; G493-L496 PolarHBondContact O-N 3.1Å; G493-A497 WeakPolarHBondContact O-CB 3.49Å; G493-A497 PolarHBondContact O-N 3.34Å
494	L	96.3	Very high	93.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.3	-44.9	177.8	-177	58	0	0	0	111.6	I471 L474 M478 G490 C491 L496 A497 T498 V506 L510	I471-L494 HydrophobicContact CG2-CD1 4Å; L474-L494 HydrophobicContact CB-CB 4.31Å; L474-L494 HydrophobicContact CB-CD1 4.22Å; M478-L494 HydrophobicContact CE-CD2 3.87Å; M478-L494 HydrophobicContact SD-CD2 4.11Å; G490-L494 WeakPolarHBondContact O-CB 3.46Å; G490-L494 PolarHBondContact O-N 3.21Å; C491-L494 PolarHBondContact O-N 3.03Å; L494-L496 PolarHBondContact O-N 2.71Å; L494-A497 PolarHBondContact O-N 2.91Å; L494-T498 HydrophobicContact CD1-CG2 3.99Å; L494-T498 WeakPolarHBondContact O-CB 3.4Å; L494-T498 WeakPolarHBondContact O-CG2 3.25Å; L494-T498 PolarHBondContact O-N 3.44Å; L494-T498 PolarHBondContact O-OG1 3.1Å; L494-V506 HydrophobicContact CD1-CG1 4.01Å; L494-V506 HydrophobicContact CD2-CG1 3.9Å; L494-V506 HydrophobicContact CG-CG1 3.76Å; L494-L510 HydrophobicContact CD2-CD2 4.1Å; L494-L510 HydrophobicContact CD2-CG 4.33Å
495	G	95.3	Very high	93.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-40.4	178.2	0	0	0	0	0	113.1	C491 L492 T498 L499 L531	C491-G495 PolarHBondContact O-N 3.33Å; L492-G495 PolarHBondContact O-N 3.49Å; G495-T498 CarbonylContact O-C 3.47Å; G495-L499 PolarHBondContact O-N 3.31Å; G495-L499 VanDerWaalsContact O-N 3.09Å; G495-L531 WeakPolarHBondContact O-CB 3.46Å
496	L	94.9	Very high	93.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-67.7	-44.3	175	-77.7	174.7	0	0	0	112.9	Y456 G459 L460 N464 L492 G493 L494 T498 F791 L794	Y456-L496 HydrophobicContact CD2-CD1 3.9Å; Y456-L496 HydrophobicContact CE2-CD1 3.43Å; Y456-L496 VanDerWaalsContact CE2-CD1 3.43Å; G459-L496 VanDerWaalsContact O-CB 3.31Å; G459-L496 WeakPolarHBondContact O-CB 3.39Å; L460-L496 HydrophobicContact CB-CD1 4.38Å; L460-L496 HydrophobicContact CD2-CD1 3.5Å; L460-L496 VanDerWaalsContact CD2-CD1 3.5Å; L460-L496 HydrophobicContact CG-CD1 3.61Å; N464-L496 PolarHBondContact N-O 3.15Å; L492-L496 WeakPolarHBondContact O-CB 3.33Å; L492-L496 WeakPolarHBondContact O-CG 3.46Å; L492-L496 PolarHBondContact O-N 3.1Å; G493-L496 PolarHBondContact O-N 3.1Å; L494-L496 PolarHBondContact O-N 2.71Å; L496-T498 PolarHBondContact O-N 3.41Å; L496-F791 HydrophobicContact CD1-CZ 4.35Å; L496-F791 HydrophobicContact CD2-CD1 4.09Å; L496-F791 HydrophobicContact CD2-CE1 3.45Å; L496-F791 VanDerWaalsContact CD2-CE1 3.45Å; L496-F791 HydrophobicContact CD2-CZ 3.76Å; L496-F791 HydrophobicContact CG-CE1 4.2Å; L496-F791 HydrophobicContact CG-CZ 4Å; L496-L794 HydrophobicContact CD2-CD1 3.73Å; L496-L794 HydrophobicContact CD2-CD2 4.31Å; L496-L794 HydrophobicContact CD2-CG 4.47Å
497	A	92.7	Very high	93.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.9	-26.6	179	0	0	0	0	0	112.4	G466 L474 G493 L494	G466-A497 VanDerWaalsContact CA-O 3.25Å; G466-A497 WeakPolarHBondContact CA-O 3.45Å; G466-A497 PolarHBondContact N-O 3.38Å; L474-A497 HydrophobicContact CD1-CB 4.03Å; G493-A497 WeakPolarHBondContact O-CB 3.49Å; G493-A497 PolarHBondContact O-N 3.34Å; L494-A497 PolarHBondContact O-N 2.91Å
498	T	92.1	Very high	93.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	18.9	-175.7	59.9	0	0	0	0	113.7	I471 L494 G495 L496 G500 T501 V506 V532	I471-T498 HydrophobicContact CB-CG2 4.49Å; I471-T498 HydrophobicContact CD1-CG2 3.69Å; I471-T498 HydrophobicContact CG1-CG2 3.69Å; I471-T498 HydrophobicContact CG2-CG2 4.02Å; L494-T498 HydrophobicContact CD1-CG2 3.99Å; L494-T498 WeakPolarHBondContact O-CB 3.4Å; L494-T498 WeakPolarHBondContact O-CG2 3.25Å; L494-T498 PolarHBondContact O-N 3.44Å; L494-T498 PolarHBondContact O-OG1 3.1Å; G495-T498 CarbonylContact O-C 3.47Å; L496-T498 PolarHBondContact O-N 3.41Å; T498-G500 PolarHBondContact O-N 3.22Å; T498-T501 WeakPolarHBondContact O-CB 3.49Å; T498-T501 WeakPolarHBondContact O-CG2 3.41Å; T498-T501 PolarHBondContact O-N 3.19Å; T498-T501 VanDerWaalsContact O-N 3.16Å; T498-T501 PolarHBondContact O-OG1 3.16Å; T498-V506 HydrophobicContact CG2-CG1 4.24Å; T498-V506 HydrophobicContact CG2-CG2 4.16Å; T498-V532 VanDerWaalsContact OG1-CG2 3.26Å; T498-V532 WeakPolarHBondContact OG1-CG2 3.35Å
499	L	92.4	Very high	93.9	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	125	-179.5	-170.3	153.3	0	0	0	111.1	G495 T501 L531 I774 L794	G495-L499 PolarHBondContact O-N 3.31Å; G495-L499 VanDerWaalsContact O-N 3.09Å; L499-T501 PolarHBondContact O-N 3.14Å; L499-T501 VanDerWaalsContact O-N 3.15Å; L499-L531 WeakPolarHBondContact CA-O 3.18Å; L499-L531 HydrophobicContact CD1-CD2 4.2Å; L499-I774 HydrophobicContact CD1-CG2 4.36Å; L499-I774 HydrophobicContact CD2-CD1 4.28Å; L499-L794 HydrophobicContact CD1-CD1 4.3Å
500	G	88.8	Confident	94	Very high	9 Å²	9	18.8 Å²	18.8	9%	0.093	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	16.9	176.6	0	0	0	0	0	115.4	T498 L531	T498-G500 PolarHBondContact O-N 3.22Å; G500-L531 PolarHBondContact N-O 3.39Å
501	T	88.2	Confident	94	Very high	22 Å²	22	22.4 Å²	22.4	14%	0.135	10%	0.103	C	C	.	.			trans	-84.2	-14.5	-179.5	62.2	0	0	0	0	114.1	T498 L499 R503 V532	T498-T501 WeakPolarHBondContact O-CB 3.49Å; T498-T501 WeakPolarHBondContact O-CG2 3.41Å; T498-T501 PolarHBondContact O-N 3.19Å; T498-T501 VanDerWaalsContact O-N 3.16Å; T498-T501 PolarHBondContact O-OG1 3.16Å; L499-T501 PolarHBondContact O-N 3.14Å; L499-T501 VanDerWaalsContact O-N 3.15Å; T501-R503 PolarHBondContact O-N 3.34Å; T501-R503 VanDerWaalsContact O-N 3.13Å; T501-V532 PolarHBondContact N-O 3.2Å
502	H	90.3	Very high	93.9	Very high	63 Å²	63	24.6 Å²	24.6	29%	0.292	13%	0.126	S	C	.	.			trans	55.6	28.4	179.8	-51.5	167.2	0	0	0	113.6	W504 V532 M533 A534	H502-W504 PolarHBondContact O-N 3.12Å; H502-V532 PolarHBondContact CD2-O 2.97Å; H502-V532 PolarHBondContact N-O 3.4Å; H502-M533 HydrophobicContact CB-SD 4.41Å; H502-A534 PolarHBondContact NE2-O 2.8Å
503	R	90.7	Very high	93.7	Very high	83 Å²	83	24.9 Å²	24.9	31%	0.313	13%	0.128	S	C	.	.			trans	-77.5	113.5	-178.7	-80.6	-174.4	66.5	169	1.3	112.3	T501 D505 V506 Y507	T501-R503 PolarHBondContact O-N 3.34Å; T501-R503 VanDerWaalsContact O-N 3.13Å; R503-D505 WeakPolarHBondContact CB-OD1 3.4Å; R503-D505 IonicContact CZ-OD1 3.04Å; R503-D505 IonicContact CZ-OD2 2.75Å; R503-D505 IonicContact NE-OD1 3.4Å; R503-D505 PolarHBondContact NE-OD1 3.24Å; R503-D505 IonicContact NE-OD2 3.45Å; R503-D505 IonicContact NH2-OD1 3.94Å; R503-D505 PolarHBondContact NH2-OD1 2.97Å; R503-D505 IonicContact NH2-OD2 2.67Å; R503-D505 PolarHBondContact NH2-OD2 2.86Å; R503-D505 PolarHBondContact O-N 3.36Å; R503-V506 HydrophobicContact CB-CB 4.16Å; R503-V506 HydrophobicContact CB-CG2 3.95Å; R503-V506 PolarHBondContact O-N 3.46Å; R503-Y507 WeakPolarHBondContact O-CB 3.15Å; R503-Y507 PolarHBondContact O-N 3.45Å
504	W	93.5	Very high	93.6	Very high	84 Å²	84	25 Å²	25	32%	0.318	13%	0.128	S	C	.	.	H	α-helix	trans	-67.1	-33.8	177.7	-73.9	103.3	0	0	0	113.8	H502 V506 Y507 D508 M533 N538 R540	H502-W504 PolarHBondContact O-N 3.12Å; W504-V506 PolarHBondContact O-N 3Å; W504-Y507 AromaticContact CE3-CD1 3.68Å; W504-Y507 HydrophobicContact CE3-CD1 3.68Å; W504-Y507 HydrophobicContact CE3-CE1 4.27Å; W504-Y507 HydrophobicContact CE3-CG 4.11Å; W504-Y507 AromaticContact CZ3-CD1 3.6Å; W504-Y507 HydrophobicContact CZ3-CD1 3.6Å; W504-Y507 AromaticContact CZ3-CE1 3.74Å; W504-Y507 HydrophobicContact CZ3-CE1 3.74Å; W504-Y507 HydrophobicContact CZ3-CG 4.11Å; W504-Y507 PolarHBondContact O-N 3.49Å; W504-D508 WeakPolarHBondContact O-CB 3.44Å; W504-D508 PolarHBondContact O-N 2.73Å; W504-M533 HydrophobicContact CD2-CE 3.73Å; W504-M533 HydrophobicContact CE3-CE 3.73Å; W504-M533 HydrophobicContact CG-CE 4.34Å; W504-M533 HydrophobicContact CH2-CE 3.95Å; W504-M533 HydrophobicContact CZ2-CE 3.97Å; W504-M533 HydrophobicContact CZ3-CE 3.84Å; W504-N538 WeakPolarHBondContact CH2-OD1 3.46Å; W504-R540 VanDerWaalsContact CE3-NH1 3.31Å; W504-R540 HydrophobicContact CH2-CB 3.91Å; W504-R540 HydrophobicContact CH2-CG 3.96Å; W504-R540 HydrophobicContact CZ3-CG 4.11Å
505	D	94.6	Very high	93.3	Very high	63 Å²	63	30 Å²	30	34%	0.337	15%	0.15	S	C	.	.	H	α-helix	trans	-66.9	-28.2	179.4	73.5	-64.4	0	0	0	113	K475 R503 C509	K475-D505 PolarHBondContact NZ-O 3.42Å; K475-D505 VanDerWaalsContact NZ-O 3.1Å; K475-D505 IonicContact NZ-OD2 3.01Å; K475-D505 PolarHBondContact NZ-OD2 2.98Å; R503-D505 WeakPolarHBondContact CB-OD1 3.4Å; R503-D505 IonicContact CZ-OD1 3.04Å; R503-D505 IonicContact CZ-OD2 2.75Å; R503-D505 IonicContact NE-OD1 3.4Å; R503-D505 PolarHBondContact NE-OD1 3.24Å; R503-D505 IonicContact NE-OD2 3.45Å; R503-D505 IonicContact NH2-OD1 3.94Å; R503-D505 PolarHBondContact NH2-OD1 2.97Å; R503-D505 IonicContact NH2-OD2 2.67Å; R503-D505 PolarHBondContact NH2-OD2 2.86Å; R503-D505 PolarHBondContact O-N 3.36Å; D505-C509 WeakPolarHBondContact O-CB 3.25Å
506	V	94.4	Very high	93	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-80.6	-46.2	173.1	178.3	0	0	0	0	109.6	I471 L494 T498 R503 W504 D508 C509 L510 V532	I471-V506 HydrophobicContact CG2-CG2 4.22Å; L494-V506 HydrophobicContact CD1-CG1 4.01Å; L494-V506 HydrophobicContact CD2-CG1 3.9Å; L494-V506 HydrophobicContact CG-CG1 3.76Å; T498-V506 HydrophobicContact CG2-CG1 4.24Å; T498-V506 HydrophobicContact CG2-CG2 4.16Å; R503-V506 HydrophobicContact CB-CB 4.16Å; R503-V506 HydrophobicContact CB-CG2 3.95Å; R503-V506 PolarHBondContact O-N 3.46Å; W504-V506 PolarHBondContact O-N 3Å; V506-D508 PolarHBondContact O-N 2.74Å; V506-C509 WeakPolarHBondContact O-CB 3.38Å; V506-C509 PolarHBondContact O-N 3Å; V506-C509 VanDerWaalsContact O-N 3.17Å; V506-L510 HydrophobicContact CG1-CD1 4.07Å; V506-L510 WeakPolarHBondContact O-CG 3.35Å; V506-L510 PolarHBondContact O-N 3.28Å; V506-V532 HydrophobicContact CG1-CG2 3.74Å
507	Y	96.6	Very high	92.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-47.7	177	177.6	-84.8	0	0	0	112.4	R503 W504 C509 L510 R511 M529 M533 S541 E544	R503-Y507 WeakPolarHBondContact O-CB 3.15Å; R503-Y507 PolarHBondContact O-N 3.45Å; W504-Y507 AromaticContact CE3-CD1 3.68Å; W504-Y507 HydrophobicContact CE3-CD1 3.68Å; W504-Y507 HydrophobicContact CE3-CE1 4.27Å; W504-Y507 HydrophobicContact CE3-CG 4.11Å; W504-Y507 AromaticContact CZ3-CD1 3.6Å; W504-Y507 HydrophobicContact CZ3-CD1 3.6Å; W504-Y507 AromaticContact CZ3-CE1 3.74Å; W504-Y507 HydrophobicContact CZ3-CE1 3.74Å; W504-Y507 HydrophobicContact CZ3-CG 4.11Å; W504-Y507 PolarHBondContact O-N 3.49Å; Y507-C509 PolarHBondContact O-N 3.12Å; Y507-L510 PolarHBondContact O-N 3.15Å; Y507-R511 VanDerWaalsContact O-CB 3.32Å; Y507-R511 WeakPolarHBondContact O-CB 3.18Å; Y507-R511 PolarHBondContact O-N 3.16Å; Y507-M529 HydrophobicContact CD2-CB 4.15Å; Y507-M529 HydrophobicContact CD2-CE 4.21Å; Y507-M529 HydrophobicContact CD2-CG 4.24Å; Y507-M529 HydrophobicContact CE1-CE 3.99Å; Y507-M529 HydrophobicContact CE2-CB 4.02Å; Y507-M529 HydrophobicContact CE2-CE 3.46Å; Y507-M529 VanDerWaalsContact CE2-CE 3.46Å; Y507-M529 HydrophobicContact CE2-CG 4.24Å; Y507-M529 VanDerWaalsContact OH-CE 3.27Å; Y507-M529 WeakPolarHBondContact OH-CE 3.36Å; Y507-M533 HydrophobicContact CD2-CE 3.75Å; Y507-M533 HydrophobicContact CD2-CG 3.62Å; Y507-M533 HydrophobicContact CE2-CG 4.06Å; Y507-M533 HydrophobicContact CG-CE 3.7Å; Y507-S541 WeakPolarHBondContact OH-CA 3.38Å; Y507-E544 VanDerWaalsContact CE1-OE2 3.24Å; Y507-E544 WeakPolarHBondContact CE1-OE2 3.24Å; Y507-E544 PolarHBondContact OH-OE2 3.13Å
508	D	96.4	Very high	92.6	Very high	53 Å²	53	42.6 Å²	42.6	28%	0.283	21%	0.207	S	C	.	.	H	α-helix	trans	-65.1	-31.5	179.6	-76.1	-39.5	0	0	0	111.8	W504 V506 R511 G512 R540	W504-D508 WeakPolarHBondContact O-CB 3.44Å; W504-D508 PolarHBondContact O-N 2.73Å; V506-D508 PolarHBondContact O-N 2.74Å; D508-R511 IonicContact OD1-CZ 3.96Å; D508-R511 IonicContact OD1-NE 2.76Å; D508-R511 IonicContact OD1-NH2 3.67Å; D508-G512 PolarHBondContact O-N 2.71Å; D508-G512 VanDerWaalsContact O-N 3.08Å; D508-R540 IonicContact OD1-CZ 2.71Å; D508-R540 IonicContact OD1-NH1 3.89Å; D508-R540 IonicContact OD1-NH2 3.21Å; D508-R540 PolarHBondContact OD1-NH2 3.28Å
509	C	95	Very high	92.6	Very high	13 Å²	13	43.6 Å²	43.6	9%	0.088	22%	0.215	C	C	.	.	H	α-helix	trans	-67.9	-46.8	174.5	-167.3	0	0	0	0	111.7	M478 M479 D505 V506 Y507 R511 G512 V513	M478-C509 HydrophobicContact CE-CB 4.31Å; M478-C509 WeakPolarHBondContact CE-SG 3.19Å; M479-C509 VanDerWaalsContact CG-SG 3.59Å; M479-C509 PolarHBondContact SD-SG 3.37Å; D505-C509 WeakPolarHBondContact O-CB 3.25Å; V506-C509 WeakPolarHBondContact O-CB 3.38Å; V506-C509 PolarHBondContact O-N 3Å; V506-C509 VanDerWaalsContact O-N 3.17Å; Y507-C509 PolarHBondContact O-N 3.12Å; C509-R511 VanDerWaalsContact C-N 3.34Å; C509-G512 PolarHBondContact O-N 3.34Å; C509-V513 PolarHBondContact O-N 2.75Å
510	L	96.9	Very high	92.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-38.1	175.6	-67.5	167.4	0	0	0	111.8	M478 C491 L494 V506 Y507 G512 V513 L514 A528 M529 V532	M478-L510 HydrophobicContact CE-CD2 4.23Å; M478-L510 HydrophobicContact SD-CD2 3.84Å; C491-L510 HydrophobicContact CB-CD2 4.08Å; L494-L510 HydrophobicContact CD2-CD2 4.1Å; L494-L510 HydrophobicContact CD2-CG 4.33Å; V506-L510 HydrophobicContact CG1-CD1 4.07Å; V506-L510 WeakPolarHBondContact O-CG 3.35Å; V506-L510 PolarHBondContact O-N 3.28Å; Y507-L510 PolarHBondContact O-N 3.15Å; L510-G512 VanDerWaalsContact C-N 3.27Å; L510-G512 PolarHBondContact O-N 3.38Å; L510-V513 WeakPolarHBondContact O-CB 3.26Å; L510-V513 PolarHBondContact O-N 3.29Å; L510-L514 PolarHBondContact O-N 2.91Å; L510-A528 HydrophobicContact CD1-CB 3.73Å; L510-A528 HydrophobicContact CD2-CB 3.82Å; L510-A528 HydrophobicContact CG-CB 4.4Å; L510-M529 HydrophobicContact CB-CG 3.53Å; L510-M529 HydrophobicContact CB-SD 4.35Å; L510-M529 HydrophobicContact CD1-CG 4.21Å; L510-V532 HydrophobicContact CD1-CG2 3.79Å
511	R	95.7	Very high	92.9	Very high	76 Å²	76	44.2 Å²	44.2	29%	0.287	22%	0.217	S	C	.	.	H	α-helix	trans	-58.4	-40.2	173.5	-174.6	-174.6	66.7	132.6	2.9	111.6	Y507 D508 C509 V513 L514 F515 M529 E544	Y507-R511 VanDerWaalsContact O-CB 3.32Å; Y507-R511 WeakPolarHBondContact O-CB 3.18Å; Y507-R511 PolarHBondContact O-N 3.16Å; D508-R511 IonicContact OD1-CZ 3.96Å; D508-R511 IonicContact OD1-NE 2.76Å; D508-R511 IonicContact OD1-NH2 3.67Å; C509-R511 VanDerWaalsContact C-N 3.34Å; R511-V513 VanDerWaalsContact C-N 3.27Å; R511-V513 PolarHBondContact O-N 3.02Å; R511-L514 PolarHBondContact O-N 3.06Å; R511-F515 HydrophobicContact CG-CD2 4.18Å; R511-F515 HydrophobicContact CG-CE1 4.22Å; R511-F515 HydrophobicContact CG-CE2 3.86Å; R511-F515 HydrophobicContact CG-CZ 3.89Å; R511-F515 PolarHBondContact O-N 2.86Å; R511-M529 HydrophobicContact CB-CE 3.94Å; R511-M529 HydrophobicContact CB-SD 4.35Å; R511-M529 HydrophobicContact CG-CE 4.24Å; R511-E544 WeakPolarHBondContact CD-OE2 3.39Å
512	G	93.7	Very high	93.2	Very high	45 Å²	45	43.2 Å²	43.2	46%	0.464	21%	0.211	S	C	.	.	H	α-helix	trans	-58.7	-38	173.6	0	0	0	0	0	113	D508 C509 L510 Y516	D508-G512 PolarHBondContact O-N 2.71Å; D508-G512 VanDerWaalsContact O-N 3.08Å; C509-G512 PolarHBondContact O-N 3.34Å; L510-G512 VanDerWaalsContact C-N 3.27Å; L510-G512 PolarHBondContact O-N 3.38Å; G512-Y516 PolarHBondContact O-N 3.24Å
513	V	94	Very high	93.4	Very high	8 Å²	8	41.3 Å²	41.3	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-72.3	-40	175.1	-177.8	0	0	0	0	111.5	M478 R487 C509 L510 R511 Y516 A525	M478-V513 HydrophobicContact CE-CG2 4.03Å; M478-V513 HydrophobicContact CG-CG2 4.28Å; M478-V513 HydrophobicContact SD-CG2 4.11Å; R487-V513 HydrophobicContact CB-CG1 4.39Å; C509-V513 PolarHBondContact O-N 2.75Å; L510-V513 WeakPolarHBondContact O-CB 3.26Å; L510-V513 PolarHBondContact O-N 3.29Å; R511-V513 VanDerWaalsContact C-N 3.27Å; R511-V513 PolarHBondContact O-N 3.02Å; V513-Y516 VanDerWaalsContact O-CB 3.28Å; V513-Y516 WeakPolarHBondContact O-CB 3.45Å; V513-Y516 PolarHBondContact O-N 3.05Å; V513-A525 HydrophobicContact CB-CB 4.11Å; V513-A525 HydrophobicContact CG1-CB 4.07Å
514	L	93.8	Very high	93.7	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-60	-47.5	176.4	-179.4	62.5	0	0	0	111.2	L510 R511 Y516 D517 A525 A526 M529 L545 Y548 I557	L510-L514 PolarHBondContact O-N 2.91Å; R511-L514 PolarHBondContact O-N 3.06Å; L514-Y516 PolarHBondContact O-N 3.24Å; L514-Y516 VanDerWaalsContact O-N 3.15Å; L514-D517 PolarHBondContact O-N 2.85Å; L514-A525 HydrophobicContact CB-CB 4.16Å; L514-A526 HydrophobicContact CD1-CB 4.06Å; L514-M529 HydrophobicContact CB-SD 4.12Å; L514-M529 HydrophobicContact CD2-CE 4.15Å; L514-M529 HydrophobicContact CD2-SD 3.67Å; L514-L545 HydrophobicContact CD2-CD2 4.1Å; L514-Y548 HydrophobicContact CD1-CD1 4.1Å; L514-Y548 HydrophobicContact CD1-CE1 3.76Å; L514-Y548 HydrophobicContact CD2-CD1 4.11Å; L514-Y548 HydrophobicContact CD2-CE1 4.44Å; L514-Y548 HydrophobicContact CD2-CG 4.31Å; L514-Y548 HydrophobicContact CG-CD1 4.05Å; L514-Y548 HydrophobicContact CG-CE1 3.87Å; L514-Y548 HydrophobicContact CG-CG 4.48Å; L514-Y548 PolarHBondContact O-OH 3.32Å; L514-I557 HydrophobicContact CD1-CG2 3.42Å; L514-I557 VanDerWaalsContact CD1-CG2 3.42Å
515	F	90.5	Very high	93.9	Very high	107 Å²	107	33.4 Å²	33.4	47%	0.469	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-7.8	-178.8	-71.8	-3.8	0	0	0	114.4	R511 D517 Y548	R511-F515 HydrophobicContact CG-CD2 4.18Å; R511-F515 HydrophobicContact CG-CE1 4.22Å; R511-F515 HydrophobicContact CG-CE2 3.86Å; R511-F515 HydrophobicContact CG-CZ 3.89Å; R511-F515 PolarHBondContact O-N 2.86Å; F515-D517 PolarHBondContact O-N 2.64Å; F515-Y548 AromaticContact CD1-CD2 3.5Å; F515-Y548 HydrophobicContact CD1-CD2 3.5Å; F515-Y548 VanDerWaalsContact CD1-CD2 3.5Å; F515-Y548 AromaticContact CD1-CE2 3.39Å; F515-Y548 HydrophobicContact CD1-CE2 3.39Å; F515-Y548 HydrophobicContact CD1-CG 4.44Å; F515-Y548 AromaticContact CE1-CD2 3.36Å; F515-Y548 HydrophobicContact CE1-CD2 3.36Å; F515-Y548 AromaticContact CE1-CE2 3.81Å; F515-Y548 HydrophobicContact CE1-CE2 3.81Å; F515-Y548 HydrophobicContact CE1-CG 4.15Å; F515-Y548 HydrophobicContact CG-CE2 4.42Å
516	Y	88.7	Confident	94	Very high	154 Å²	154	30.4 Å²	30.4	60%	0.604	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-15.1	166.7	-165.8	-101.8	0	0	0	112.4	G512 V513 L514 D518	G512-Y516 PolarHBondContact O-N 3.24Å; V513-Y516 VanDerWaalsContact O-CB 3.28Å; V513-Y516 WeakPolarHBondContact O-CB 3.45Å; V513-Y516 PolarHBondContact O-N 3.05Å; L514-Y516 PolarHBondContact O-N 3.24Å; L514-Y516 VanDerWaalsContact O-N 3.15Å; Y516-D518 HydrophobicContact CD1-CB 3.96Å; Y516-D518 HydrophobicContact CE1-CB 4.43Å; Y516-D518 PolarHBondContact O-N 2.83Å
517	D	86.1	Confident	94.2	Very high	69 Å²	69	30.9 Å²	30.9	37%	0.369	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	29	175.5	-157.9	36.8	0	0	0	114.2	L514 F515 Y548 T552 H554	L514-D517 PolarHBondContact O-N 2.85Å; F515-D517 PolarHBondContact O-N 2.64Å; D517-Y548 WeakPolarHBondContact CA-OH 3.45Å; D517-Y548 WeakPolarHBondContact CB-OH 3.48Å; D517-Y548 PolarHBondContact OD1-OH 3.35Å; D517-T552 PolarHBondContact OD1-OG1 2.69Å; D517-H554 PolarHBondContact O-CD2 3.26Å; D517-H554 PolarHBondContact O-NE2 2.7Å; D517-H554 IonicContact OD1-CD2 3.82Å; D517-H554 PolarHBondContact OD1-CD2 2.91Å; D517-H554 IonicContact OD2-CD2 2.73Å
518	D	93	Very high	94.2	Very high	41 Å²	41	30.9 Å²	30.9	22%	0.219	16%	0.159	C	C	.	.			trans	-82.5	129.7	168	173.8	73.7	0	0	0	110.6	T484 Y516 V520 S521 G522	T484-D518 WeakPolarHBondContact CB-OD2 3.39Å; T484-D518 HydrophobicContact CG2-CB 4.29Å; T484-D518 VanDerWaalsContact CG2-CG 3.45Å; T484-D518 WeakPolarHBondContact CG2-OD2 3.3Å; Y516-D518 HydrophobicContact CD1-CB 3.96Å; Y516-D518 HydrophobicContact CE1-CB 4.43Å; Y516-D518 PolarHBondContact O-N 2.83Å; D518-V520 VanDerWaalsContact C-N 3.27Å; D518-V520 PolarHBondContact O-N 3.17Å; D518-V520 PolarHBondContact OD2-N 2.59Å; D518-S521 WeakPolarHBondContact CB-OG 3.04Å; D518-S521 PolarHBondContact OD2-N 3.24Å; D518-S521 PolarHBondContact OD2-OG 3.46Å; D518-G522 VanDerWaalsContact O-CA 3.29Å; D518-G522 WeakPolarHBondContact O-CA 3.38Å; D518-G522 PolarHBondContact O-N 3.02Å
519	A	92.1	Very high	94.3	Very high	20 Å²	20	28.4 Å²	28.4	17%	0.165	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-30.8	-173.8	0	0	0	0	0	114	H554 K556	A519-H554 HydrophobicContact CB-CB 4.22Å; A519-K556 HydrophobicContact CB-CB 4.43Å; A519-K556 HydrophobicContact CB-CD 4.2Å; A519-K556 VanDerWaalsContact O-CB 3.29Å; A519-K556 WeakPolarHBondContact O-CB 3.45Å
520	V	92.8	Very high	94.4	Very high	27 Å²	27	27.8 Å²	27.8	16%	0.164	14%	0.142	C	C	.	.	H	α-helix	trans	-85.2	-56.8	-177.4	178.5	0	0	0	0	109.7	W410 H488 D518 G522 E523	W410-V520 HydrophobicContact CH2-CG1 3.7Å; W410-V520 HydrophobicContact CZ2-CG1 3.73Å; H488-V520 HydrophobicContact CB-CG1 4.01Å; H488-V520 PolarHBondContact ND1-O 3.32Å; D518-V520 VanDerWaalsContact C-N 3.27Å; D518-V520 PolarHBondContact O-N 3.17Å; D518-V520 PolarHBondContact OD2-N 2.59Å; V520-G522 VanDerWaalsContact C-N 3.29Å; V520-G522 PolarHBondContact O-N 3.22Å; V520-E523 PolarHBondContact O-N 3.06Å
521	S	93.6	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.8	-32.5	-179.9	60.3	0	0	0	0	112.3	D518 A524 A525	D518-S521 WeakPolarHBondContact CB-OG 3.04Å; D518-S521 PolarHBondContact OD2-N 3.24Å; D518-S521 PolarHBondContact OD2-OG 3.46Å; S521-A524 PolarHBondContact O-N 3.49Å; S521-A525 VanDerWaalsContact O-CB 3.26Å; S521-A525 WeakPolarHBondContact O-CB 3.14Å; S521-A525 PolarHBondContact O-N 3.05Å
522	G	94.7	Very high	94.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.2	-35.6	177.4	0	0	0	0	0	113.9	D518 V520 A525 A526	D518-G522 VanDerWaalsContact O-CA 3.29Å; D518-G522 WeakPolarHBondContact O-CA 3.38Å; D518-G522 PolarHBondContact O-N 3.02Å; V520-G522 VanDerWaalsContact C-N 3.29Å; V520-G522 PolarHBondContact O-N 3.22Å; G522-A525 PolarHBondContact O-N 2.92Å; G522-A526 VanDerWaalsContact O-CB 3.31Å; G522-A526 WeakPolarHBondContact O-CB 3.44Å; G522-A526 PolarHBondContact O-N 3.02Å
523	E	95.5	Very high	94.3	Very high	24 Å²	24	22.1 Å²	22.1	11%	0.112	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-47.5	174.6	-179	166.5	-141.5	0	0	111	V520 L527 K556 R559	V520-E523 PolarHBondContact O-N 3.06Å; E523-L527 WeakPolarHBondContact O-CB 3.18Å; E523-L527 PolarHBondContact O-N 2.98Å; E523-L527 VanDerWaalsContact O-N 3.16Å; E523-K556 HydrophobicContact CB-CB 4.2Å; E523-K556 WeakPolarHBondContact CB-O 3.19Å; E523-K556 VanDerWaalsContact CG-O 3.22Å; E523-K556 WeakPolarHBondContact CG-O 3.37Å; E523-R559 IonicContact OE1-CZ 3.29Å; E523-R559 IonicContact OE1-NE 3.92Å; E523-R559 PolarHBondContact OE1-NE 3.47Å; E523-R559 VanDerWaalsContact OE1-NE 3.15Å; E523-R559 IonicContact OE1-NH2 3.96Å; E523-R559 PolarHBondContact OE1-NH2 3.37Å; E523-R559 IonicContact OE2-NH2 2.93Å
524	A	96.5	Very high	94.2	Very high	1 Å²	1	22 Å²	22	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-69.9	-39.2	176.5	0	0	0	0	0	112.9	H488 C491 L492 S521 L527 A528	H488-A524 HydrophobicContact CB-CB 4.36Å; H488-A524 VanDerWaalsContact ND1-CB 3.33Å; H488-A524 WeakPolarHBondContact ND1-CB 3.32Å; H488-A524 WeakPolarHBondContact O-CB 3.23Å; C491-A524 HydrophobicContact CB-CB 3.71Å; L492-A524 HydrophobicContact CD2-CB 3.87Å; L492-A524 HydrophobicContact CG-CB 3.82Å; S521-A524 PolarHBondContact O-N 3.49Å; A524-L527 PolarHBondContact O-N 2.87Å; A524-A528 WeakPolarHBondContact O-CB 3.41Å; A524-A528 PolarHBondContact O-N 3.42Å
525	A	97.5	Very high	94	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.4	-46.5	178.2	0	0	0	0	0	111.2	V513 L514 S521 G522 A528 M529	V513-A525 HydrophobicContact CB-CB 4.11Å; V513-A525 HydrophobicContact CG1-CB 4.07Å; L514-A525 HydrophobicContact CB-CB 4.16Å; S521-A525 VanDerWaalsContact O-CB 3.26Å; S521-A525 WeakPolarHBondContact O-CB 3.14Å; S521-A525 PolarHBondContact O-N 3.05Å; G522-A525 PolarHBondContact O-N 2.92Å; A525-A528 PolarHBondContact O-N 3.06Å; A525-M529 WeakPolarHBondContact O-CB 3.3Å; A525-M529 WeakPolarHBondContact O-CG 3.13Å; A525-M529 PolarHBondContact O-N 2.9Å
526	A	97.3	Very high	93.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-43.1	177.4	0	0	0	0	0	112.4	L514 G522 M529 G530 I557 I561	L514-A526 HydrophobicContact CD1-CB 4.06Å; G522-A526 VanDerWaalsContact O-CB 3.31Å; G522-A526 WeakPolarHBondContact O-CB 3.44Å; G522-A526 PolarHBondContact O-N 3.02Å; A526-M529 PolarHBondContact O-N 2.8Å; A526-G530 PolarHBondContact O-N 3.22Å; A526-I557 HydrophobicContact CB-CG2 4.5Å; A526-I561 HydrophobicContact CB-CB 4.48Å; A526-I561 HydrophobicContact CB-CG1 3.61Å
527	L	97.6	Very high	94.1	Very high	9 Å²	9	13.5 Å²	13.5	5%	0.047	9%	0.085	C	C	.	.	H	α-helix	trans	-61.3	-48.2	174.2	175.9	59.3	0	0	0	111.1	L492 E523 A524 M529 G530 L531 V563 V778 L788 F791	L492-L527 HydrophobicContact CD2-CD2 3.89Å; E523-L527 WeakPolarHBondContact O-CB 3.18Å; E523-L527 PolarHBondContact O-N 2.98Å; E523-L527 VanDerWaalsContact O-N 3.16Å; A524-L527 PolarHBondContact O-N 2.87Å; L527-M529 PolarHBondContact O-N 2.67Å; L527-G530 CarbonylContact O-C 3.59Å; L527-G530 WeakPolarHBondContact O-CA 3.37Å; L527-G530 PolarHBondContact O-N 2.85Å; L527-L531 HydrophobicContact CG-CD1 4.45Å; L527-L531 WeakPolarHBondContact O-CG 3.44Å; L527-L531 PolarHBondContact O-N 3.09Å; L527-V563 HydrophobicContact CD1-CB 4.05Å; L527-V563 HydrophobicContact CD1-CG1 3.6Å; L527-V778 HydrophobicContact CD1-CG2 3.99Å; L527-V778 HydrophobicContact CD2-CG1 4.09Å; L527-L788 HydrophobicContact CD2-CD2 4.15Å; L527-F791 HydrophobicContact CD2-CZ 4.4Å
528	A	97.6	Very high	94.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.9	-38.1	-179.7	0	0	0	0	0	112.8	C491 L510 A524 A525 G530 L531 V532	C491-A528 HydrophobicContact CB-CB 4.36Å; C491-A528 WeakPolarHBondContact O-CB 3.36Å; L510-A528 HydrophobicContact CD1-CB 3.73Å; L510-A528 HydrophobicContact CD2-CB 3.82Å; L510-A528 HydrophobicContact CG-CB 4.4Å; A524-A528 WeakPolarHBondContact O-CB 3.41Å; A524-A528 PolarHBondContact O-N 3.42Å; A525-A528 PolarHBondContact O-N 3.06Å; A528-G530 VanDerWaalsContact C-N 3.25Å; A528-G530 PolarHBondContact O-N 2.88Å; A528-L531 PolarHBondContact O-N 3.2Å; A528-L531 VanDerWaalsContact O-N 3.16Å; A528-V532 VanDerWaalsContact O-CG2 3.3Å; A528-V532 WeakPolarHBondContact O-CG2 3.36Å; A528-V532 PolarHBondContact O-N 2.83Å
529	M	98	Very high	94.5	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-59	-40.7	172	-72.9	167.5	71.8	0	0	110.9	Y507 L510 R511 L514 A525 A526 L527 M533 L545	Y507-M529 HydrophobicContact CD2-CB 4.15Å; Y507-M529 HydrophobicContact CD2-CE 4.21Å; Y507-M529 HydrophobicContact CD2-CG 4.24Å; Y507-M529 HydrophobicContact CE1-CE 3.99Å; Y507-M529 HydrophobicContact CE2-CB 4.02Å; Y507-M529 HydrophobicContact CE2-CE 3.46Å; Y507-M529 VanDerWaalsContact CE2-CE 3.46Å; Y507-M529 HydrophobicContact CE2-CG 4.24Å; Y507-M529 VanDerWaalsContact OH-CE 3.27Å; Y507-M529 WeakPolarHBondContact OH-CE 3.36Å; L510-M529 HydrophobicContact CB-CG 3.53Å; L510-M529 HydrophobicContact CB-SD 4.35Å; L510-M529 HydrophobicContact CD1-CG 4.21Å; R511-M529 HydrophobicContact CB-CE 3.94Å; R511-M529 HydrophobicContact CB-SD 4.35Å; R511-M529 HydrophobicContact CG-CE 4.24Å; L514-M529 HydrophobicContact CB-SD 4.12Å; L514-M529 HydrophobicContact CD2-CE 4.15Å; L514-M529 HydrophobicContact CD2-SD 3.67Å; A525-M529 WeakPolarHBondContact O-CB 3.3Å; A525-M529 WeakPolarHBondContact O-CG 3.13Å; A525-M529 PolarHBondContact O-N 2.9Å; A526-M529 PolarHBondContact O-N 2.8Å; L527-M529 PolarHBondContact O-N 2.67Å; M529-M533 WeakPolarHBondContact O-CB 3.35Å; M529-M533 PolarHBondContact O-N 3.16Å; M529-M533 VanDerWaalsContact O-N 3.16Å; M529-L545 HydrophobicContact CE-CD2 3.86Å; M529-L545 HydrophobicContact CE-CG 4.41Å; M529-L545 HydrophobicContact SD-CD2 4.22Å
530	G	96.2	Very high	94.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.5	-47.1	171.9	0	0	0	0	0	112.9	A526 L527 A528 V532 M533 A534 V567	A526-G530 PolarHBondContact O-N 3.22Å; L527-G530 CarbonylContact O-C 3.59Å; L527-G530 WeakPolarHBondContact O-CA 3.37Å; L527-G530 PolarHBondContact O-N 2.85Å; A528-G530 VanDerWaalsContact C-N 3.25Å; A528-G530 PolarHBondContact O-N 2.88Å; G530-V532 PolarHBondContact O-N 3.44Å; G530-M533 CarbonylContact O-C 3.49Å; G530-M533 PolarHBondContact O-N 3.43Å; G530-A534 PolarHBondContact O-N 3.33Å; G530-V567 WeakPolarHBondContact O-CG1 3.04Å
531	L	95.7	Very high	94.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-44.6	177.6	-62.9	175.4	0	0	0	112.1	G495 L499 G500 L527 A528 M533 A534 V567 I774 F791	G495-L531 WeakPolarHBondContact O-CB 3.46Å; L499-L531 WeakPolarHBondContact CA-O 3.18Å; L499-L531 HydrophobicContact CD1-CD2 4.2Å; G500-L531 PolarHBondContact N-O 3.39Å; L527-L531 HydrophobicContact CG-CD1 4.45Å; L527-L531 WeakPolarHBondContact O-CG 3.44Å; L527-L531 PolarHBondContact O-N 3.09Å; A528-L531 PolarHBondContact O-N 3.2Å; A528-L531 VanDerWaalsContact O-N 3.16Å; L531-M533 VanDerWaalsContact C-N 3.31Å; L531-M533 PolarHBondContact O-N 2.86Å; L531-A534 VanDerWaalsContact O-CB 3.32Å; L531-A534 WeakPolarHBondContact O-CB 3.24Å; L531-A534 PolarHBondContact O-N 2.98Å; L531-V567 HydrophobicContact CD2-CG1 4.4Å; L531-I774 HydrophobicContact CD2-CG2 3.46Å; L531-I774 VanDerWaalsContact CD2-CG2 3.46Å; L531-F791 HydrophobicContact CD1-CE1 3.92Å; L531-F791 HydrophobicContact CD1-CZ 3.99Å; L531-F791 HydrophobicContact CD2-CE1 4.21Å
532	V	94.5	Very high	94.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.9	-42.9	177.3	173	0	0	0	0	111.4	T498 T501 H502 V506 L510 A528 G530	T498-V532 VanDerWaalsContact OG1-CG2 3.26Å; T498-V532 WeakPolarHBondContact OG1-CG2 3.35Å; T501-V532 PolarHBondContact N-O 3.2Å; H502-V532 PolarHBondContact CD2-O 2.97Å; H502-V532 PolarHBondContact N-O 3.4Å; V506-V532 HydrophobicContact CG1-CG2 3.74Å; L510-V532 HydrophobicContact CD1-CG2 3.79Å; A528-V532 VanDerWaalsContact O-CG2 3.3Å; A528-V532 WeakPolarHBondContact O-CG2 3.36Å; A528-V532 PolarHBondContact O-N 2.83Å; G530-V532 PolarHBondContact O-N 3.44Å
533	M	94.6	Very high	95	Very high	2 Å²	2	25 Å²	25	1%	0.01	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	17.8	-175.4	-66.2	-63.9	174.8	0	0	113.3	H502 W504 Y507 M529 G530 L531 G535 S536 I568	H502-M533 HydrophobicContact CB-SD 4.41Å; W504-M533 HydrophobicContact CD2-CE 3.73Å; W504-M533 HydrophobicContact CE3-CE 3.73Å; W504-M533 HydrophobicContact CG-CE 4.34Å; W504-M533 HydrophobicContact CH2-CE 3.95Å; W504-M533 HydrophobicContact CZ2-CE 3.97Å; W504-M533 HydrophobicContact CZ3-CE 3.84Å; Y507-M533 HydrophobicContact CD2-CE 3.75Å; Y507-M533 HydrophobicContact CD2-CG 3.62Å; Y507-M533 HydrophobicContact CE2-CG 4.06Å; Y507-M533 HydrophobicContact CG-CE 3.7Å; M529-M533 WeakPolarHBondContact O-CB 3.35Å; M529-M533 PolarHBondContact O-N 3.16Å; M529-M533 VanDerWaalsContact O-N 3.16Å; G530-M533 CarbonylContact O-C 3.49Å; G530-M533 PolarHBondContact O-N 3.43Å; L531-M533 VanDerWaalsContact C-N 3.31Å; L531-M533 PolarHBondContact O-N 2.86Å; M533-G535 PolarHBondContact O-N 3.3Å; M533-S536 WeakPolarHBondContact O-CB 3.43Å; M533-S536 PolarHBondContact O-N 3.18Å; M533-S536 VanDerWaalsContact O-N 3.12Å; M533-S536 PolarHBondContact O-OG 2.9Å; M533-I568 HydrophobicContact CB-CD1 4.28Å; M533-I568 HydrophobicContact CB-CG1 3.9Å
534	A	92.6	Very high	95	Very high	6 Å²	6	26 Å²	26	5%	0.05	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	128.9	-177.8	0	0	0	0	0	112.2	H502 G530 L531 S536 V567 I774	H502-A534 PolarHBondContact NE2-O 2.8Å; G530-A534 PolarHBondContact O-N 3.33Å; L531-A534 VanDerWaalsContact O-CB 3.32Å; L531-A534 WeakPolarHBondContact O-CB 3.24Å; L531-A534 PolarHBondContact O-N 2.98Å; A534-S536 PolarHBondContact O-N 3.08Å; A534-V567 HydrophobicContact CB-CG1 3.52Å; A534-I774 HydrophobicContact CB-CD1 3.72Å
535	G	88.8	Confident	95	Very high	28 Å²	28	26 Å²	26	29%	0.289	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	11	179.6	0	0	0	0	0	116.3	M533 V567 I568 C570 C572	M533-G535 PolarHBondContact O-N 3.3Å; G535-V567 PolarHBondContact N-O 3.1Å; G535-V567 VanDerWaalsContact N-O 3.16Å; G535-I568 CarbonylContact C-O 3.59Å; G535-I568 WeakPolarHBondContact CA-O 3.41Å; G535-I568 PolarHBondContact N-O 2.72Å; G535-C570 VanDerWaalsContact CA-O 3.22Å; G535-C570 WeakPolarHBondContact CA-O 3.21Å; G535-C572 PolarHBondContact O-SG 2.74Å
536	S	89.4	Confident	94.9	Very high	33 Å²	33	26.9 Å²	26.9	23%	0.231	14%	0.14	C	C	.	.			trans	-84.2	-23.1	179.7	67.6	0	0	0	0	113.9	M533 A534 N538 I568	M533-S536 WeakPolarHBondContact O-CB 3.43Å; M533-S536 PolarHBondContact O-N 3.18Å; M533-S536 VanDerWaalsContact O-N 3.12Å; M533-S536 PolarHBondContact O-OG 2.9Å; A534-S536 PolarHBondContact O-N 3.08Å; S536-N538 PolarHBondContact O-N 3.21Å; S536-N538 PolarHBondContact OG-N 3.17Å; S536-I568 PolarHBondContact N-O 2.83Å
537	N	92	Very high	94.8	Very high	21 Å²	21	29.2 Å²	29.2	11%	0.112	16%	0.159	C	C	.	.			trans	41.3	33.6	-166.3	-169.9	34.1	0	0	0	113.7	S539 I568 C572 E575 W579	N537-S539 PolarHBondContact O-N 3.33Å; N537-I568 PolarHBondContact N-O 3.2Å; N537-C572 HydrophobicContact CB-CB 4.08Å; N537-E575 WeakPolarHBondContact ND2-CB 3.36Å; N537-E575 PolarHBondContact ND2-OE2 3.15Å; N537-W579 PolarHBondContact OD1-NE1 3.35Å
538	N	93.6	Very high	94.7	Very high	55 Å²	55	30.3 Å²	30.3	29%	0.294	16%	0.163	S	C	.	.			trans	-69.2	123.7	-168.8	-179.4	-78.1	0	0	0	111.3	W504 S536 R540 S541 V542	W504-N538 WeakPolarHBondContact CH2-OD1 3.46Å; S536-N538 PolarHBondContact O-N 3.21Å; S536-N538 PolarHBondContact OG-N 3.17Å; N538-R540 VanDerWaalsContact C-N 3.26Å; N538-R540 PolarHBondContact O-N 3.28Å; N538-R540 VanDerWaalsContact O-N 3.15Å; N538-R540 WeakPolarHBondContact OD1-CA 3.35Å; N538-R540 WeakPolarHBondContact OD1-CB 3.23Å; N538-R540 PolarHBondContact OD1-N 3.26Å; N538-S541 PolarHBondContact O-N 2.93Å; N538-S541 VanDerWaalsContact O-N 3.08Å; N538-S541 PolarHBondContact O-OG 2.71Å; N538-S541 PolarHBondContact OD1-N 3.29Å; N538-V542 WeakPolarHBondContact O-CG2 3.5Å; N538-V542 PolarHBondContact O-N 3.39Å
539	S	93.5	Very high	94.4	Very high	85 Å²	85	30.4 Å²	30.4	59%	0.594	16%	0.163	S	C	*	.	H	α-helix	trans	-59	-28.6	-175.5	-71.6	0	0	0	0	115	N537 R543	N537-S539 PolarHBondContact O-N 3.33Å; S539-R543 WeakPolarHBondContact O-CB 3.26Å; S539-R543 VanDerWaalsContact O-CG 3.23Å; S539-R543 WeakPolarHBondContact O-CG 3.49Å; S539-R543 PolarHBondContact O-N 3.15Å; S539-R543 PolarHBondContact O-NE 3.46Å
540	R	95.6	Very high	94.1	Very high	82 Å²	82	34.2 Å²	34.2	31%	0.309	18%	0.182	S	C	.	.	H	α-helix	trans	-72	-51.7	174.2	172.7	-179.6	172.9	-153.3	-7	109.8	W504 D508 N538 V542 R543 E544	W504-R540 VanDerWaalsContact CE3-NH1 3.31Å; W504-R540 HydrophobicContact CH2-CB 3.91Å; W504-R540 HydrophobicContact CH2-CG 3.96Å; W504-R540 HydrophobicContact CZ3-CG 4.11Å; D508-R540 IonicContact OD1-CZ 2.71Å; D508-R540 IonicContact OD1-NH1 3.89Å; D508-R540 IonicContact OD1-NH2 3.21Å; D508-R540 PolarHBondContact OD1-NH2 3.28Å; N538-R540 VanDerWaalsContact C-N 3.26Å; N538-R540 PolarHBondContact O-N 3.28Å; N538-R540 VanDerWaalsContact O-N 3.15Å; N538-R540 WeakPolarHBondContact OD1-CA 3.35Å; N538-R540 WeakPolarHBondContact OD1-CB 3.23Å; N538-R540 PolarHBondContact OD1-N 3.26Å; R540-V542 PolarHBondContact O-N 3.45Å; R540-R543 PolarHBondContact O-N 3.14Å; R540-E544 HydrophobicContact CG-CG 4.42Å; R540-E544 WeakPolarHBondContact CG-OE1 3.42Å; R540-E544 IonicContact CZ-OE1 2.8Å; R540-E544 IonicContact NE-OE1 3.74Å; R540-E544 PolarHBondContact NE-OE1 2.85Å; R540-E544 IonicContact NH2-OE1 3.96Å; R540-E544 WeakPolarHBondContact O-CB 3.3Å; R540-E544 WeakPolarHBondContact O-CG 3.43Å; R540-E544 PolarHBondContact O-N 3.42Å
541	S	94.7	Very high	93.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-45	-177.7	69.8	0	0	0	0	113	Y507 N538 E544 L545	Y507-S541 WeakPolarHBondContact OH-CA 3.38Å; N538-S541 PolarHBondContact O-N 2.93Å; N538-S541 VanDerWaalsContact O-N 3.08Å; N538-S541 PolarHBondContact O-OG 2.71Å; N538-S541 PolarHBondContact OD1-N 3.29Å; S541-E544 PolarHBondContact O-N 3.19Å; S541-L545 WeakPolarHBondContact O-CB 3.36Å; S541-L545 WeakPolarHBondContact O-CG 3.43Å; S541-L545 PolarHBondContact O-N 2.87Å
542	V	97.1	Very high	93.7	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.036	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-47	178.9	173.3	0	0	0	0	110.8	N538 R540 I546 L565 I568 W579	N538-V542 WeakPolarHBondContact O-CG2 3.5Å; N538-V542 PolarHBondContact O-N 3.39Å; R540-V542 PolarHBondContact O-N 3.45Å; V542-I546 HydrophobicContact CG1-CD1 3.58Å; V542-I546 HydrophobicContact CG1-CG1 4.34Å; V542-I546 WeakPolarHBondContact O-CB 3.47Å; V542-I546 VanDerWaalsContact O-CG1 3.23Å; V542-I546 WeakPolarHBondContact O-CG1 3.39Å; V542-I546 PolarHBondContact O-N 3.28Å; V542-L565 HydrophobicContact CG1-CD2 4.34Å; V542-I568 HydrophobicContact CG2-CG2 3.7Å; V542-W579 HydrophobicContact CG1-CD2 3.85Å; V542-W579 HydrophobicContact CG1-CE3 4.39Å; V542-W579 HydrophobicContact CG1-CG 3.95Å; V542-W579 HydrophobicContact CG1-CZ2 4.37Å; V542-W579 HydrophobicContact CG2-CZ2 4.27Å
543	R	96.5	Very high	93.5	Very high	172 Å²	172	52.4 Å²	52.4	65%	0.649	26%	0.263	S	S	*	.	H	α-helix	trans	-63.7	-43.7	179.4	-77.8	-174.6	-63	155.1	-1.2	112.3	S539 R540 A547	S539-R543 WeakPolarHBondContact O-CB 3.26Å; S539-R543 VanDerWaalsContact O-CG 3.23Å; S539-R543 WeakPolarHBondContact O-CG 3.49Å; S539-R543 PolarHBondContact O-N 3.15Å; S539-R543 PolarHBondContact O-NE 3.46Å; R540-R543 PolarHBondContact O-N 3.14Å; R543-A547 WeakPolarHBondContact O-CB 3.16Å; R543-A547 PolarHBondContact O-N 2.97Å
544	E	95.9	Very high	93.4	Very high	45 Å²	45	55.6 Å²	55.6	21%	0.21	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-47	179.5	-73.9	179.7	-173.5	0	0	111.5	Y507 R511 R540 S541 A547 Y548	Y507-E544 VanDerWaalsContact CE1-OE2 3.24Å; Y507-E544 WeakPolarHBondContact CE1-OE2 3.24Å; Y507-E544 PolarHBondContact OH-OE2 3.13Å; R511-E544 WeakPolarHBondContact CD-OE2 3.39Å; R540-E544 HydrophobicContact CG-CG 4.42Å; R540-E544 WeakPolarHBondContact CG-OE1 3.42Å; R540-E544 IonicContact CZ-OE1 2.8Å; R540-E544 IonicContact NE-OE1 3.74Å; R540-E544 PolarHBondContact NE-OE1 2.85Å; R540-E544 IonicContact NH2-OE1 3.96Å; R540-E544 WeakPolarHBondContact O-CB 3.3Å; R540-E544 WeakPolarHBondContact O-CG 3.43Å; R540-E544 PolarHBondContact O-N 3.42Å; S541-E544 PolarHBondContact O-N 3.19Å; E544-A547 PolarHBondContact O-N 2.67Å; E544-Y548 WeakPolarHBondContact O-CB 3.38Å; E544-Y548 PolarHBondContact O-N 3.13Å
545	L	96.7	Very high	93.4	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-41	178.6	-73.7	174.2	0	0	0	112.6	L514 M529 S541 G549 I561 L565 I568	L514-L545 HydrophobicContact CD2-CD2 4.1Å; M529-L545 HydrophobicContact CE-CD2 3.86Å; M529-L545 HydrophobicContact CE-CG 4.41Å; M529-L545 HydrophobicContact SD-CD2 4.22Å; S541-L545 WeakPolarHBondContact O-CB 3.36Å; S541-L545 WeakPolarHBondContact O-CG 3.43Å; S541-L545 PolarHBondContact O-N 2.87Å; L545-G549 PolarHBondContact O-N 3.41Å; L545-I561 HydrophobicContact CB-CG2 4.27Å; L545-I561 HydrophobicContact CD2-CG1 4.27Å; L545-L565 HydrophobicContact CB-CD2 3.96Å; L545-L565 HydrophobicContact CB-CG 4.42Å; L545-L565 HydrophobicContact CD1-CD2 4.23Å; L545-I568 HydrophobicContact CD1-CD1 3.47Å; L545-I568 VanDerWaalsContact CD1-CD1 3.47Å
546	I	96.2	Very high	93.6	Very high	19 Å²	19	64.7 Å²	64.7	10%	0.097	31%	0.31	C	S	.	.	H	α-helix	trans	-66.4	-45.9	176.3	-69.4	174.9	0	0	0	110.7	V542 G549 M550 L565 W579 L583	V542-I546 HydrophobicContact CG1-CD1 3.58Å; V542-I546 HydrophobicContact CG1-CG1 4.34Å; V542-I546 WeakPolarHBondContact O-CB 3.47Å; V542-I546 VanDerWaalsContact O-CG1 3.23Å; V542-I546 WeakPolarHBondContact O-CG1 3.39Å; V542-I546 PolarHBondContact O-N 3.28Å; I546-G549 CarbonylContact O-C 3.46Å; I546-G549 PolarHBondContact O-N 3.22Å; I546-M550 HydrophobicContact CG2-CE 3.79Å; I546-M550 HydrophobicContact CG2-SD 4.14Å; I546-M550 WeakPolarHBondContact O-CG 3.41Å; I546-M550 PolarHBondContact O-N 3.12Å; I546-L565 HydrophobicContact CG1-CD1 3.78Å; I546-L565 HydrophobicContact CG1-CD2 4.08Å; I546-W579 HydrophobicContact CD1-CB 4.35Å; I546-W579 HydrophobicContact CD1-CE3 4.28Å; I546-L583 HydrophobicContact CD1-CD1 4.17Å; I546-L583 HydrophobicContact CD1-CD2 4.28Å; I546-L583 HydrophobicContact CD1-CG 4.35Å; I546-L583 HydrophobicContact CG1-CD2 4.31Å; I546-L583 HydrophobicContact CG2-CD2 4.35Å
547	A	94.7	Very high	93.9	Very high	49 Å²	49	63.1 Å²	63.1	41%	0.405	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-49.1	179.1	0	0	0	0	0	110.8	R543 E544 G549 M550 D551	R543-A547 WeakPolarHBondContact O-CB 3.16Å; R543-A547 PolarHBondContact O-N 2.97Å; E544-A547 PolarHBondContact O-N 2.67Å; A547-G549 VanDerWaalsContact C-N 3.29Å; A547-G549 PolarHBondContact O-N 3.15Å; A547-M550 PolarHBondContact O-N 3.29Å; A547-D551 PolarHBondContact O-N 3.37Å
548	Y	94.5	Very high	94.1	Very high	32 Å²	32	62.5 Å²	62.5	13%	0.125	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-37.3	177	-165.1	-89	0	0	0	112.2	L514 F515 D517 E544 M550 D551 T552 I557 I561	L514-Y548 HydrophobicContact CD1-CD1 4.1Å; L514-Y548 HydrophobicContact CD1-CE1 3.76Å; L514-Y548 HydrophobicContact CD2-CD1 4.11Å; L514-Y548 HydrophobicContact CD2-CE1 4.44Å; L514-Y548 HydrophobicContact CD2-CG 4.31Å; L514-Y548 HydrophobicContact CG-CD1 4.05Å; L514-Y548 HydrophobicContact CG-CE1 3.87Å; L514-Y548 HydrophobicContact CG-CG 4.48Å; L514-Y548 PolarHBondContact O-OH 3.32Å; F515-Y548 AromaticContact CD1-CD2 3.5Å; F515-Y548 HydrophobicContact CD1-CD2 3.5Å; F515-Y548 VanDerWaalsContact CD1-CD2 3.5Å; F515-Y548 AromaticContact CD1-CE2 3.39Å; F515-Y548 HydrophobicContact CD1-CE2 3.39Å; F515-Y548 HydrophobicContact CD1-CG 4.44Å; F515-Y548 AromaticContact CE1-CD2 3.36Å; F515-Y548 HydrophobicContact CE1-CD2 3.36Å; F515-Y548 AromaticContact CE1-CE2 3.81Å; F515-Y548 HydrophobicContact CE1-CE2 3.81Å; F515-Y548 HydrophobicContact CE1-CG 4.15Å; F515-Y548 HydrophobicContact CG-CE2 4.42Å; D517-Y548 WeakPolarHBondContact CA-OH 3.45Å; D517-Y548 WeakPolarHBondContact CB-OH 3.48Å; D517-Y548 PolarHBondContact OD1-OH 3.35Å; E544-Y548 WeakPolarHBondContact O-CB 3.38Å; E544-Y548 PolarHBondContact O-N 3.13Å; Y548-M550 VanDerWaalsContact C-N 3.26Å; Y548-M550 PolarHBondContact O-N 2.86Å; Y548-D551 PolarHBondContact O-N 3.42Å; Y548-T552 HydrophobicContact CD1-CG2 4.3Å; Y548-T552 HydrophobicContact CE1-CG2 4.28Å; Y548-T552 WeakPolarHBondContact O-CG2 3.48Å; Y548-T552 PolarHBondContact O-N 3.01Å; Y548-I557 HydrophobicContact CD1-CG2 4.35Å; Y548-I557 HydrophobicContact CE1-CD1 4.49Å; Y548-I557 HydrophobicContact CE1-CG2 3.95Å; Y548-I561 HydrophobicContact CD1-CD1 3.98Å
549	G	91.6	Very high	94.1	Very high	1 Å²	1	62 Å²	62	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-68.8	-18.5	174.7	0	0	0	0	0	114.7	L545 I546 A547 L558	L545-G549 PolarHBondContact O-N 3.41Å; I546-G549 CarbonylContact O-C 3.46Å; I546-G549 PolarHBondContact O-N 3.22Å; A547-G549 VanDerWaalsContact C-N 3.29Å; A547-G549 PolarHBondContact O-N 3.15Å; G549-L558 VanDerWaalsContact CA-CD2 3.46Å; G549-L558 WeakPolarHBondContact O-CD2 3.42Å
550	M	92.4	Very high	94.2	Very high	82 Å²	82	58.2 Å²	58.2	40%	0.404	26%	0.263	S	S	.	.	H	α-helix	trans	-83.4	-27.4	171.3	-71.9	176	170.6	0	0	111.8	I546 A547 Y548 L591	I546-M550 HydrophobicContact CG2-CE 3.79Å; I546-M550 HydrophobicContact CG2-SD 4.14Å; I546-M550 WeakPolarHBondContact O-CG 3.41Å; I546-M550 PolarHBondContact O-N 3.12Å; A547-M550 PolarHBondContact O-N 3.29Å; Y548-M550 VanDerWaalsContact C-N 3.26Å; Y548-M550 PolarHBondContact O-N 2.86Å; M550-L591 HydrophobicContact CE-CD1 4.41Å; M550-L591 HydrophobicContact CG-CD1 3.93Å
551	D	91.4	Very high	94.3	Very high	131 Å²	131	54.3 Å²	54.3	70%	0.701	25%	0.249	S	C	*	.	H	α-helix	trans	-93.1	-35.6	-174.1	-67.7	-21.3	0	0	0	113.5	A547 Y548	A547-D551 PolarHBondContact O-N 3.37Å; Y548-D551 PolarHBondContact O-N 3.42Å
552	T	92.1	Very high	94.4	Very high	15 Å²	15	54.4 Å²	54.4	9%	0.092	25%	0.249	C	C	.	.			trans	-70	142.3	-175.3	-171.8	0	0	0	0	112.4	D517 Y548 H554 I557 L558	D517-T552 PolarHBondContact OD1-OG1 2.69Å; Y548-T552 HydrophobicContact CD1-CG2 4.3Å; Y548-T552 HydrophobicContact CE1-CG2 4.28Å; Y548-T552 WeakPolarHBondContact O-CG2 3.48Å; Y548-T552 PolarHBondContact O-N 3.01Å; T552-H554 PolarHBondContact OG1-N 3.16Å; T552-I557 HydrophobicContact CG2-CB 4.4Å; T552-I557 HydrophobicContact CG2-CG2 4.46Å; T552-L558 HydrophobicContact CG2-CD2 3.54Å; T552-L558 HydrophobicContact CG2-CG 3.78Å
553	R	89.7	Confident	94.4	Very high	237 Å²	237	54.3 Å²	54.3	89%	0.894	25%	0.249	S	C	*	.			trans	-94.1	-7.4	174.4	-61.4	-178.7	-176.6	177.7	1.6	112.6	E555	R553-E555 PolarHBondContact O-N 3.12Å
554	H	93.3	Very high	94.4	Very high	69 Å²	69	46.1 Å²	46.1	32%	0.319	22%	0.218	S	C	.	.			trans	-86.7	105.2	-176.9	-67.5	-60.7	0	0	0	110.7	D517 A519 T552 K556 I557 L558	D517-H554 PolarHBondContact O-CD2 3.26Å; D517-H554 PolarHBondContact O-NE2 2.7Å; D517-H554 IonicContact OD1-CD2 3.82Å; D517-H554 PolarHBondContact OD1-CD2 2.91Å; D517-H554 IonicContact OD2-CD2 2.73Å; A519-H554 HydrophobicContact CB-CB 4.22Å; T552-H554 PolarHBondContact OG1-N 3.16Å; H554-K556 PolarHBondContact O-N 3.44Å; H554-K556 VanDerWaalsContact O-N 3.15Å; H554-I557 HydrophobicContact CB-CB 4.21Å; H554-I557 HydrophobicContact CB-CD1 3.8Å; H554-I557 HydrophobicContact CB-CG1 3.75Å; H554-I557 PolarHBondContact O-N 3.4Å; H554-L558 PolarHBondContact O-N 3.09Å; H554-L558 VanDerWaalsContact O-N 3.11Å
555	E	92.5	Very high	94.5	Very high	135 Å²	135	44 Å²	44	63%	0.631	21%	0.208	S	C	*	.	H	α-helix	trans	-54.9	-35	176.2	-65.1	-172.7	168.6	0	0	112.6	R553 I557 L558 R559 L590	R553-E555 PolarHBondContact O-N 3.12Å; E555-I557 PolarHBondContact O-N 2.96Å; E555-L558 CarbonylContact O-C 3.56Å; E555-L558 WeakPolarHBondContact O-CB 3.46Å; E555-L558 PolarHBondContact O-N 2.84Å; E555-R559 WeakPolarHBondContact O-CG 3.41Å; E555-R559 PolarHBondContact O-N 2.95Å; E555-L590 HydrophobicContact CB-CD1 4.11Å; E555-L590 HydrophobicContact CG-CD1 4.23Å
556	K	93.5	Very high	94.5	Very high	89 Å²	89	44 Å²	44	39%	0.387	21%	0.208	S	C	.	.	H	α-helix	trans	-57.4	-46.7	175.1	-64.4	-164.9	173.9	179.6	0	112.2	A519 E523 H554 L558 R559 G560	A519-K556 HydrophobicContact CB-CB 4.43Å; A519-K556 HydrophobicContact CB-CD 4.2Å; A519-K556 VanDerWaalsContact O-CB 3.29Å; A519-K556 WeakPolarHBondContact O-CB 3.45Å; E523-K556 HydrophobicContact CB-CB 4.2Å; E523-K556 WeakPolarHBondContact CB-O 3.19Å; E523-K556 VanDerWaalsContact CG-O 3.22Å; E523-K556 WeakPolarHBondContact CG-O 3.37Å; H554-K556 PolarHBondContact O-N 3.44Å; H554-K556 VanDerWaalsContact O-N 3.15Å; K556-L558 VanDerWaalsContact C-N 3.34Å; K556-L558 PolarHBondContact O-N 3.22Å; K556-R559 WeakPolarHBondContact O-CB 3.25Å; K556-R559 PolarHBondContact O-N 3.41Å; K556-G560 PolarHBondContact O-N 3.3Å; K556-G560 VanDerWaalsContact O-N 3.14Å
557	I	95.7	Very high	94.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-43.4	177.7	-55.9	-178.3	0	0	0	109.8	L514 A526 Y548 T552 H554 E555 R559 G560 I561	L514-I557 HydrophobicContact CD1-CG2 3.42Å; L514-I557 VanDerWaalsContact CD1-CG2 3.42Å; A526-I557 HydrophobicContact CB-CG2 4.5Å; Y548-I557 HydrophobicContact CD1-CG2 4.35Å; Y548-I557 HydrophobicContact CE1-CD1 4.49Å; Y548-I557 HydrophobicContact CE1-CG2 3.95Å; T552-I557 HydrophobicContact CG2-CB 4.4Å; T552-I557 HydrophobicContact CG2-CG2 4.46Å; H554-I557 HydrophobicContact CB-CB 4.21Å; H554-I557 HydrophobicContact CB-CD1 3.8Å; H554-I557 HydrophobicContact CB-CG1 3.75Å; H554-I557 PolarHBondContact O-N 3.4Å; E555-I557 PolarHBondContact O-N 2.96Å; I557-R559 PolarHBondContact O-N 2.87Å; I557-G560 WeakPolarHBondContact O-CA 3.06Å; I557-G560 PolarHBondContact O-N 2.96Å; I557-I561 HydrophobicContact CG2-CD1 3.91Å; I557-I561 HydrophobicContact CG2-CG1 4.28Å; I557-I561 WeakPolarHBondContact O-CG1 3.08Å; I557-I561 PolarHBondContact O-N 3.45Å
558	L	95.1	Very high	94.5	Very high	9 Å²	9	40.8 Å²	40.8	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-35	175.1	-66.4	176.8	0	0	0	113.1	G549 T552 H554 E555 K556 I561 C562 L590	G549-L558 VanDerWaalsContact CA-CD2 3.46Å; G549-L558 WeakPolarHBondContact O-CD2 3.42Å; T552-L558 HydrophobicContact CG2-CD2 3.54Å; T552-L558 HydrophobicContact CG2-CG 3.78Å; H554-L558 PolarHBondContact O-N 3.09Å; H554-L558 VanDerWaalsContact O-N 3.11Å; E555-L558 CarbonylContact O-C 3.56Å; E555-L558 WeakPolarHBondContact O-CB 3.46Å; E555-L558 PolarHBondContact O-N 2.84Å; K556-L558 VanDerWaalsContact C-N 3.34Å; K556-L558 PolarHBondContact O-N 3.22Å; L558-I561 PolarHBondContact O-N 3.32Å; L558-C562 WeakPolarHBondContact O-CB 3.43Å; L558-C562 PolarHBondContact O-N 3.07Å; L558-L590 HydrophobicContact CB-CB 4.23Å; L558-L590 HydrophobicContact CB-CD1 3.65Å; L558-L590 HydrophobicContact CD1-CD1 3.81Å; L558-L590 HydrophobicContact CG-CD1 4.38Å
559	R	94.3	Very high	94.5	Very high	45 Å²	45	39.2 Å²	39.2	17%	0.17	18%	0.178	C	C	.	.	H	α-helix	trans	-65.6	-44.5	173.1	-66.9	-168.7	-61	-140.6	8.8	111.7	E523 E555 K556 I557 C562 V563 L590	E523-R559 IonicContact OE1-CZ 3.29Å; E523-R559 IonicContact OE1-NE 3.92Å; E523-R559 PolarHBondContact OE1-NE 3.47Å; E523-R559 VanDerWaalsContact OE1-NE 3.15Å; E523-R559 IonicContact OE1-NH2 3.96Å; E523-R559 PolarHBondContact OE1-NH2 3.37Å; E523-R559 IonicContact OE2-NH2 2.93Å; E555-R559 WeakPolarHBondContact O-CG 3.41Å; E555-R559 PolarHBondContact O-N 2.95Å; K556-R559 WeakPolarHBondContact O-CB 3.25Å; K556-R559 PolarHBondContact O-N 3.41Å; I557-R559 PolarHBondContact O-N 2.87Å; R559-C562 WeakPolarHBondContact O-CB 3.48Å; R559-C562 PolarHBondContact O-N 3.32Å; R559-V563 WeakPolarHBondContact O-CG2 3.32Å; R559-V563 PolarHBondContact O-N 2.95Å; R559-V563 VanDerWaalsContact O-N 3.16Å; R559-L590 HydrophobicContact CG-CD2 4.23Å
560	G	96	Very high	94.5	Very high	4 Å²	4	39.4 Å²	39.4	4%	0.041	18%	0.179	C	C	.	.	H	α-helix	trans	-58.3	-46.4	173.3	0	0	0	0	0	112.3	K556 I557 C562 V563 G564	K556-G560 PolarHBondContact O-N 3.3Å; K556-G560 VanDerWaalsContact O-N 3.14Å; I557-G560 WeakPolarHBondContact O-CA 3.06Å; I557-G560 PolarHBondContact O-N 2.96Å; G560-C562 PolarHBondContact O-N 3.24Å; G560-V563 PolarHBondContact O-N 2.74Å; G560-G564 PolarHBondContact O-N 3.24Å
561	I	97	Very high	94.1	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-44.1	175.9	-67.2	171.4	0	0	0	111	A526 L545 Y548 I557 L558 V563 G564 L565	A526-I561 HydrophobicContact CB-CB 4.48Å; A526-I561 HydrophobicContact CB-CG1 3.61Å; L545-I561 HydrophobicContact CB-CG2 4.27Å; L545-I561 HydrophobicContact CD2-CG1 4.27Å; Y548-I561 HydrophobicContact CD1-CD1 3.98Å; I557-I561 HydrophobicContact CG2-CD1 3.91Å; I557-I561 HydrophobicContact CG2-CG1 4.28Å; I557-I561 WeakPolarHBondContact O-CG1 3.08Å; I557-I561 PolarHBondContact O-N 3.45Å; L558-I561 PolarHBondContact O-N 3.32Å; I561-V563 VanDerWaalsContact C-N 3.3Å; I561-V563 PolarHBondContact O-N 2.78Å; I561-G564 PolarHBondContact O-N 3.06Å; I561-L565 HydrophobicContact CG2-CD1 3.75Å; I561-L565 HydrophobicContact CG2-CG 4.1Å; I561-L565 WeakPolarHBondContact O-CB 3.46Å; I561-L565 WeakPolarHBondContact O-CG 3.28Å; I561-L565 PolarHBondContact O-N 3.16Å
562	C	96	Very high	94	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	15%	0.151	C	C	.	.	H	α-helix	trans	-57.6	-43.3	-178.5	170.5	0	0	0	0	112	L558 R559 G560 G566 R593 A594 Y597	L558-C562 WeakPolarHBondContact O-CB 3.43Å; L558-C562 PolarHBondContact O-N 3.07Å; R559-C562 WeakPolarHBondContact O-CB 3.48Å; R559-C562 PolarHBondContact O-N 3.32Å; G560-C562 PolarHBondContact O-N 3.24Å; C562-G566 PolarHBondContact O-N 2.89Å; C562-R593 PolarHBondContact SG-NE 3.47Å; C562-A594 HydrophobicContact CB-CB 3.99Å; C562-A594 VanDerWaalsContact SG-CA 3.56Å; C562-A594 PolarHBondContact SG-N 2.9Å; C562-Y597 WeakPolarHBondContact SG-CD2 3.35Å; C562-Y597 WeakPolarHBondContact SG-CE2 3.43Å
563	V	97.2	Very high	93.8	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.03	15%	0.149	C	C	.	.	H	α-helix	trans	-75.9	-42.9	176.3	-177.6	0	0	0	0	110.4	L527 R559 G560 I561 L565 G566 V567 Y597 L777 V778 Q781	L527-V563 HydrophobicContact CD1-CB 4.05Å; L527-V563 HydrophobicContact CD1-CG1 3.6Å; R559-V563 WeakPolarHBondContact O-CG2 3.32Å; R559-V563 PolarHBondContact O-N 2.95Å; R559-V563 VanDerWaalsContact O-N 3.16Å; G560-V563 PolarHBondContact O-N 2.74Å; I561-V563 VanDerWaalsContact C-N 3.3Å; I561-V563 PolarHBondContact O-N 2.78Å; V563-L565 VanDerWaalsContact C-N 3.33Å; V563-L565 PolarHBondContact O-N 3.31Å; V563-G566 WeakPolarHBondContact O-CA 3.06Å; V563-G566 PolarHBondContact O-N 3.22Å; V563-V567 HydrophobicContact CG1-CG2 4.35Å; V563-V567 WeakPolarHBondContact O-CG2 3.26Å; V563-V567 PolarHBondContact O-N 3.36Å; V563-Y597 HydrophobicContact CG2-CE2 4.39Å; V563-L777 HydrophobicContact CG1-CD2 4.15Å; V563-L777 HydrophobicContact CG1-CG 4.3Å; V563-V778 HydrophobicContact CG1-CG2 3.87Å; V563-Q781 HydrophobicContact CG2-CG 3.57Å
564	G	97.1	Very high	93.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.8	-41.9	179.6	0	0	0	0	0	113.3	G560 I561 G566 V567 I568	G560-G564 PolarHBondContact O-N 3.24Å; I561-G564 PolarHBondContact O-N 3.06Å; G564-G566 VanDerWaalsContact C-N 3.35Å; G564-V567 PolarHBondContact O-N 2.82Å; G564-I568 VanDerWaalsContact O-CG1 3.3Å; G564-I568 WeakPolarHBondContact O-CG1 3.23Å; G564-I568 PolarHBondContact O-N 3.26Å
565	L	98	Very high	93.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-38.4	173.1	-72.3	173.4	0	0	0	112.2	V542 L545 I546 I561 V563 V567 I568 A569 L583 A594	V542-L565 HydrophobicContact CG1-CD2 4.34Å; L545-L565 HydrophobicContact CB-CD2 3.96Å; L545-L565 HydrophobicContact CB-CG 4.42Å; L545-L565 HydrophobicContact CD1-CD2 4.23Å; I546-L565 HydrophobicContact CG1-CD1 3.78Å; I546-L565 HydrophobicContact CG1-CD2 4.08Å; I561-L565 HydrophobicContact CG2-CD1 3.75Å; I561-L565 HydrophobicContact CG2-CG 4.1Å; I561-L565 WeakPolarHBondContact O-CB 3.46Å; I561-L565 WeakPolarHBondContact O-CG 3.28Å; I561-L565 PolarHBondContact O-N 3.16Å; V563-L565 VanDerWaalsContact C-N 3.33Å; V563-L565 PolarHBondContact O-N 3.31Å; L565-V567 VanDerWaalsContact C-N 3.34Å; L565-I568 PolarHBondContact O-N 3.02Å; L565-A569 PolarHBondContact O-N 3.07Å; L565-L583 HydrophobicContact CD1-CD1 4.13Å; L565-A594 HydrophobicContact CD1-CB 4.1Å
566	G	96.6	Very high	93.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.3	-45.1	172.8	0	0	0	0	0	112.3	C562 V563 G564 A569 C570 M601	C562-G566 PolarHBondContact O-N 2.89Å; V563-G566 WeakPolarHBondContact O-CA 3.06Å; V563-G566 PolarHBondContact O-N 3.22Å; G564-G566 VanDerWaalsContact C-N 3.35Å; G566-A569 PolarHBondContact O-N 3.03Å; G566-C570 PolarHBondContact O-N 2.71Å; G566-M601 WeakPolarHBondContact O-CB 3.27Å
567	V	95.6	Very high	93.5	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.9	-39.9	178.2	173.5	0	0	0	0	112.1	G530 L531 A534 G535 V563 G564 L565 A569 C570 I774 L777	G530-V567 WeakPolarHBondContact O-CG1 3.04Å; L531-V567 HydrophobicContact CD2-CG1 4.4Å; A534-V567 HydrophobicContact CB-CG1 3.52Å; G535-V567 PolarHBondContact N-O 3.1Å; G535-V567 VanDerWaalsContact N-O 3.16Å; V563-V567 HydrophobicContact CG1-CG2 4.35Å; V563-V567 WeakPolarHBondContact O-CG2 3.26Å; V563-V567 PolarHBondContact O-N 3.36Å; G564-V567 PolarHBondContact O-N 2.82Å; L565-V567 VanDerWaalsContact C-N 3.34Å; V567-A569 VanDerWaalsContact C-N 3.27Å; V567-A569 PolarHBondContact O-N 2.82Å; V567-C570 VanDerWaalsContact O-CB 3.25Å; V567-C570 WeakPolarHBondContact O-CB 3.32Å; V567-C570 PolarHBondContact O-N 3.48Å; V567-I774 HydrophobicContact CB-CG1 4.44Å; V567-I774 HydrophobicContact CG1-CD1 3.66Å; V567-I774 HydrophobicContact CG1-CG1 3.8Å; V567-I774 HydrophobicContact CG1-CG2 4.26Å; V567-I774 HydrophobicContact CG2-CG1 4.14Å; V567-I774 HydrophobicContact CG2-CG2 3.95Å; V567-L777 HydrophobicContact CG2-CD2 4.17Å
568	I	96	Very high	93.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-35.3	177.4	-71.9	165	0	0	0	111.9	M533 G535 S536 N537 V542 L545 G564 L565 C570	M533-I568 HydrophobicContact CB-CD1 4.28Å; M533-I568 HydrophobicContact CB-CG1 3.9Å; G535-I568 CarbonylContact C-O 3.59Å; G535-I568 WeakPolarHBondContact CA-O 3.41Å; G535-I568 PolarHBondContact N-O 2.72Å; S536-I568 PolarHBondContact N-O 2.83Å; N537-I568 PolarHBondContact N-O 3.2Å; V542-I568 HydrophobicContact CG2-CG2 3.7Å; L545-I568 HydrophobicContact CD1-CD1 3.47Å; L545-I568 VanDerWaalsContact CD1-CD1 3.47Å; G564-I568 VanDerWaalsContact O-CG1 3.3Å; G564-I568 WeakPolarHBondContact O-CG1 3.23Å; G564-I568 PolarHBondContact O-N 3.26Å; L565-I568 PolarHBondContact O-N 3.02Å; I568-C570 VanDerWaalsContact C-N 3.3Å; I568-C570 PolarHBondContact O-N 2.99Å
569	A	94.2	Very high	93.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.4	179.4	0	0	0	0	0	114.3	L565 G566 V567 G571 C572 P576 W579 A598 A602	L565-A569 PolarHBondContact O-N 3.07Å; G566-A569 PolarHBondContact O-N 3.03Å; V567-A569 VanDerWaalsContact C-N 3.27Å; V567-A569 PolarHBondContact O-N 2.82Å; A569-G571 PolarHBondContact O-N 2.71Å; A569-C572 WeakPolarHBondContact O-CB 3.48Å; A569-C572 PolarHBondContact O-N 3.37Å; A569-C572 VanDerWaalsContact O-N 3.14Å; A569-P576 HydrophobicContact CB-CB 4.17Å; A569-P576 HydrophobicContact CB-CG 4.14Å; A569-W579 HydrophobicContact CB-CH2 3.85Å; A569-W579 HydrophobicContact CB-CZ2 3.99Å; A569-A598 HydrophobicContact CB-CB 3.94Å; A569-A602 HydrophobicContact CB-CB 4.45Å; A569-A602 WeakPolarHBondContact O-CA 3.04Å
570	C	90.9	Very high	93.7	Very high	5 Å²	5	17.7 Å²	17.7	3%	0.034	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	121.3	-172.6	-170.9	0	0	0	0	112.4	G535 G566 V567 I568 C572 M601 T770	G535-C570 VanDerWaalsContact CA-O 3.22Å; G535-C570 WeakPolarHBondContact CA-O 3.21Å; G566-C570 PolarHBondContact O-N 2.71Å; V567-C570 VanDerWaalsContact O-CB 3.25Å; V567-C570 WeakPolarHBondContact O-CB 3.32Å; V567-C570 PolarHBondContact O-N 3.48Å; I568-C570 VanDerWaalsContact C-N 3.3Å; I568-C570 PolarHBondContact O-N 2.99Å; C570-C572 VanDerWaalsContact C-N 3.28Å; C570-C572 PolarHBondContact O-N 2.79Å; C570-M601 WeakPolarHBondContact CA-O 3.24Å; C570-M601 HydrophobicContact CB-CB 4.27Å; C570-M601 HydrophobicContact CB-CE 4.03Å; C570-M601 WeakPolarHBondContact SG-CE 3.38Å; C570-T770 HydrophobicContact CB-CG2 4.29Å
571	G	85.1	Confident	93.6	Very high	47 Å²	47	23 Å²	23	49%	0.485	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	4.1	179	0	0	0	0	0	115.7	A569 M601	A569-G571 PolarHBondContact O-N 2.71Å; G571-M601 PolarHBondContact N-O 3.46Å; G571-M601 VanDerWaalsContact N-O 3.1Å
572	C	87.9	Confident	93.6	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.02	15%	0.154	C	C	.	.			trans	-87.6	-3.1	-176.5	-52.1	0	0	0	0	114.6	G535 N537 A569 C570 E574 E575 P576	G535-C572 PolarHBondContact O-SG 2.74Å; N537-C572 HydrophobicContact CB-CB 4.08Å; A569-C572 WeakPolarHBondContact O-CB 3.48Å; A569-C572 PolarHBondContact O-N 3.37Å; A569-C572 VanDerWaalsContact O-N 3.14Å; C570-C572 VanDerWaalsContact C-N 3.28Å; C570-C572 PolarHBondContact O-N 2.79Å; C572-E574 PolarHBondContact O-N 3.07Å; C572-E575 PolarHBondContact O-N 3.47Å; C572-P576 HydrophobicContact CB-CG 4.24Å
573	L	88	Confident	93.6	Very high	13 Å²	13	29.3 Å²	29.3	7%	0.068	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	-120	175.9	-58.6	169.1	0	0	0	113.7	R194 P576 A602 Y603 T606	R194-L573 HydrophobicContact CB-CD1 4.26Å; L573-P576 VanDerWaalsContact O-CD 3.29Å; L573-P576 WeakPolarHBondContact O-CD 3.25Å; L573-A602 WeakPolarHBondContact CA-O 3.39Å; L573-A602 PolarHBondContact N-O 2.94Å; L573-A602 VanDerWaalsContact N-O 3.14Å; L573-Y603 HydrophobicContact CB-CE1 4.38Å; L573-Y603 HydrophobicContact CD2-CD1 3.97Å; L573-Y603 HydrophobicContact CD2-CE1 4.22Å; L573-T606 HydrophobicContact CD2-CG2 3.54Å
574	E	87.7	Confident	93.6	Very high	56 Å²	56	30.8 Å²	30.8	26%	0.262	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.3	-175.6	61.1	-90.6	-158.1	0	0	115.3	R194 C572 E577 Y603	R194-E574 WeakPolarHBondContact CB-OE1 3.37Å; R194-E574 PolarHBondContact N-OE1 2.84Å; C572-E574 PolarHBondContact O-N 3.07Å; E574-E577 WeakPolarHBondContact O-CB 3.43Å; E574-E577 PolarHBondContact O-N 3.22Å; E574-Y603 WeakPolarHBondContact CA-OH 3.32Å
575	E	88.8	Confident	93.5	Very high	83 Å²	83	39.5 Å²	39.5	39%	0.388	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-42.7	-175.2	-59.5	178.2	-173.4	0	0	115	R194 N537 C572 E577 P578	R194-E575 IonicContact CZ-OE1 2.7Å; R194-E575 IonicContact NH1-OE1 3.79Å; R194-E575 PolarHBondContact NH1-OE1 3.48Å; R194-E575 IonicContact NH1-OE2 3.96Å; N537-E575 WeakPolarHBondContact ND2-CB 3.36Å; N537-E575 PolarHBondContact ND2-OE2 3.15Å; C572-E575 PolarHBondContact O-N 3.47Å; E575-E577 PolarHBondContact O-N 3.23Å; E575-P578 VanDerWaalsContact O-CD 3.23Å; E575-P578 WeakPolarHBondContact O-CD 3.23Å
576	P	93	Very high	93.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5.6	178.9	30.4	-38.7	0	0	0	114.1	A569 C572 L573 W579 I580 A602	A569-P576 HydrophobicContact CB-CB 4.17Å; A569-P576 HydrophobicContact CB-CG 4.14Å; C572-P576 HydrophobicContact CB-CG 4.24Å; L573-P576 VanDerWaalsContact O-CD 3.29Å; L573-P576 WeakPolarHBondContact O-CD 3.25Å; P576-W579 VanDerWaalsContact CA-NE1 3.31Å; P576-W579 HydrophobicContact CB-CD2 4.29Å; P576-W579 HydrophobicContact CB-CH2 4.05Å; P576-W579 HydrophobicContact CB-CZ2 3.21Å; P576-W579 PolarHBondContact O-N 3.11Å; P576-I580 HydrophobicContact CB-CD1 3.6Å; P576-I580 HydrophobicContact CB-CG1 4.11Å; P576-I580 HydrophobicContact CG-CD1 3.66Å; P576-I580 WeakPolarHBondContact O-CB 3.06Å; P576-I580 VanDerWaalsContact O-CG1 3.3Å; P576-I580 WeakPolarHBondContact O-CG1 3.43Å; P576-I580 PolarHBondContact O-N 3.32Å; P576-A602 HydrophobicContact CG-CB 3.77Å
577	E	93.1	Very high	93.3	Very high	21 Å²	21	50.9 Å²	50.9	10%	0.098	25%	0.251	C	S	.	.	H	α-helix	trans	-51.9	-40.8	-174.3	-169.4	62.9	-143.8	0	0	114.6	E574 E575 W579 I580 K581 R614	E574-E577 WeakPolarHBondContact O-CB 3.43Å; E574-E577 PolarHBondContact O-N 3.22Å; E575-E577 PolarHBondContact O-N 3.23Å; E577-W579 PolarHBondContact O-N 3.37Å; E577-I580 PolarHBondContact O-N 2.88Å; E577-K581 HydrophobicContact CG-CD 4.15Å; E577-K581 HydrophobicContact CG-CG 4.34Å; E577-K581 WeakPolarHBondContact O-CB 3.42Å; E577-K581 WeakPolarHBondContact O-CG 3.4Å; E577-K581 PolarHBondContact O-N 3.41Å; E577-K581 WeakPolarHBondContact OE1-CE 3.12Å; E577-K581 VanDerWaalsContact OE1-CG 3.24Å; E577-K581 WeakPolarHBondContact OE1-CG 3.25Å; E577-R614 VanDerWaalsContact CD-NH1 3.25Å; E577-R614 IonicContact OE1-CZ 3.23Å; E577-R614 IonicContact OE1-NH1 3.9Å; E577-R614 PolarHBondContact OE1-NH1 3.03Å; E577-R614 IonicContact OE1-NH2 3.67Å; E577-R614 PolarHBondContact OE1-NH2 3.46Å; E577-R614 IonicContact OE2-CZ 3.18Å; E577-R614 IonicContact OE2-NH1 3.25Å; E577-R614 PolarHBondContact OE2-NH1 3.19Å; E577-R614 IonicContact OE2-NH2 3.15Å
578	P	94.6	Very high	93.2	Very high	96 Å²	96	53.3 Å²	53.3	62%	0.623	26%	0.264	S	S	*	.	H	α-helix	trans	-59.7	-44.3	-179.5	-25	35.7	0	0	0	113.3	E575 K582	E575-P578 VanDerWaalsContact O-CD 3.23Å; E575-P578 WeakPolarHBondContact O-CD 3.23Å; P578-K582 PolarHBondContact O-N 3.08Å
579	W	96.3	Very high	93.3	Very high	36 Å²	36	55.2 Å²	55.2	14%	0.136	28%	0.276	C	S	.	.	H	α-helix	trans	-84.9	-29.1	-178.9	60.8	-103.9	0	0	0	111.9	N537 V542 I546 A569 P576 E577 K582 L583 A598	N537-W579 PolarHBondContact OD1-NE1 3.35Å; V542-W579 HydrophobicContact CG1-CD2 3.85Å; V542-W579 HydrophobicContact CG1-CE3 4.39Å; V542-W579 HydrophobicContact CG1-CG 3.95Å; V542-W579 HydrophobicContact CG1-CZ2 4.37Å; V542-W579 HydrophobicContact CG2-CZ2 4.27Å; I546-W579 HydrophobicContact CD1-CB 4.35Å; I546-W579 HydrophobicContact CD1-CE3 4.28Å; A569-W579 HydrophobicContact CB-CH2 3.85Å; A569-W579 HydrophobicContact CB-CZ2 3.99Å; P576-W579 VanDerWaalsContact CA-NE1 3.31Å; P576-W579 HydrophobicContact CB-CD2 4.29Å; P576-W579 HydrophobicContact CB-CH2 4.05Å; P576-W579 HydrophobicContact CB-CZ2 3.21Å; P576-W579 PolarHBondContact O-N 3.11Å; E577-W579 PolarHBondContact O-N 3.37Å; W579-K582 WeakPolarHBondContact O-CB 3.44Å; W579-K582 PolarHBondContact O-N 2.79Å; W579-L583 HydrophobicContact CE3-CD1 3.66Å; W579-L583 HydrophobicContact CE3-CG 4.48Å; W579-L583 HydrophobicContact CZ3-CD1 3.77Å; W579-L583 WeakPolarHBondContact O-CG 3.42Å; W579-L583 PolarHBondContact O-N 3.41Å; W579-A598 HydrophobicContact CH2-CB 3.46Å; W579-A598 VanDerWaalsContact CH2-CB 3.46Å; W579-A598 HydrophobicContact CZ3-CB 3.52Å
580	I	97.5	Very high	93.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-49.8	169.6	-72.1	171.7	0	0	0	110.4	P576 E577 K582 L583 L584 A598 L599	P576-I580 HydrophobicContact CB-CD1 3.6Å; P576-I580 HydrophobicContact CB-CG1 4.11Å; P576-I580 HydrophobicContact CG-CD1 3.66Å; P576-I580 WeakPolarHBondContact O-CB 3.06Å; P576-I580 VanDerWaalsContact O-CG1 3.3Å; P576-I580 WeakPolarHBondContact O-CG1 3.43Å; P576-I580 PolarHBondContact O-N 3.32Å; E577-I580 PolarHBondContact O-N 2.88Å; I580-K582 PolarHBondContact O-N 3.26Å; I580-L583 PolarHBondContact O-N 2.98Å; I580-L583 VanDerWaalsContact O-N 3.13Å; I580-L584 HydrophobicContact CG2-CD1 3.79Å; I580-L584 HydrophobicContact CG2-CG 4.22Å; I580-L584 WeakPolarHBondContact O-CG 3.42Å; I580-L584 PolarHBondContact O-N 3.26Å; I580-A598 HydrophobicContact CD1-CB 3.89Å; I580-A598 HydrophobicContact CG1-CB 3.74Å; I580-L599 HydrophobicContact CG2-CB 4.06Å; I580-L599 HydrophobicContact CG2-CD1 4.46Å
581	K	95.8	Very high	93.6	Very high	116 Å²	116	56.3 Å²	56.3	50%	0.504	28%	0.282	S	S	.	.	H	α-helix	trans	-57.7	-35.3	177.3	-76.6	178.1	177.6	173.4	0	112.5	E577 K585	E577-K581 HydrophobicContact CG-CD 4.15Å; E577-K581 HydrophobicContact CG-CG 4.34Å; E577-K581 WeakPolarHBondContact O-CB 3.42Å; E577-K581 WeakPolarHBondContact O-CG 3.4Å; E577-K581 PolarHBondContact O-N 3.41Å; E577-K581 WeakPolarHBondContact OE1-CE 3.12Å; E577-K581 VanDerWaalsContact OE1-CG 3.24Å; E577-K581 WeakPolarHBondContact OE1-CG 3.25Å; K581-K585 WeakPolarHBondContact O-CG 3.35Å
582	K	95.7	Very high	94.1	Very high	134 Å²	134	55.3 Å²	55.3	58%	0.583	26%	0.263	S	S	*	.	H	α-helix	trans	-68.4	-47.4	176.1	-173.3	-179.2	177.6	-174.9	0	111.1	P578 W579 I580 K585 D586	P578-K582 PolarHBondContact O-N 3.08Å; W579-K582 WeakPolarHBondContact O-CB 3.44Å; W579-K582 PolarHBondContact O-N 2.79Å; I580-K582 PolarHBondContact O-N 3.26Å; K582-K585 PolarHBondContact O-N 2.89Å; K582-D586 PolarHBondContact O-N 3.32Å
583	L	96.8	Very high	94.6	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-41.5	179.8	-71.9	179.2	0	0	0	112.5	I546 L565 W579 I580 K585 D586 L591 R592 A594	I546-L583 HydrophobicContact CD1-CD1 4.17Å; I546-L583 HydrophobicContact CD1-CD2 4.28Å; I546-L583 HydrophobicContact CD1-CG 4.35Å; I546-L583 HydrophobicContact CG1-CD2 4.31Å; I546-L583 HydrophobicContact CG2-CD2 4.35Å; L565-L583 HydrophobicContact CD1-CD1 4.13Å; W579-L583 HydrophobicContact CE3-CD1 3.66Å; W579-L583 HydrophobicContact CE3-CG 4.48Å; W579-L583 HydrophobicContact CZ3-CD1 3.77Å; W579-L583 WeakPolarHBondContact O-CG 3.42Å; W579-L583 PolarHBondContact O-N 3.41Å; I580-L583 PolarHBondContact O-N 2.98Å; I580-L583 VanDerWaalsContact O-N 3.13Å; L583-K585 PolarHBondContact O-N 3.04Å; L583-K585 VanDerWaalsContact O-N 3.16Å; L583-D586 VanDerWaalsContact O-CB 3.25Å; L583-D586 WeakPolarHBondContact O-CB 2.99Å; L583-D586 PolarHBondContact O-N 3Å; L583-L591 HydrophobicContact CD2-CB 4.18Å; L583-L591 HydrophobicContact CD2-CD2 4.38Å; L583-R592 WeakPolarHBondContact O-CA 3.4Å; L583-R592 WeakPolarHBondContact O-CG 3.49Å; L583-A594 HydrophobicContact CD1-CB 4.28Å
584	L	96.7	Very high	95	Very high	36 Å²	36	54.7 Å²	54.7	19%	0.188	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-20.9	178.4	-70.6	174.7	0	0	0	113.5	I580 R592 V596 I618	I580-L584 HydrophobicContact CG2-CD1 3.79Å; I580-L584 HydrophobicContact CG2-CG 4.22Å; I580-L584 WeakPolarHBondContact O-CG 3.42Å; I580-L584 PolarHBondContact O-N 3.26Å; L584-R592 VanDerWaalsContact O-CD 3.23Å; L584-R592 WeakPolarHBondContact O-CD 3.23Å; L584-V596 HydrophobicContact CD2-CG2 3.83Å; L584-I618 HydrophobicContact CD1-CD1 4.26Å; L584-I618 HydrophobicContact CD2-CD1 3.87Å
585	K	95.5	Very high	95.5	Very high	183 Å²	183	52 Å²	52	80%	0.796	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	2.9	177.4	-66.1	179.7	-179.7	-175.7	0	113.3	K581 K582 L583	K581-K585 WeakPolarHBondContact O-CG 3.35Å; K582-K585 PolarHBondContact O-N 2.89Å; L583-K585 PolarHBondContact O-N 3.04Å; L583-K585 VanDerWaalsContact O-N 3.16Å
586	D	95.4	Very high	95.9	Very high	39 Å²	39	48.1 Å²	48.1	21%	0.209	23%	0.229	C	C	.	.			trans	-70.8	151.8	-176.8	-159.2	-78.3	0	0	0	111.9	K582 L583 N588 L591 R592	K582-D586 PolarHBondContact O-N 3.32Å; L583-D586 VanDerWaalsContact O-CB 3.25Å; L583-D586 WeakPolarHBondContact O-CB 2.99Å; L583-D586 PolarHBondContact O-N 3Å; D586-N588 VanDerWaalsContact C-N 3.33Å; D586-N588 WeakPolarHBondContact OD1-CB 3.35Å; D586-N588 PolarHBondContact OD1-N 3.17Å; D586-L591 HydrophobicContact CB-CB 4.05Å; D586-R592 HydrophobicContact CB-CG 4.39Å; D586-R592 WeakPolarHBondContact O-CD 3.33Å; D586-R592 WeakPolarHBondContact O-CG 3.23Å; D586-R592 PolarHBondContact O-NH1 2.87Å
587	K	94	Very high	96.2	Very high	200 Å²	200	48.1 Å²	48.1	87%	0.87	23%	0.229	S	C	*	.	S	Bend	trans	-70	-33.3	177.1	-65.2	-177.6	-179.4	179.4	0	111.5	P589 R592	K587-P589 WeakPolarHBondContact O-CD 3.08Å; K587-R592 PolarHBondContact O-NH1 3.13Å
588	N	95	Very high	96.4	Very high	50 Å²	50	47.1 Å²	47.1	27%	0.267	22%	0.224	S	C	.	.	S	Bend	trans	-77.1	119.6	-179.2	-172.1	-22.6	0	0	0	110.8	D586 L590 L591 R592	D586-N588 VanDerWaalsContact C-N 3.33Å; D586-N588 WeakPolarHBondContact OD1-CB 3.35Å; D586-N588 PolarHBondContact OD1-N 3.17Å; N588-L590 VanDerWaalsContact C-N 3.25Å; N588-L590 PolarHBondContact O-N 3.37Å; N588-L590 WeakPolarHBondContact OD1-CB 3.5Å; N588-L590 PolarHBondContact OD1-N 2.99Å; N588-L591 HydrophobicContact CB-CB 4.29Å; N588-L591 HydrophobicContact CB-CD1 4.13Å; N588-L591 HydrophobicContact CB-CG 4.14Å; N588-L591 PolarHBondContact O-N 2.95Å; N588-L591 VanDerWaalsContact O-N 3.15Å; N588-R592 PolarHBondContact O-N 3.37Å; N588-R592 VanDerWaalsContact O-N 3.09Å
589	P	96.2	Very high	96.5	Very high	40 Å²	40	42.6 Å²	42.6	26%	0.26	20%	0.195	S	C	.	.	H	α-helix	trans	-58.3	-32.7	178.4	-23.1	33.5	0	0	0	114.1	K587 L591 R592 R593 N624 V627	K587-P589 WeakPolarHBondContact O-CD 3.08Å; P589-L591 VanDerWaalsContact C-N 3.34Å; P589-L591 PolarHBondContact O-N 2.66Å; P589-R592 PolarHBondContact O-N 2.87Å; P589-R593 WeakPolarHBondContact O-CB 3.23Å; P589-R593 PolarHBondContact O-N 3.34Å; P589-N624 HydrophobicContact CB-CB 3.89Å; P589-N624 HydrophobicContact CG-CB 4.2Å; P589-V627 HydrophobicContact CB-CG2 3.99Å; P589-V627 VanDerWaalsContact O-CG2 3.31Å; P589-V627 WeakPolarHBondContact O-CG2 3.42Å
590	L	95.4	Very high	96.5	Very high	24 Å²	24	40.9 Å²	40.9	13%	0.126	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-35.8	179.1	-67	173.7	0	0	0	111.9	E555 L558 R559 N588 R593 A594	E555-L590 HydrophobicContact CB-CD1 4.11Å; E555-L590 HydrophobicContact CG-CD1 4.23Å; L558-L590 HydrophobicContact CB-CB 4.23Å; L558-L590 HydrophobicContact CB-CD1 3.65Å; L558-L590 HydrophobicContact CD1-CD1 3.81Å; L558-L590 HydrophobicContact CG-CD1 4.38Å; R559-L590 HydrophobicContact CG-CD2 4.23Å; N588-L590 VanDerWaalsContact C-N 3.25Å; N588-L590 PolarHBondContact O-N 3.37Å; N588-L590 WeakPolarHBondContact OD1-CB 3.5Å; N588-L590 PolarHBondContact OD1-N 2.99Å; L590-R593 VanDerWaalsContact CD2-NH2 3.29Å; L590-R593 PolarHBondContact O-N 3.24Å; L590-A594 PolarHBondContact O-N 3.26Å
591	L	96	Very high	96.4	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-72.6	-39.4	174.5	-67	-179	0	0	0	111.3	M550 L583 D586 N588 P589 R593 A594 G595	M550-L591 HydrophobicContact CE-CD1 4.41Å; M550-L591 HydrophobicContact CG-CD1 3.93Å; L583-L591 HydrophobicContact CD2-CB 4.18Å; L583-L591 HydrophobicContact CD2-CD2 4.38Å; D586-L591 HydrophobicContact CB-CB 4.05Å; N588-L591 HydrophobicContact CB-CB 4.29Å; N588-L591 HydrophobicContact CB-CD1 4.13Å; N588-L591 HydrophobicContact CB-CG 4.14Å; N588-L591 PolarHBondContact O-N 2.95Å; N588-L591 VanDerWaalsContact O-N 3.15Å; P589-L591 VanDerWaalsContact C-N 3.34Å; P589-L591 PolarHBondContact O-N 2.66Å; L591-R593 VanDerWaalsContact C-N 3.29Å; L591-R593 PolarHBondContact O-N 2.75Å; L591-A594 VanDerWaalsContact O-CB 3.28Å; L591-A594 WeakPolarHBondContact O-CB 3.34Å; L591-A594 PolarHBondContact O-N 2.91Å; L591-A594 VanDerWaalsContact O-N 3.13Å; L591-G595 PolarHBondContact O-N 2.69Å
592	R	97.6	Very high	96.3	Very high	26 Å²	26	35.4 Å²	35.4	10%	0.098	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-42.7	171.2	-65.5	-158.3	-59.2	-79.1	2.6	111.7	L583 L584 D586 K587 N588 P589 A594 G595 V596 D622 V627	L583-R592 WeakPolarHBondContact O-CA 3.4Å; L583-R592 WeakPolarHBondContact O-CG 3.49Å; L584-R592 VanDerWaalsContact O-CD 3.23Å; L584-R592 WeakPolarHBondContact O-CD 3.23Å; D586-R592 HydrophobicContact CB-CG 4.39Å; D586-R592 WeakPolarHBondContact O-CD 3.33Å; D586-R592 WeakPolarHBondContact O-CG 3.23Å; D586-R592 PolarHBondContact O-NH1 2.87Å; K587-R592 PolarHBondContact O-NH1 3.13Å; N588-R592 PolarHBondContact O-N 3.37Å; N588-R592 VanDerWaalsContact O-N 3.09Å; P589-R592 PolarHBondContact O-N 2.87Å; R592-A594 VanDerWaalsContact C-N 3.31Å; R592-A594 PolarHBondContact O-N 2.92Å; R592-G595 CarbonylContact O-C 3.58Å; R592-G595 WeakPolarHBondContact O-CA 3.29Å; R592-G595 PolarHBondContact O-N 3.28Å; R592-V596 PolarHBondContact O-N 3.48Å; R592-D622 IonicContact CZ-OD1 3.72Å; R592-D622 IonicContact CZ-OD2 2.7Å; R592-D622 IonicContact NE-OD1 3.36Å; R592-D622 IonicContact NE-OD2 3.72Å; R592-D622 PolarHBondContact NE-OD2 3Å; R592-D622 IonicContact NH2-OD1 3.22Å; R592-D622 PolarHBondContact NH2-OD1 2.91Å; R592-D622 IonicContact NH2-OD2 3.15Å; R592-V627 HydrophobicContact CB-CG1 4.4Å; R592-V627 HydrophobicContact CB-CG2 4.29Å
593	R	96.8	Very high	96.2	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-62.1	-37.2	174.3	-168.4	173.5	68	-173	7	112.7	C562 P589 L590 L591 G595 V596 Y597 V627 A630 Y784	C562-R593 PolarHBondContact SG-NE 3.47Å; P589-R593 WeakPolarHBondContact O-CB 3.23Å; P589-R593 PolarHBondContact O-N 3.34Å; L590-R593 VanDerWaalsContact CD2-NH2 3.29Å; L590-R593 PolarHBondContact O-N 3.24Å; L591-R593 VanDerWaalsContact C-N 3.29Å; L591-R593 PolarHBondContact O-N 2.75Å; R593-G595 VanDerWaalsContact C-N 3.28Å; R593-G595 PolarHBondContact O-N 3.18Å; R593-V596 WeakPolarHBondContact O-CB 3.2Å; R593-V596 PolarHBondContact O-N 2.97Å; R593-V596 VanDerWaalsContact O-N 3.13Å; R593-Y597 HydrophobicContact CG-CD2 4.23Å; R593-Y597 HydrophobicContact CG-CE1 4.36Å; R593-Y597 HydrophobicContact CG-CE2 3.76Å; R593-Y597 PolarHBondContact O-N 2.87Å; R593-V627 HydrophobicContact CB-CG2 4.3Å; R593-A630 HydrophobicContact CG-CB 3.66Å; R593-Y784 PolarHBondContact NH1-OH 3.46Å
594	A	96.9	Very high	95.9	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-60	-41.6	171.8	0	0	0	0	0	111.2	C562 L565 L583 L590 L591 R592 V596 Y597 A598	C562-A594 HydrophobicContact CB-CB 3.99Å; C562-A594 VanDerWaalsContact SG-CA 3.56Å; C562-A594 PolarHBondContact SG-N 2.9Å; L565-A594 HydrophobicContact CD1-CB 4.1Å; L583-A594 HydrophobicContact CD1-CB 4.28Å; L590-A594 PolarHBondContact O-N 3.26Å; L591-A594 VanDerWaalsContact O-CB 3.28Å; L591-A594 WeakPolarHBondContact O-CB 3.34Å; L591-A594 PolarHBondContact O-N 2.91Å; L591-A594 VanDerWaalsContact O-N 3.13Å; R592-A594 VanDerWaalsContact C-N 3.31Å; R592-A594 PolarHBondContact O-N 2.92Å; A594-V596 VanDerWaalsContact C-N 3.34Å; A594-V596 PolarHBondContact O-N 2.96Å; A594-Y597 PolarHBondContact O-N 3.39Å; A594-A598 VanDerWaalsContact O-CB 3.24Å; A594-A598 WeakPolarHBondContact O-CB 3.39Å; A594-A598 PolarHBondContact O-N 3.42Å
595	G	97.7	Very high	95.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.4	-41.3	171.6	0	0	0	0	0	113	L591 R592 R593 L599	L591-G595 PolarHBondContact O-N 2.69Å; R592-G595 CarbonylContact O-C 3.58Å; R592-G595 WeakPolarHBondContact O-CA 3.29Å; R592-G595 PolarHBondContact O-N 3.28Å; R593-G595 VanDerWaalsContact C-N 3.28Å; R593-G595 PolarHBondContact O-N 3.18Å; G595-L599 VanDerWaalsContact O-CB 3.27Å; G595-L599 WeakPolarHBondContact O-CB 3.46Å; G595-L599 PolarHBondContact O-N 3.09Å
596	V	98.4	Very high	95.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.4	-49.7	176.2	172	0	0	0	0	111.7	L584 R592 R593 A594 L599 A600 L615 I618 V627 A630 A631 C634	L584-V596 HydrophobicContact CD2-CG2 3.83Å; R592-V596 PolarHBondContact O-N 3.48Å; R593-V596 WeakPolarHBondContact O-CB 3.2Å; R593-V596 PolarHBondContact O-N 2.97Å; R593-V596 VanDerWaalsContact O-N 3.13Å; A594-V596 VanDerWaalsContact C-N 3.34Å; A594-V596 PolarHBondContact O-N 2.96Å; V596-L599 PolarHBondContact O-N 3.06Å; V596-A600 WeakPolarHBondContact O-CB 3.35Å; V596-A600 PolarHBondContact O-N 3.3Å; V596-L615 HydrophobicContact CG1-CD2 3.91Å; V596-I618 HydrophobicContact CG2-CD1 4.27Å; V596-I618 HydrophobicContact CG2-CG2 4.04Å; V596-V627 HydrophobicContact CG2-CG1 3.99Å; V596-A630 HydrophobicContact CG1-CB 4.09Å; V596-A631 HydrophobicContact CG1-CB 4.06Å; V596-C634 HydrophobicContact CG1-CB 4.31Å
597	Y	98.1	Very high	94.5	Very high	1 Å²	1	21.2 Å²	21.2	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-63.1	-44.4	178	-65.6	-31.5	0	0	0	111.6	C562 V563 R593 A594 L599 A600 M601 A630 L777 Q781	C562-Y597 WeakPolarHBondContact SG-CD2 3.35Å; C562-Y597 WeakPolarHBondContact SG-CE2 3.43Å; V563-Y597 HydrophobicContact CG2-CE2 4.39Å; R593-Y597 HydrophobicContact CG-CD2 4.23Å; R593-Y597 HydrophobicContact CG-CE1 4.36Å; R593-Y597 HydrophobicContact CG-CE2 3.76Å; R593-Y597 PolarHBondContact O-N 2.87Å; A594-Y597 PolarHBondContact O-N 3.39Å; Y597-L599 VanDerWaalsContact C-N 3.33Å; Y597-L599 PolarHBondContact O-N 3.39Å; Y597-A600 PolarHBondContact O-N 3.49Å; Y597-M601 WeakPolarHBondContact O-CB 3.41Å; Y597-M601 WeakPolarHBondContact O-CG 3.22Å; Y597-M601 PolarHBondContact O-N 3Å; Y597-A630 HydrophobicContact CD1-CB 4.35Å; Y597-A630 HydrophobicContact CE1-CB 3.59Å; Y597-L777 HydrophobicContact CD1-CD1 3.73Å; Y597-L777 HydrophobicContact CE1-CD1 4.12Å; Y597-L777 HydrophobicContact CG-CD1 3.96Å; Y597-Q781 PolarHBondContact OH-NE2 3.43Å; Y597-Q781 VanDerWaalsContact OH-NE2 3.12Å; Y597-Q781 PolarHBondContact OH-OE1 3.28Å
598	A	97.8	Very high	94.1	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60	-42.6	176	0	0	0	0	0	112.3	A569 W579 I580 A594 A602	A569-A598 HydrophobicContact CB-CB 3.94Å; W579-A598 HydrophobicContact CH2-CB 3.46Å; W579-A598 VanDerWaalsContact CH2-CB 3.46Å; W579-A598 HydrophobicContact CZ3-CB 3.52Å; I580-A598 HydrophobicContact CD1-CB 3.89Å; I580-A598 HydrophobicContact CG1-CB 3.74Å; A594-A598 VanDerWaalsContact O-CB 3.24Å; A594-A598 WeakPolarHBondContact O-CB 3.39Å; A594-A598 PolarHBondContact O-N 3.42Å; A598-A602 WeakPolarHBondContact O-CB 3.13Å; A598-A602 PolarHBondContact O-N 3.27Å
599	L	97.4	Very high	93.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61	-46.6	175.4	-179.5	63.6	0	0	0	111.7	I580 G595 V596 Y597 Y603 T611 R614 L615	I580-L599 HydrophobicContact CG2-CB 4.06Å; I580-L599 HydrophobicContact CG2-CD1 4.46Å; G595-L599 VanDerWaalsContact O-CB 3.27Å; G595-L599 WeakPolarHBondContact O-CB 3.46Å; G595-L599 PolarHBondContact O-N 3.09Å; V596-L599 PolarHBondContact O-N 3.06Å; Y597-L599 VanDerWaalsContact C-N 3.33Å; Y597-L599 PolarHBondContact O-N 3.39Å; L599-Y603 HydrophobicContact CD1-CD2 3.89Å; L599-Y603 HydrophobicContact CD1-CE2 3.94Å; L599-Y603 WeakPolarHBondContact O-CD2 3.31Å; L599-Y603 PolarHBondContact O-N 3.35Å; L599-T611 HydrophobicContact CD1-CG2 3.93Å; L599-T611 HydrophobicContact CD2-CG2 4.26Å; L599-T611 HydrophobicContact CG-CG2 3.79Å; L599-R614 HydrophobicContact CD2-CB 4.24Å; L599-L615 HydrophobicContact CD2-CD2 4.08Å; L599-L615 HydrophobicContact CD2-CG 4.33Å
600	A	96.4	Very high	93.4	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-66.7	-43.7	-178.5	0	0	0	0	0	112.6	V596 Y597 Y603 C604 C634 V638	V596-A600 WeakPolarHBondContact O-CB 3.35Å; V596-A600 PolarHBondContact O-N 3.3Å; Y597-A600 PolarHBondContact O-N 3.49Å; A600-Y603 CarbonylContact O-C 3.6Å; A600-Y603 PolarHBondContact O-N 3.02Å; A600-C604 WeakPolarHBondContact O-CA 3.44Å; A600-C604 PolarHBondContact O-N 3.3Å; A600-C634 HydrophobicContact CB-CB 3.4Å; A600-C634 VanDerWaalsContact CB-CB 3.4Å; A600-C634 WeakPolarHBondContact CB-SG 2.98Å; A600-V638 HydrophobicContact CB-CG2 4.44Å
601	M	95.5	Very high	93.3	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-71.3	-34.6	-179.5	-65.2	-56.4	-60.8	0	0	112.3	G566 C570 G571 Y597 Y603 C604 F637 A773 L777	G566-M601 WeakPolarHBondContact O-CB 3.27Å; C570-M601 WeakPolarHBondContact CA-O 3.24Å; C570-M601 HydrophobicContact CB-CB 4.27Å; C570-M601 HydrophobicContact CB-CE 4.03Å; C570-M601 WeakPolarHBondContact SG-CE 3.38Å; G571-M601 PolarHBondContact N-O 3.46Å; G571-M601 VanDerWaalsContact N-O 3.1Å; Y597-M601 WeakPolarHBondContact O-CB 3.41Å; Y597-M601 WeakPolarHBondContact O-CG 3.22Å; Y597-M601 PolarHBondContact O-N 3Å; M601-Y603 VanDerWaalsContact C-N 3.26Å; M601-Y603 PolarHBondContact O-N 2.82Å; M601-C604 PolarHBondContact O-N 2.86Å; M601-F637 HydrophobicContact SD-CD1 4.34Å; M601-F637 HydrophobicContact SD-CE1 4.45Å; M601-A773 HydrophobicContact CE-CB 3.49Å; M601-A773 VanDerWaalsContact CE-CB 3.49Å; M601-L777 HydrophobicContact CG-CD2 3.74Å; M601-L777 HydrophobicContact SD-CB 4.14Å; M601-L777 HydrophobicContact SD-CD1 4.43Å; M601-L777 HydrophobicContact SD-CD2 3.91Å; M601-L777 HydrophobicContact SD-CG 4.38Å
602	A	93.4	Very high	93.2	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-61.1	-37.7	174.1	0	0	0	0	0	112.2	A569 L573 P576 A598	A569-A602 HydrophobicContact CB-CB 4.45Å; A569-A602 WeakPolarHBondContact O-CA 3.04Å; L573-A602 WeakPolarHBondContact CA-O 3.39Å; L573-A602 PolarHBondContact N-O 2.94Å; L573-A602 VanDerWaalsContact N-O 3.14Å; P576-A602 HydrophobicContact CG-CB 3.77Å; A598-A602 WeakPolarHBondContact O-CB 3.13Å; A598-A602 PolarHBondContact O-N 3.27Å
603	Y	92.8	Very high	93	Very high	22 Å²	22	16.1 Å²	16.1	9%	0.086	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	22	-178.7	-69.1	-78.8	0	0	0	113.5	L573 E574 L599 A600 M601 G605 T606 N608 T611	L573-Y603 HydrophobicContact CB-CE1 4.38Å; L573-Y603 HydrophobicContact CD2-CD1 3.97Å; L573-Y603 HydrophobicContact CD2-CE1 4.22Å; E574-Y603 WeakPolarHBondContact CA-OH 3.32Å; L599-Y603 HydrophobicContact CD1-CD2 3.89Å; L599-Y603 HydrophobicContact CD1-CE2 3.94Å; L599-Y603 WeakPolarHBondContact O-CD2 3.31Å; L599-Y603 PolarHBondContact O-N 3.35Å; A600-Y603 CarbonylContact O-C 3.6Å; A600-Y603 PolarHBondContact O-N 3.02Å; M601-Y603 VanDerWaalsContact C-N 3.26Å; M601-Y603 PolarHBondContact O-N 2.82Å; Y603-G605 PolarHBondContact O-N 2.73Å; Y603-T606 HydrophobicContact CD1-CG2 4.28Å; Y603-T606 WeakPolarHBondContact O-CB 3.33Å; Y603-T606 WeakPolarHBondContact O-CG2 3.4Å; Y603-T606 PolarHBondContact O-N 2.89Å; Y603-T606 VanDerWaalsContact O-N 3.15Å; Y603-T606 PolarHBondContact O-OG1 3.28Å; Y603-N608 HydrophobicContact CD1-CB 4.35Å; Y603-T611 HydrophobicContact CD2-CG2 3.97Å; Y603-T611 WeakPolarHBondContact CD2-OG1 3.42Å; Y603-T611 HydrophobicContact CG-CG2 4.12Å
604	C	91.8	Very high	93	Very high	11 Å²	11	19 Å²	19	7%	0.074	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	130.3	-178.7	-170.9	0	0	0	0	110.1	A600 M601 T606 V768	A600-C604 WeakPolarHBondContact O-CA 3.44Å; A600-C604 PolarHBondContact O-N 3.3Å; M601-C604 PolarHBondContact O-N 2.86Å; C604-T606 PolarHBondContact O-N 3.47Å; C604-T606 VanDerWaalsContact O-N 3.12Å; C604-V768 HydrophobicContact CB-CG1 4.13Å; C604-V768 WeakPolarHBondContact O-CG2 3.43Å
605	G	88.3	Confident	93	Very high	3 Å²	3	18.9 Å²	18.9	3%	0.031	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	23.2	-177.9	0	0	0	0	0	116.1	Y603 F637 K641	Y603-G605 PolarHBondContact O-N 2.73Å; G605-F637 PolarHBondContact N-O 3.11Å; G605-K641 WeakPolarHBondContact O-CD 3.5Å; G605-K641 WeakPolarHBondContact O-CE 3.46Å; G605-K641 WeakPolarHBondContact O-CG 3.22Å
606	T	85.6	Confident	92.9	Very high	40 Å²	40	20.9 Å²	20.9	25%	0.245	13%	0.132	C	C	.	.			trans	-84.5	-19.7	173.6	61.1	0	0	0	0	113.2	L573 Y603 C604 N608	L573-T606 HydrophobicContact CD2-CG2 3.54Å; Y603-T606 HydrophobicContact CD1-CG2 4.28Å; Y603-T606 WeakPolarHBondContact O-CB 3.33Å; Y603-T606 WeakPolarHBondContact O-CG2 3.4Å; Y603-T606 PolarHBondContact O-N 2.89Å; Y603-T606 VanDerWaalsContact O-N 3.15Å; Y603-T606 PolarHBondContact O-OG1 3.28Å; C604-T606 PolarHBondContact O-N 3.47Å; C604-T606 VanDerWaalsContact O-N 3.12Å; T606-N608 PolarHBondContact O-N 2.9Å; T606-N608 WeakPolarHBondContact OG1-CB 3.5Å; T606-N608 PolarHBondContact OG1-N 3.23Å
607	G	84.5	Confident	92.8	Very high	18 Å²	18	26.6 Å²	26.6	19%	0.186	16%	0.157	C	C	.	.			trans	62.3	18.8	-172.1	0	0	0	0	0	113.6	S609 V638	G607-S609 PolarHBondContact O-N 3.37Å; G607-S609 VanDerWaalsContact O-N 3.1Å; G607-V638 PolarHBondContact N-O 3.38Å
608	N	85.4	Confident	92.7	Very high	13 Å²	13	27.5 Å²	27.5	7%	0.07	16%	0.162	C	C	.	.			trans	-66.5	111.8	-175.7	-175.6	-23.9	0	0	0	111	Q192 Y603 T606 T610 T611 A612	Q192-N608 PolarHBondContact OE1-ND2 3.04Å; Q192-N608 VanDerWaalsContact OE1-ND2 3.15Å; Y603-N608 HydrophobicContact CD1-CB 4.35Å; T606-N608 PolarHBondContact O-N 2.9Å; T606-N608 WeakPolarHBondContact OG1-CB 3.5Å; T606-N608 PolarHBondContact OG1-N 3.23Å; N608-T610 VanDerWaalsContact C-N 3.28Å; N608-T610 PolarHBondContact O-N 2.88Å; N608-T610 WeakPolarHBondContact OD1-CA 3.48Å; N608-T610 VanDerWaalsContact OD1-CB 3.23Å; N608-T610 WeakPolarHBondContact OD1-CB 3.28Å; N608-T610 PolarHBondContact OD1-N 3.43Å; N608-T611 PolarHBondContact O-N 3.36Å; N608-T611 PolarHBondContact OD1-N 3.3Å; N608-A612 PolarHBondContact O-N 3.08Å
609	S	86.3	Confident	92.6	Very high	93 Å²	93	27.7 Å²	27.7	65%	0.65	16%	0.163	S	C	*	.	H	α-helix	trans	-63.1	-30.6	179.5	57.3	0	0	0	0	113.4	G607 G613	G607-S609 PolarHBondContact O-N 3.37Å; G607-S609 VanDerWaalsContact O-N 3.1Å; S609-G613 PolarHBondContact O-N 2.88Å
610	T	89.6	Confident	92.4	Very high	93 Å²	93	32.6 Å²	32.6	57%	0.571	19%	0.193	S	C	*	.	H	α-helix	trans	-67.4	-44.5	175.1	-55.3	0	0	0	0	110.2	N608 G613 R614	N608-T610 VanDerWaalsContact C-N 3.28Å; N608-T610 PolarHBondContact O-N 2.88Å; N608-T610 WeakPolarHBondContact OD1-CA 3.48Å; N608-T610 VanDerWaalsContact OD1-CB 3.23Å; N608-T610 WeakPolarHBondContact OD1-CB 3.28Å; N608-T610 PolarHBondContact OD1-N 3.43Å; T610-G613 PolarHBondContact O-N 3.45Å; T610-R614 VanDerWaalsContact O-CG 3.26Å; T610-R614 WeakPolarHBondContact O-CG 3.39Å; T610-R614 PolarHBondContact O-N 3.01Å
611	T	93.1	Very high	92.2	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-43.5	177.2	-58.4	0	0	0	0	111.4	L599 Y603 N608 G613 R614 L615 V638	L599-T611 HydrophobicContact CD1-CG2 3.93Å; L599-T611 HydrophobicContact CD2-CG2 4.26Å; L599-T611 HydrophobicContact CG-CG2 3.79Å; Y603-T611 HydrophobicContact CD2-CG2 3.97Å; Y603-T611 WeakPolarHBondContact CD2-OG1 3.42Å; Y603-T611 HydrophobicContact CG-CG2 4.12Å; N608-T611 PolarHBondContact O-N 3.36Å; N608-T611 PolarHBondContact OD1-N 3.3Å; T611-G613 VanDerWaalsContact C-N 3.34Å; T611-G613 PolarHBondContact O-N 2.86Å; T611-R614 PolarHBondContact O-N 3.35Å; T611-L615 HydrophobicContact CG2-CD1 4.38Å; T611-L615 WeakPolarHBondContact O-CG 3.3Å; T611-L615 PolarHBondContact O-N 2.76Å; T611-V638 HydrophobicContact CG2-CG1 4.46Å; T611-V638 HydrophobicContact CG2-CG2 4.11Å
612	A	93.9	Very high	92.3	Very high	3 Å²	3	39.5 Å²	39.5	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-58.9	-45.1	173.7	0	0	0	0	0	111.5	N608 R614 L615 L616 L635 M639 L649	N608-A612 PolarHBondContact O-N 3.08Å; A612-R614 VanDerWaalsContact C-N 3.35Å; A612-R614 PolarHBondContact O-N 3.28Å; A612-L615 PolarHBondContact O-N 3.44Å; A612-L616 WeakPolarHBondContact O-CB 3.44Å; A612-L616 WeakPolarHBondContact O-CG 3.47Å; A612-L616 PolarHBondContact O-N 2.75Å; A612-L635 HydrophobicContact CB-CD2 4.11Å; A612-M639 HydrophobicContact CB-SD 4.18Å; A612-L649 HydrophobicContact CB-CD1 4.32Å
613	G	94.2	Very high	92.4	Very high	35 Å²	35	45.5 Å²	45.5	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-60.2	-40.5	175.2	0	0	0	0	0	113.1	S609 T610 T611 L616 F617	S609-G613 PolarHBondContact O-N 2.88Å; T610-G613 PolarHBondContact O-N 3.45Å; T611-G613 VanDerWaalsContact C-N 3.34Å; T611-G613 PolarHBondContact O-N 2.86Å; G613-L616 PolarHBondContact O-N 3.22Å; G613-F617 WeakPolarHBondContact O-CB 3.44Å; G613-F617 PolarHBondContact O-N 2.85Å
614	R	95.7	Very high	92.7	Very high	62 Å²	62	46.8 Å²	46.8	23%	0.234	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-44.2	174.6	-72.2	168.2	65.5	-178.1	7.7	112.2	E577 L599 T610 T611 A612 F617 I618	E577-R614 VanDerWaalsContact CD-NH1 3.25Å; E577-R614 IonicContact OE1-CZ 3.23Å; E577-R614 IonicContact OE1-NH1 3.9Å; E577-R614 PolarHBondContact OE1-NH1 3.03Å; E577-R614 IonicContact OE1-NH2 3.67Å; E577-R614 PolarHBondContact OE1-NH2 3.46Å; E577-R614 IonicContact OE2-CZ 3.18Å; E577-R614 IonicContact OE2-NH1 3.25Å; E577-R614 PolarHBondContact OE2-NH1 3.19Å; E577-R614 IonicContact OE2-NH2 3.15Å; L599-R614 HydrophobicContact CD2-CB 4.24Å; T610-R614 VanDerWaalsContact O-CG 3.26Å; T610-R614 WeakPolarHBondContact O-CG 3.39Å; T610-R614 PolarHBondContact O-N 3.01Å; T611-R614 PolarHBondContact O-N 3.35Å; A612-R614 VanDerWaalsContact C-N 3.35Å; A612-R614 PolarHBondContact O-N 3.28Å; R614-F617 PolarHBondContact O-N 2.82Å; R614-I618 WeakPolarHBondContact O-CD1 3.4Å; R614-I618 VanDerWaalsContact O-CG1 3.23Å; R614-I618 WeakPolarHBondContact O-CG1 3.35Å; R614-I618 PolarHBondContact O-N 3.06Å
615	L	97.6	Very high	92.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-42	177.1	-71	173.7	0	0	0	111.4	V596 L599 T611 A612 I618 S619 A631 C634 L635 V638	V596-L615 HydrophobicContact CG1-CD2 3.91Å; L599-L615 HydrophobicContact CD2-CD2 4.08Å; L599-L615 HydrophobicContact CD2-CG 4.33Å; T611-L615 HydrophobicContact CG2-CD1 4.38Å; T611-L615 WeakPolarHBondContact O-CG 3.3Å; T611-L615 PolarHBondContact O-N 2.76Å; A612-L615 PolarHBondContact O-N 3.44Å; L615-I618 PolarHBondContact O-N 2.9Å; L615-S619 PolarHBondContact O-N 3.28Å; L615-A631 HydrophobicContact CD2-CB 4.46Å; L615-C634 HydrophobicContact CD1-CB 4.02Å; L615-C634 HydrophobicContact CD2-CB 4.13Å; L615-L635 HydrophobicContact CB-CD2 3.68Å; L615-L635 HydrophobicContact CB-CG 4.25Å; L615-L635 HydrophobicContact CD1-CD2 4.02Å; L615-V638 HydrophobicContact CD1-CG2 3.82Å
616	L	95.6	Very high	93.3	Very high	41 Å²	41	51.2 Å²	51.2	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-45.4	173.4	-74	169	0	0	0	111.4	A612 G613 I618 S619 V620 L635 L649 L653	A612-L616 WeakPolarHBondContact O-CB 3.44Å; A612-L616 WeakPolarHBondContact O-CG 3.47Å; A612-L616 PolarHBondContact O-N 2.75Å; G613-L616 PolarHBondContact O-N 3.22Å; L616-I618 PolarHBondContact O-N 3.43Å; L616-S619 WeakPolarHBondContact O-CB 3.36Å; L616-S619 PolarHBondContact O-N 2.48Å; L616-S619 VanDerWaalsContact O-N 3.14Å; L616-S619 PolarHBondContact O-OG 2.7Å; L616-V620 PolarHBondContact O-N 2.98Å; L616-L635 HydrophobicContact CD2-CD1 3.62Å; L616-L635 HydrophobicContact CG-CD1 4.11Å; L616-L635 HydrophobicContact CG-CD2 4.22Å; L616-L649 HydrophobicContact CD1-CD2 4.1Å; L616-L653 HydrophobicContact CD2-CD1 3.77Å
617	F	95.8	Very high	93.9	Very high	121 Å²	121	49.3 Å²	49.3	53%	0.531	28%	0.281	S	S	.	.	H	α-helix	trans	-60	-46.3	177.2	-177.2	-107.2	0	0	0	111.9	G613 R614 S619 V620 E621	G613-F617 WeakPolarHBondContact O-CB 3.44Å; G613-F617 PolarHBondContact O-N 2.85Å; R614-F617 PolarHBondContact O-N 2.82Å; F617-S619 VanDerWaalsContact C-N 3.26Å; F617-S619 PolarHBondContact O-N 3.13Å; F617-V620 PolarHBondContact O-N 3.1Å; F617-V620 VanDerWaalsContact O-N 3.11Å; F617-E621 HydrophobicContact CE1-CB 4.31Å; F617-E621 VanDerWaalsContact CE1-CD 3.47Å; F617-E621 HydrophobicContact CE1-CG 4.43Å; F617-E621 WeakPolarHBondContact CE1-OE2 3.24Å; F617-E621 HydrophobicContact CZ-CB 4.26Å; F617-E621 VanDerWaalsContact CZ-CD 3.43Å; F617-E621 HydrophobicContact CZ-CG 4.22Å; F617-E621 VanDerWaalsContact CZ-OE2 3.3Å; F617-E621 WeakPolarHBondContact CZ-OE2 3.47Å; F617-E621 WeakPolarHBondContact O-CB 3.23Å; F617-E621 PolarHBondContact O-N 3.28Å
618	I	96.6	Very high	94.5	Very high	20 Å²	20	51.2 Å²	51.2	10%	0.103	28%	0.283	C	S	.	.	H	α-helix	trans	-59.7	-37.7	175.7	-66.6	161.6	0	0	0	111.3	L584 V596 R614 L615 L616 V620 D622 V627 A631	L584-I618 HydrophobicContact CD1-CD1 4.26Å; L584-I618 HydrophobicContact CD2-CD1 3.87Å; V596-I618 HydrophobicContact CG2-CD1 4.27Å; V596-I618 HydrophobicContact CG2-CG2 4.04Å; R614-I618 WeakPolarHBondContact O-CD1 3.4Å; R614-I618 VanDerWaalsContact O-CG1 3.23Å; R614-I618 WeakPolarHBondContact O-CG1 3.35Å; R614-I618 PolarHBondContact O-N 3.06Å; L615-I618 PolarHBondContact O-N 2.9Å; L616-I618 PolarHBondContact O-N 3.43Å; I618-V620 PolarHBondContact O-N 2.96Å; I618-D622 HydrophobicContact CG2-CB 4.3Å; I618-D622 WeakPolarHBondContact O-CB 3.37Å; I618-D622 PolarHBondContact O-N 3.37Å; I618-D622 VanDerWaalsContact O-N 3.11Å; I618-V627 HydrophobicContact CG2-CG1 3.93Å; I618-A631 HydrophobicContact CB-CB 4.13Å; I618-A631 HydrophobicContact CG2-CB 3.83Å
619	S	94.8	Very high	95.1	Very high	4 Å²	4	50.7 Å²	50.7	3%	0.028	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-25.7	179.2	80.2	0	0	0	0	113.9	L615 L616 F617 R628 V632	L615-S619 PolarHBondContact O-N 3.28Å; L616-S619 WeakPolarHBondContact O-CB 3.36Å; L616-S619 PolarHBondContact O-N 2.48Å; L616-S619 VanDerWaalsContact O-N 3.14Å; L616-S619 PolarHBondContact O-OG 2.7Å; F617-S619 VanDerWaalsContact C-N 3.26Å; F617-S619 PolarHBondContact O-N 3.13Å; S619-R628 WeakPolarHBondContact O-CD 3.23Å; S619-R628 WeakPolarHBondContact O-CG 3.37Å; S619-V632 VanDerWaalsContact CB-CG2 3.44Å
620	V	93.3	Very high	95.6	Very high	103 Å²	103	46.3 Å²	46.3	62%	0.624	25%	0.249	S	C	*	.	H	α-helix	trans	-95.4	-44.7	179.7	179.3	0	0	0	0	111.3	L616 F617 I618 R628	L616-V620 PolarHBondContact O-N 2.98Å; F617-V620 PolarHBondContact O-N 3.1Å; F617-V620 VanDerWaalsContact O-N 3.11Å; I618-V620 PolarHBondContact O-N 2.96Å; V620-R628 PolarHBondContact O-NH2 3.1Å
621	E	93.6	Very high	96	Very high	126 Å²	126	41.9 Å²	41.9	59%	0.589	22%	0.222	S	C	*	.	H	α-helix	trans	-80.6	-39.8	-170.7	-166.8	-168.8	-155.4	0	0	113.8	F617	F617-E621 HydrophobicContact CE1-CB 4.31Å; F617-E621 VanDerWaalsContact CE1-CD 3.47Å; F617-E621 HydrophobicContact CE1-CG 4.43Å; F617-E621 WeakPolarHBondContact CE1-OE2 3.24Å; F617-E621 HydrophobicContact CZ-CB 4.26Å; F617-E621 VanDerWaalsContact CZ-CD 3.43Å; F617-E621 HydrophobicContact CZ-CG 4.22Å; F617-E621 VanDerWaalsContact CZ-OE2 3.3Å; F617-E621 WeakPolarHBondContact CZ-OE2 3.47Å; F617-E621 WeakPolarHBondContact O-CB 3.23Å; F617-E621 PolarHBondContact O-N 3.28Å
622	D	97.2	Very high	96.2	Very high	20 Å²	20	41.9 Å²	41.9	11%	0.107	22%	0.222	C	C	.	.			trans	-63.7	141.3	-171.1	-161.2	-67.2	0	0	0	111.2	R592 I618 N624 V627 R628	R592-D622 IonicContact CZ-OD1 3.72Å; R592-D622 IonicContact CZ-OD2 2.7Å; R592-D622 IonicContact NE-OD1 3.36Å; R592-D622 IonicContact NE-OD2 3.72Å; R592-D622 PolarHBondContact NE-OD2 3Å; R592-D622 IonicContact NH2-OD1 3.22Å; R592-D622 PolarHBondContact NH2-OD1 2.91Å; R592-D622 IonicContact NH2-OD2 3.15Å; I618-D622 HydrophobicContact CG2-CB 4.3Å; I618-D622 WeakPolarHBondContact O-CB 3.37Å; I618-D622 PolarHBondContact O-N 3.37Å; I618-D622 VanDerWaalsContact O-N 3.11Å; D622-N624 VanDerWaalsContact C-N 3.33Å; D622-N624 PolarHBondContact O-N 3.15Å; D622-N624 WeakPolarHBondContact OD1-CB 3.35Å; D622-N624 PolarHBondContact OD1-N 3.36Å; D622-V627 HydrophobicContact CB-CB 4.36Å; D622-V627 HydrophobicContact CB-CG1 4.15Å; D622-V627 WeakPolarHBondContact OD2-CG1 3.34Å; D622-R628 HydrophobicContact CB-CG 4.42Å; D622-R628 PolarHBondContact O-NE 3.35Å; D622-R628 PolarHBondContact O-NH2 3.4Å
623	V	95.4	Very high	96.4	Very high	127 Å²	127	41.8 Å²	41.8	77%	0.77	22%	0.221	S	C	*	.	S	Bend	trans	-77.1	-17.4	-179.9	-63.8	0	0	0	0	114.1
624	N	97.6	Very high	96.6	Very high	49 Å²	49	40.1 Å²	40.1	26%	0.262	20%	0.204	S	C	.	.			trans	-100.3	125	-172.7	-177.4	-82.9	0	0	0	112.1	P589 D622 D626 V627 R628	P589-N624 HydrophobicContact CB-CB 3.89Å; P589-N624 HydrophobicContact CG-CB 4.2Å; D622-N624 VanDerWaalsContact C-N 3.33Å; D622-N624 PolarHBondContact O-N 3.15Å; D622-N624 WeakPolarHBondContact OD1-CB 3.35Å; D622-N624 PolarHBondContact OD1-N 3.36Å; N624-D626 VanDerWaalsContact C-N 3.31Å; N624-D626 PolarHBondContact O-N 3.4Å; N624-D626 WeakPolarHBondContact OD1-CA 3.4Å; N624-D626 WeakPolarHBondContact OD1-CB 3.31Å; N624-D626 PolarHBondContact OD1-N 3.39Å; N624-V627 HydrophobicContact CB-CB 4.38Å; N624-V627 HydrophobicContact CB-CG2 3.96Å; N624-V627 PolarHBondContact O-N 2.96Å; N624-V627 VanDerWaalsContact O-N 3.14Å; N624-V627 PolarHBondContact OD1-N 3.41Å; N624-R628 WeakPolarHBondContact O-CG 3.48Å; N624-R628 PolarHBondContact O-N 2.84Å
625	D	97.3	Very high	96.6	Very high	65 Å²	65	37.2 Å²	37.2	35%	0.348	19%	0.193	S	C	.	.	H	α-helix	trans	-62.4	-32.1	-176.3	-69.2	-33.6	0	0	0	114.3	R628 R629 N658 H660	D625-R628 PolarHBondContact O-N 3.14Å; D625-R629 WeakPolarHBondContact O-CB 3.42Å; D625-R629 PolarHBondContact O-N 3.2Å; D625-N658 PolarHBondContact OD1-ND2 3.25Å; D625-H660 HydrophobicContact CB-CB 4Å; D625-H660 IonicContact OD2-CD2 2.8Å
626	D	95.7	Very high	96.5	Very high	41 Å²	41	37.2 Å²	37.2	22%	0.219	19%	0.193	C	C	.	.	H	α-helix	trans	-72.5	-32.9	177.1	-88.4	-39.5	0	0	0	112.4	N624 R629 A630 Y784	N624-D626 VanDerWaalsContact C-N 3.31Å; N624-D626 PolarHBondContact O-N 3.4Å; N624-D626 WeakPolarHBondContact OD1-CA 3.4Å; N624-D626 WeakPolarHBondContact OD1-CB 3.31Å; N624-D626 PolarHBondContact OD1-N 3.39Å; D626-R629 IonicContact OD1-CZ 2.66Å; D626-R629 IonicContact OD1-NE 2.75Å; D626-R629 PolarHBondContact OD1-NE 2.88Å; D626-R629 IonicContact OD1-NH2 3.96Å; D626-R629 PolarHBondContact OD1-NH2 3.12Å; D626-A630 WeakPolarHBondContact O-CB 3.44Å; D626-A630 PolarHBondContact O-N 2.73Å; D626-Y784 PolarHBondContact OD1-OH 2.78Å; D626-Y784 PolarHBondContact OD2-OH 3.07Å
627	V	98	Very high	96.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-68.6	-44.1	172.3	-176.6	0	0	0	0	109.8	P589 R592 R593 V596 I618 D622 N624 A630 A631	P589-V627 HydrophobicContact CB-CG2 3.99Å; P589-V627 VanDerWaalsContact O-CG2 3.31Å; P589-V627 WeakPolarHBondContact O-CG2 3.42Å; R592-V627 HydrophobicContact CB-CG1 4.4Å; R592-V627 HydrophobicContact CB-CG2 4.29Å; R593-V627 HydrophobicContact CB-CG2 4.3Å; V596-V627 HydrophobicContact CG2-CG1 3.99Å; I618-V627 HydrophobicContact CG2-CG1 3.93Å; D622-V627 HydrophobicContact CB-CB 4.36Å; D622-V627 HydrophobicContact CB-CG1 4.15Å; D622-V627 WeakPolarHBondContact OD2-CG1 3.34Å; N624-V627 HydrophobicContact CB-CB 4.38Å; N624-V627 HydrophobicContact CB-CG2 3.96Å; N624-V627 PolarHBondContact O-N 2.96Å; N624-V627 VanDerWaalsContact O-N 3.14Å; N624-V627 PolarHBondContact OD1-N 3.41Å; V627-A630 PolarHBondContact O-N 3.15Å; V627-A631 WeakPolarHBondContact O-CB 3.2Å; V627-A631 PolarHBondContact O-N 2.94Å
628	R	98	Very high	96.5	Very high	58 Å²	58	29.5 Å²	29.5	22%	0.219	16%	0.157	C	C	.	.	H	α-helix	trans	-58.5	-49.3	175.2	-64.5	-179.2	-176.6	-141.5	-8.5	111.6	S619 V620 D622 N624 D625 A630 A631 V632 V661	S619-R628 WeakPolarHBondContact O-CD 3.23Å; S619-R628 WeakPolarHBondContact O-CG 3.37Å; V620-R628 PolarHBondContact O-NH2 3.1Å; D622-R628 HydrophobicContact CB-CG 4.42Å; D622-R628 PolarHBondContact O-NE 3.35Å; D622-R628 PolarHBondContact O-NH2 3.4Å; N624-R628 WeakPolarHBondContact O-CG 3.48Å; N624-R628 PolarHBondContact O-N 2.84Å; D625-R628 PolarHBondContact O-N 3.14Å; R628-A630 VanDerWaalsContact C-N 3.34Å; R628-A630 PolarHBondContact O-N 2.89Å; R628-A631 PolarHBondContact O-N 3.28Å; R628-A631 VanDerWaalsContact O-N 3.17Å; R628-V632 WeakPolarHBondContact O-CG2 3.32Å; R628-V632 PolarHBondContact O-N 3.15Å; R628-V661 HydrophobicContact CB-CG2 4.12Å
629	R	97.1	Very high	96.4	Very high	2 Å²	2	29 Å²	29	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-54.9	-50	176.5	-174.6	176.4	62	79.6	-3.8	111.4	D625 D626 A631 V632 S633 H660 Y663 Y784	D625-R629 WeakPolarHBondContact O-CB 3.42Å; D625-R629 PolarHBondContact O-N 3.2Å; D626-R629 IonicContact OD1-CZ 2.66Å; D626-R629 IonicContact OD1-NE 2.75Å; D626-R629 PolarHBondContact OD1-NE 2.88Å; D626-R629 IonicContact OD1-NH2 3.96Å; D626-R629 PolarHBondContact OD1-NH2 3.12Å; R629-A631 VanDerWaalsContact C-N 3.32Å; R629-A631 PolarHBondContact O-N 3.44Å; R629-V632 PolarHBondContact O-N 2.94Å; R629-S633 WeakPolarHBondContact O-CB 3.25Å; R629-S633 PolarHBondContact O-N 3.38Å; R629-S633 PolarHBondContact O-OG 3.08Å; R629-H660 HydrophobicContact CB-CB 4.16Å; R629-H660 WeakPolarHBondContact CG-O 3.41Å; R629-Y663 HydrophobicContact CG-CD1 3.81Å; R629-Y663 HydrophobicContact CG-CE1 4.47Å; R629-Y784 PolarHBondContact NH2-OH 3.47Å; R629-Y784 VanDerWaalsContact NH2-OH 3.15Å
630	A	97.5	Very high	96.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-44.8	178.2	0	0	0	0	0	111.3	R593 V596 Y597 D626 V627 R628 V632 S633 C634	R593-A630 HydrophobicContact CG-CB 3.66Å; V596-A630 HydrophobicContact CG1-CB 4.09Å; Y597-A630 HydrophobicContact CD1-CB 4.35Å; Y597-A630 HydrophobicContact CE1-CB 3.59Å; D626-A630 WeakPolarHBondContact O-CB 3.44Å; D626-A630 PolarHBondContact O-N 2.73Å; V627-A630 PolarHBondContact O-N 3.15Å; R628-A630 VanDerWaalsContact C-N 3.34Å; R628-A630 PolarHBondContact O-N 2.89Å; A630-V632 VanDerWaalsContact C-N 3.35Å; A630-V632 PolarHBondContact O-N 2.88Å; A630-S633 PolarHBondContact O-N 2.9Å; A630-C634 WeakPolarHBondContact O-CB 3.38Å; A630-C634 PolarHBondContact O-N 3.47Å; A630-C634 PolarHBondContact O-SG 3.45Å
631	A	98.2	Very high	96	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-43.3	-179.1	0	0	0	0	0	112.1	V596 L615 I618 V627 R628 R629 C634 L635	V596-A631 HydrophobicContact CG1-CB 4.06Å; L615-A631 HydrophobicContact CD2-CB 4.46Å; I618-A631 HydrophobicContact CB-CB 4.13Å; I618-A631 HydrophobicContact CG2-CB 3.83Å; V627-A631 WeakPolarHBondContact O-CB 3.2Å; V627-A631 PolarHBondContact O-N 2.94Å; R628-A631 PolarHBondContact O-N 3.28Å; R628-A631 VanDerWaalsContact O-N 3.17Å; R629-A631 VanDerWaalsContact C-N 3.32Å; R629-A631 PolarHBondContact O-N 3.44Å; A631-C634 WeakPolarHBondContact O-CB 3.17Å; A631-C634 PolarHBondContact O-N 2.69Å; A631-L635 PolarHBondContact O-N 3.46Å
632	V	98.2	Very high	95.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-70.9	-46.6	177.7	-174.2	0	0	0	0	111.5	S619 R628 R629 A630 C634 L635 L653 V661 G664 A665 S668	S619-V632 VanDerWaalsContact CB-CG2 3.44Å; R628-V632 WeakPolarHBondContact O-CG2 3.32Å; R628-V632 PolarHBondContact O-N 3.15Å; R629-V632 PolarHBondContact O-N 2.94Å; A630-V632 VanDerWaalsContact C-N 3.35Å; A630-V632 PolarHBondContact O-N 2.88Å; V632-C634 PolarHBondContact O-N 3.28Å; V632-L635 HydrophobicContact CG1-CD1 4.36Å; V632-L635 VanDerWaalsContact O-CB 3.31Å; V632-L635 WeakPolarHBondContact O-CB 3.37Å; V632-L635 PolarHBondContact O-N 2.94Å; V632-L653 HydrophobicContact CG1-CD1 3.79Å; V632-L653 HydrophobicContact CG2-CD1 4Å; V632-V661 HydrophobicContact CG2-CG1 4.24Å; V632-G664 VanDerWaalsContact CG1-C 3.42Å; V632-A665 HydrophobicContact CG1-CB 4.01Å; V632-A665 VanDerWaalsContact CG1-N 3.28Å; V632-S668 WeakPolarHBondContact O-CB 3.37Å; V632-S668 PolarHBondContact O-OG 2.97Å
633	S	97.5	Very high	95.5	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.007	14%	0.138	C	C	.	.	H	α-helix	trans	-56.9	-35	175.4	-65.5	0	0	0	0	112.2	R629 A630 L635 G636 G664	R629-S633 WeakPolarHBondContact O-CB 3.25Å; R629-S633 PolarHBondContact O-N 3.38Å; R629-S633 PolarHBondContact O-OG 3.08Å; A630-S633 PolarHBondContact O-N 2.9Å; S633-L635 VanDerWaalsContact C-N 3.28Å; S633-L635 PolarHBondContact O-N 3.36Å; S633-G636 PolarHBondContact O-N 3.14Å; S633-G664 WeakPolarHBondContact OG-CA 3.49Å
634	C	97.6	Very high	95.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.3	-21.7	178.7	-83.8	0	0	0	0	114.8	V596 A600 L615 A630 A631 V632 G636 F637 V638	V596-C634 HydrophobicContact CG1-CB 4.31Å; A600-C634 HydrophobicContact CB-CB 3.4Å; A600-C634 VanDerWaalsContact CB-CB 3.4Å; A600-C634 WeakPolarHBondContact CB-SG 2.98Å; L615-C634 HydrophobicContact CD1-CB 4.02Å; L615-C634 HydrophobicContact CD2-CB 4.13Å; A630-C634 WeakPolarHBondContact O-CB 3.38Å; A630-C634 PolarHBondContact O-N 3.47Å; A630-C634 PolarHBondContact O-SG 3.45Å; A631-C634 WeakPolarHBondContact O-CB 3.17Å; A631-C634 PolarHBondContact O-N 2.69Å; V632-C634 PolarHBondContact O-N 3.28Å; C634-G636 PolarHBondContact O-N 3.27Å; C634-F637 PolarHBondContact O-N 3.47Å; C634-V638 PolarHBondContact O-N 3.48Å
635	L	97	Very high	95.2	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-35.2	173.3	-67.6	168.9	0	0	0	111.2	A612 L615 L616 A631 V632 S633 F637 V638 M639 V650 L653	A612-L635 HydrophobicContact CB-CD2 4.11Å; L615-L635 HydrophobicContact CB-CD2 3.68Å; L615-L635 HydrophobicContact CB-CG 4.25Å; L615-L635 HydrophobicContact CD1-CD2 4.02Å; L616-L635 HydrophobicContact CD2-CD1 3.62Å; L616-L635 HydrophobicContact CG-CD1 4.11Å; L616-L635 HydrophobicContact CG-CD2 4.22Å; A631-L635 PolarHBondContact O-N 3.46Å; V632-L635 HydrophobicContact CG1-CD1 4.36Å; V632-L635 VanDerWaalsContact O-CB 3.31Å; V632-L635 WeakPolarHBondContact O-CB 3.37Å; V632-L635 PolarHBondContact O-N 2.94Å; S633-L635 VanDerWaalsContact C-N 3.28Å; S633-L635 PolarHBondContact O-N 3.36Å; L635-F637 VanDerWaalsContact C-N 3.3Å; L635-F637 PolarHBondContact O-N 2.89Å; L635-V638 PolarHBondContact O-N 3.06Å; L635-M639 WeakPolarHBondContact O-CB 3.31Å; L635-M639 WeakPolarHBondContact O-CG 3.18Å; L635-M639 PolarHBondContact O-N 3.34Å; L635-V650 HydrophobicContact CD1-CG1 4.07Å; L635-L653 HydrophobicContact CD1-CD1 4.39Å
636	G	95.3	Very high	95.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59	-40	177.9	0	0	0	0	0	112.8	S633 C634 V640 S668	S633-G636 PolarHBondContact O-N 3.14Å; C634-G636 PolarHBondContact O-N 3.27Å; G636-V640 PolarHBondContact O-N 3.42Å; G636-S668 WeakPolarHBondContact CA-O 3.2Å; G636-S668 WeakPolarHBondContact CA-OG 3.31Å; G636-S668 PolarHBondContact N-OG 3.13Å
637	F	96.2	Very high	95	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67.6	-45.3	175.6	-71.5	-76.6	0	0	0	112.2	M601 G605 C634 L635 I671 L761 L776 L777 L780	M601-F637 HydrophobicContact SD-CD1 4.34Å; M601-F637 HydrophobicContact SD-CE1 4.45Å; G605-F637 PolarHBondContact N-O 3.11Å; C634-F637 PolarHBondContact O-N 3.47Å; L635-F637 VanDerWaalsContact C-N 3.3Å; L635-F637 PolarHBondContact O-N 2.89Å; F637-I671 HydrophobicContact CD1-CG2 4.31Å; F637-I671 HydrophobicContact CD2-CD1 4.21Å; F637-I671 HydrophobicContact CE1-CG2 4.44Å; F637-I671 HydrophobicContact CE2-CD1 3.74Å; F637-I671 HydrophobicContact CG-CG2 4.45Å; F637-I671 HydrophobicContact CZ-CD1 4Å; F637-L761 HydrophobicContact CD1-CD1 3.94Å; F637-L761 HydrophobicContact CD1-CD2 4.28Å; F637-L761 HydrophobicContact CE1-CD1 4.33Å; F637-L761 HydrophobicContact CE1-CD2 4.25Å; F637-L776 HydrophobicContact CE1-CB 3.69Å; F637-L776 HydrophobicContact CZ-CB 3.75Å; F637-L777 HydrophobicContact CE2-CD1 4.41Å; F637-L777 HydrophobicContact CZ-CB 4.13Å; F637-L780 HydrophobicContact CE2-CD1 3.82Å; F637-L780 HydrophobicContact CZ-CD1 4.35Å
638	V	95.1	Very high	94.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-39.2	-177.2	178.1	0	0	0	0	111.2	A600 G607 T611 L615 C634 L635	A600-V638 HydrophobicContact CB-CG2 4.44Å; G607-V638 PolarHBondContact N-O 3.38Å; T611-V638 HydrophobicContact CG2-CG1 4.46Å; T611-V638 HydrophobicContact CG2-CG2 4.11Å; L615-V638 HydrophobicContact CD1-CG2 3.82Å; C634-V638 PolarHBondContact O-N 3.48Å; L635-V638 PolarHBondContact O-N 3.06Å
639	M	93.5	Very high	94.6	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.049	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	11.4	-171.8	-60.2	-60.1	-67.1	0	0	114.3	A612 L635 K641 N642 C646 L649	A612-M639 HydrophobicContact CB-SD 4.18Å; L635-M639 WeakPolarHBondContact O-CB 3.31Å; L635-M639 WeakPolarHBondContact O-CG 3.18Å; L635-M639 PolarHBondContact O-N 3.34Å; M639-K641 PolarHBondContact O-N 3.49Å; M639-K641 VanDerWaalsContact O-N 3.14Å; M639-N642 HydrophobicContact CE-CB 4.24Å; M639-N642 CarbonylContact O-C 3.56Å; M639-N642 WeakPolarHBondContact O-CA 3.41Å; M639-N642 PolarHBondContact O-N 3.04Å; M639-C646 HydrophobicContact CB-CB 3.64Å; M639-C646 HydrophobicContact CG-CB 4.45Å; M639-L649 HydrophobicContact CE-CD1 4.03Å; M639-L649 HydrophobicContact CG-CD1 4.36Å; M639-L649 HydrophobicContact SD-CD1 4.37Å
640	V	91.5	Very high	94.4	Very high	13 Å²	13	24.7 Å²	24.7	8%	0.079	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.3	-175.4	68.7	0	0	0	0	114.4	G636 N642 L761 L762	G636-V640 PolarHBondContact O-N 3.42Å; V640-N642 VanDerWaalsContact C-N 3.31Å; V640-L761 HydrophobicContact CB-CD1 4.09Å; V640-L761 HydrophobicContact CG1-CB 4.34Å; V640-L761 HydrophobicContact CG1-CD1 4.33Å; V640-L761 HydrophobicContact CG2-CB 3.91Å; V640-L761 HydrophobicContact CG2-CD1 3.86Å; V640-L761 HydrophobicContact CG2-CG 4.48Å; V640-L762 HydrophobicContact CG1-CD2 4.01Å; V640-L762 HydrophobicContact CG1-CG 4.25Å; V640-L762 HydrophobicContact CG2-CD1 4.47Å; V640-L762 HydrophobicContact CG2-CG 4.34Å
641	K	88.2	Confident	94.3	Very high	74 Å²	74	26.6 Å²	26.6	32%	0.322	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-24.9	173.8	-70.4	-167.6	-179.3	-177.1	0	113.4	G605 M639 P643 L762 N766	G605-K641 WeakPolarHBondContact O-CD 3.5Å; G605-K641 WeakPolarHBondContact O-CE 3.46Å; G605-K641 WeakPolarHBondContact O-CG 3.22Å; M639-K641 PolarHBondContact O-N 3.49Å; M639-K641 VanDerWaalsContact O-N 3.14Å; K641-P643 VanDerWaalsContact C-CD 3.46Å; K641-P643 WeakPolarHBondContact O-CD 3.38Å; K641-L762 HydrophobicContact CG-CD1 4.05Å; K641-L762 HydrophobicContact CG-CD2 3.82Å; K641-N766 WeakPolarHBondContact CE-O 3.31Å; K641-N766 PolarHBondContact NZ-O 2.92Å
642	N	90.1	Very high	94	Very high	77 Å²	77	34.2 Å²	34.2	41%	0.412	18%	0.181	S	C	.	.			trans	-124.9	68.7	-175.4	-63.8	-13.9	0	0	0	109.8	M639 V640 T644 S645 C646	M639-N642 HydrophobicContact CE-CB 4.24Å; M639-N642 CarbonylContact O-C 3.56Å; M639-N642 WeakPolarHBondContact O-CA 3.41Å; M639-N642 PolarHBondContact O-N 3.04Å; V640-N642 VanDerWaalsContact C-N 3.31Å; N642-T644 VanDerWaalsContact C-N 3.31Å; N642-T644 PolarHBondContact O-N 3.02Å; N642-S645 PolarHBondContact O-N 2.82Å; N642-C646 PolarHBondContact O-N 3.01Å
643	P	91.2	Very high	93.9	Very high	29 Å²	29	35.4 Å²	35.4	19%	0.188	19%	0.188	C	C	.	.	H	α-helix	trans	-60.9	-37.6	-174.1	23.3	-33.8	0	0	0	112.9	K641 S645 C646 A647 L678	K641-P643 VanDerWaalsContact C-CD 3.46Å; K641-P643 WeakPolarHBondContact O-CD 3.38Å; P643-S645 PolarHBondContact O-N 3.23Å; P643-C646 VanDerWaalsContact O-CB 3.27Å; P643-C646 WeakPolarHBondContact O-CB 3.28Å; P643-C646 PolarHBondContact O-N 3.27Å; P643-C646 VanDerWaalsContact O-N 3.17Å; P643-A647 PolarHBondContact O-N 3.33Å; P643-L678 HydrophobicContact CB-CD2 4.44Å
644	T	93.9	Very high	93.8	Very high	63 Å²	63	36 Å²	36	39%	0.387	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-45	176.4	-48.1	0	0	0	0	111.7	N642 C646 A647 Q648	N642-T644 VanDerWaalsContact C-N 3.31Å; N642-T644 PolarHBondContact O-N 3.02Å; T644-C646 VanDerWaalsContact C-N 3.34Å; T644-A647 PolarHBondContact O-N 3.03Å; T644-Q648 WeakPolarHBondContact O-CG 3.38Å; T644-Q648 PolarHBondContact O-N 2.92Å; T644-Q648 VanDerWaalsContact O-N 3.08Å
645	S	92.6	Very high	93.6	Very high	46 Å²	46	43.7 Å²	43.7	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-66.1	-37.4	175.5	-54.9	0	0	0	0	111.6	N642 P643 A647 Q648 L649	N642-S645 PolarHBondContact O-N 2.82Å; P643-S645 PolarHBondContact O-N 3.23Å; S645-A647 VanDerWaalsContact C-N 3.34Å; S645-A647 PolarHBondContact O-N 3.49Å; S645-Q648 PolarHBondContact O-N 3.39Å; S645-L649 VanDerWaalsContact O-CG 3.31Å; S645-L649 WeakPolarHBondContact O-CG 3.24Å; S645-L649 PolarHBondContact O-N 2.81Å
646	C	94.2	Very high	93.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.4	-49.1	172.5	-169.1	0	0	0	0	111	M639 N642 P643 T644 Q648 L649 V650 S668 A672	M639-C646 HydrophobicContact CB-CB 3.64Å; M639-C646 HydrophobicContact CG-CB 4.45Å; N642-C646 PolarHBondContact O-N 3.01Å; P643-C646 VanDerWaalsContact O-CB 3.27Å; P643-C646 WeakPolarHBondContact O-CB 3.28Å; P643-C646 PolarHBondContact O-N 3.27Å; P643-C646 VanDerWaalsContact O-N 3.17Å; T644-C646 VanDerWaalsContact C-N 3.34Å; C646-Q648 VanDerWaalsContact C-N 3.33Å; C646-Q648 PolarHBondContact O-N 3.16Å; C646-L649 PolarHBondContact O-N 3.42Å; C646-V650 WeakPolarHBondContact O-CG2 3.44Å; C646-V650 PolarHBondContact O-N 3.41Å; C646-S668 PolarHBondContact SG-OG 3.14Å; C646-A672 HydrophobicContact CB-CB 3.83Å; C646-A672 VanDerWaalsContact SG-CB 3.57Å
647	A	94.4	Very high	93.4	Very high	3 Å²	3	56.1 Å²	56.1	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-41.8	179.5	0	0	0	0	0	112.6	P643 T644 S645 S651 L669 L678 E680 L684	P643-A647 PolarHBondContact O-N 3.33Å; T644-A647 PolarHBondContact O-N 3.03Å; S645-A647 VanDerWaalsContact C-N 3.34Å; S645-A647 PolarHBondContact O-N 3.49Å; A647-S651 PolarHBondContact O-N 3.25Å; A647-L669 HydrophobicContact CB-CD2 3.89Å; A647-L678 HydrophobicContact CB-CD2 4.26Å; A647-E680 HydrophobicContact CB-CB 4.38Å; A647-L684 HydrophobicContact CB-CD1 4.44Å
648	Q	93.6	Very high	93.4	Very high	132 Å²	132	57.4 Å²	57.4	62%	0.617	29%	0.287	S	S	*	.	H	α-helix	trans	-62.6	-45.6	175.8	-69.9	172.1	-7.6	0	0	112	T644 S645 C646 V650 S651	T644-Q648 WeakPolarHBondContact O-CG 3.38Å; T644-Q648 PolarHBondContact O-N 2.92Å; T644-Q648 VanDerWaalsContact O-N 3.08Å; S645-Q648 PolarHBondContact O-N 3.39Å; C646-Q648 VanDerWaalsContact C-N 3.33Å; C646-Q648 PolarHBondContact O-N 3.16Å; Q648-V650 PolarHBondContact O-N 2.96Å; Q648-S651 WeakPolarHBondContact O-CB 3.36Å; Q648-S651 PolarHBondContact O-N 2.95Å; Q648-S651 PolarHBondContact O-OG 2.83Å
649	L	92.5	Very high	93.5	Very high	68 Å²	68	59 Å²	59	36%	0.356	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-38.2	-179.3	-69.4	175.6	0	0	0	112.8	A612 L616 M639 S645 C646	A612-L649 HydrophobicContact CB-CD1 4.32Å; L616-L649 HydrophobicContact CD1-CD2 4.1Å; M639-L649 HydrophobicContact CE-CD1 4.03Å; M639-L649 HydrophobicContact CG-CD1 4.36Å; M639-L649 HydrophobicContact SD-CD1 4.37Å; S645-L649 VanDerWaalsContact O-CG 3.31Å; S645-L649 WeakPolarHBondContact O-CG 3.24Å; S645-L649 PolarHBondContact O-N 2.81Å; C646-L649 PolarHBondContact O-N 3.42Å
650	V	93.7	Very high	93.7	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-88.9	-10.7	-177	-55.7	0	0	0	0	113.8	L635 C646 Q648 Q652 L653 T654 A665 L669	L635-V650 HydrophobicContact CD1-CG1 4.07Å; C646-V650 WeakPolarHBondContact O-CG2 3.44Å; C646-V650 PolarHBondContact O-N 3.41Å; Q648-V650 PolarHBondContact O-N 2.96Å; V650-Q652 PolarHBondContact O-N 2.77Å; V650-L653 WeakPolarHBondContact O-CA 3.42Å; V650-L653 WeakPolarHBondContact O-CB 3.38Å; V650-L653 PolarHBondContact O-N 3.46Å; V650-T654 PolarHBondContact O-N 3.16Å; V650-T654 VanDerWaalsContact O-N 3.1Å; V650-A665 HydrophobicContact CB-CB 4.28Å; V650-L669 HydrophobicContact CG2-CD1 4.14Å; V650-L669 HydrophobicContact CG2-CD2 3.45Å; V650-L669 VanDerWaalsContact CG2-CD2 3.45Å; V650-L669 HydrophobicContact CG2-CG 3.66Å
651	S	95.3	Very high	94	Very high	41 Å²	41	60 Å²	60	29%	0.287	30%	0.302	S	S	.	.	H	α-helix	trans	-46.7	-54.7	-177.6	60.7	0	0	0	0	112.8	A647 Q648 L653 T654	A647-S651 PolarHBondContact O-N 3.25Å; Q648-S651 WeakPolarHBondContact O-CB 3.36Å; Q648-S651 PolarHBondContact O-N 2.95Å; Q648-S651 PolarHBondContact O-OG 2.83Å; S651-L653 VanDerWaalsContact C-N 3.28Å; S651-L653 PolarHBondContact O-N 3.15Å; S651-T654 PolarHBondContact O-N 3.34Å; S651-T654 PolarHBondContact O-OG1 3.03Å
652	Q	93.2	Very high	94.5	Very high	161 Å²	161	57.8 Å²	57.8	75%	0.752	29%	0.291	S	S	*	.	H	α-helix	trans	-67.7	-26.3	178.8	-64.1	-176.8	-10.9	0	0	113.4	V650 T654 E655	V650-Q652 PolarHBondContact O-N 2.77Å; Q652-T654 VanDerWaalsContact C-N 3.32Å; Q652-E655 PolarHBondContact O-N 3.44Å
653	L	94.8	Very high	94.8	Very high	25 Å²	25	54.8 Å²	54.8	13%	0.131	27%	0.274	C	S	.	.	H	α-helix	trans	-74.4	-24.9	178.7	-59.1	179.5	0	0	0	112.1	L616 V632 L635 V650 S651 E655 S656 V661 A665	L616-L653 HydrophobicContact CD2-CD1 3.77Å; V632-L653 HydrophobicContact CG1-CD1 3.79Å; V632-L653 HydrophobicContact CG2-CD1 4Å; L635-L653 HydrophobicContact CD1-CD1 4.39Å; V650-L653 WeakPolarHBondContact O-CA 3.42Å; V650-L653 WeakPolarHBondContact O-CB 3.38Å; V650-L653 PolarHBondContact O-N 3.46Å; S651-L653 VanDerWaalsContact C-N 3.28Å; S651-L653 PolarHBondContact O-N 3.15Å; L653-E655 PolarHBondContact O-N 2.89Å; L653-S656 VanDerWaalsContact O-CB 3.24Å; L653-S656 WeakPolarHBondContact O-CB 3.39Å; L653-S656 PolarHBondContact O-N 3.23Å; L653-V661 HydrophobicContact CB-CG1 3.91Å; L653-V661 HydrophobicContact CD2-CG1 3.98Å; L653-V661 HydrophobicContact CG-CG1 4.43Å; L653-A665 HydrophobicContact CB-CB 4.07Å
654	T	95.1	Very high	95.2	Very high	14 Å²	14	53.4 Å²	53.4	9%	0.086	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-27.1	173.7	67.7	0	0	0	0	112.5	V650 S651 Q652 R662 A665 L669 L684 M688	V650-T654 PolarHBondContact O-N 3.16Å; V650-T654 VanDerWaalsContact O-N 3.1Å; S651-T654 PolarHBondContact O-N 3.34Å; S651-T654 PolarHBondContact O-OG1 3.03Å; Q652-T654 VanDerWaalsContact C-N 3.32Å; T654-R662 WeakPolarHBondContact O-CD 3.29Å; T654-R662 WeakPolarHBondContact O-CG 3.36Å; T654-A665 HydrophobicContact CG2-CB 3.86Å; T654-L669 HydrophobicContact CG2-CD1 4.4Å; T654-L684 HydrophobicContact CG2-CB 4.32Å; T654-M688 HydrophobicContact CG2-SD 4.04Å
655	E	94.1	Very high	95.3	Very high	161 Å²	161	50.4 Å²	50.4	75%	0.752	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	3.5	177.9	-60.7	-176	170.7	0	0	113.1	Q652 L653	Q652-E655 PolarHBondContact O-N 3.44Å; L653-E655 PolarHBondContact O-N 2.89Å
656	S	94.6	Very high	95.6	Very high	34 Å²	34	48.2 Å²	48.2	24%	0.238	23%	0.232	C	C	.	.			trans	-60.6	140.7	-179	-178.8	0	0	0	0	112	L653 N658 R662	L653-S656 VanDerWaalsContact O-CB 3.24Å; L653-S656 WeakPolarHBondContact O-CB 3.39Å; L653-S656 PolarHBondContact O-N 3.23Å; S656-N658 PolarHBondContact O-N 3.11Å; S656-N658 PolarHBondContact OG-N 2.99Å; S656-R662 WeakPolarHBondContact O-CD 3.19Å; S656-R662 WeakPolarHBondContact O-CG 3.13Å; S656-R662 PolarHBondContact O-NH1 3.28Å
657	Y	93.6	Very high	95.8	Very high	227 Å²	227	48.3 Å²	48.3	89%	0.89	23%	0.232	S	C	*	.	S	Bend	trans	-62	-24.6	173.3	-71.2	-79.8	0	0	0	113	P659 R662	Y657-P659 VanDerWaalsContact O-CD 3.27Å; Y657-P659 WeakPolarHBondContact O-CD 3.14Å; Y657-R662 VanDerWaalsContact C-NH1 3.34Å; Y657-R662 PolarHBondContact O-NH1 3.03Å
658	N	96.3	Very high	95.9	Very high	27 Å²	27	48.1 Å²	48.1	14%	0.144	23%	0.231	C	C	.	.			trans	-80.6	114	179.5	-171.9	-31.8	0	0	0	111	D625 S656 H660 V661 R662	D625-N658 PolarHBondContact OD1-ND2 3.25Å; S656-N658 PolarHBondContact O-N 3.11Å; S656-N658 PolarHBondContact OG-N 2.99Å; N658-H660 VanDerWaalsContact C-N 3.25Å; N658-H660 PolarHBondContact O-N 3.25Å; N658-H660 VanDerWaalsContact OD1-CB 3.3Å; N658-H660 WeakPolarHBondContact OD1-CB 3.42Å; N658-H660 PolarHBondContact OD1-N 2.94Å; N658-V661 HydrophobicContact CB-CB 4.13Å; N658-V661 HydrophobicContact CB-CG2 3.93Å; N658-V661 WeakPolarHBondContact O-CB 3.38Å; N658-V661 PolarHBondContact O-N 3.12Å; N658-V661 VanDerWaalsContact O-N 3.12Å; N658-R662 PolarHBondContact O-N 3.01Å; N658-R662 VanDerWaalsContact O-N 3.11Å
659	P	97.4	Very high	96.1	Very high	34 Å²	34	41.9 Å²	41.9	22%	0.221	20%	0.202	C	C	.	.	H	α-helix	trans	-63.8	-28.4	-178	-19.7	33.2	0	0	0	113.6	Y657 V661 R662 Y663 V693 F695 V696	Y657-P659 VanDerWaalsContact O-CD 3.27Å; Y657-P659 WeakPolarHBondContact O-CD 3.14Å; P659-V661 VanDerWaalsContact C-N 3.34Å; P659-R662 PolarHBondContact O-N 3Å; P659-Y663 WeakPolarHBondContact O-CB 3.49Å; P659-Y663 PolarHBondContact O-N 2.74Å; P659-V693 HydrophobicContact CB-CB 4.17Å; P659-V693 HydrophobicContact CB-CG1 4.01Å; P659-V693 HydrophobicContact CB-CG2 3.94Å; P659-V693 HydrophobicContact CG-CG2 3.85Å; P659-F695 HydrophobicContact CB-CE1 4.43Å; P659-F695 HydrophobicContact CB-CE2 3.97Å; P659-F695 HydrophobicContact CB-CZ 3.59Å; P659-V696 HydrophobicContact CB-CG2 3.82Å; P659-V696 VanDerWaalsContact O-CG2 3.28Å; P659-V696 WeakPolarHBondContact O-CG2 3.4Å
660	H	97.5	Very high	96.3	Very high	40 Å²	40	38.6 Å²	38.6	19%	0.185	19%	0.185	C	C	.	.	H	α-helix	trans	-67.5	-36.2	176.3	-69.7	-93.1	0	0	0	112.1	D625 R629 N658 G664	D625-H660 HydrophobicContact CB-CB 4Å; D625-H660 IonicContact OD2-CD2 2.8Å; R629-H660 HydrophobicContact CB-CB 4.16Å; R629-H660 WeakPolarHBondContact CG-O 3.41Å; N658-H660 VanDerWaalsContact C-N 3.25Å; N658-H660 PolarHBondContact O-N 3.25Å; N658-H660 VanDerWaalsContact OD1-CB 3.3Å; N658-H660 WeakPolarHBondContact OD1-CB 3.42Å; N658-H660 PolarHBondContact OD1-N 2.94Å; H660-G664 PolarHBondContact O-N 3.39Å
661	V	97.8	Very high	96.5	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.024	19%	0.185	C	C	.	.	H	α-helix	trans	-68.4	-44.5	173.5	171	0	0	0	0	110.2	R628 V632 L653 N658 P659 G664 A665	R628-V661 HydrophobicContact CB-CG2 4.12Å; V632-V661 HydrophobicContact CG2-CG1 4.24Å; L653-V661 HydrophobicContact CB-CG1 3.91Å; L653-V661 HydrophobicContact CD2-CG1 3.98Å; L653-V661 HydrophobicContact CG-CG1 4.43Å; N658-V661 HydrophobicContact CB-CB 4.13Å; N658-V661 HydrophobicContact CB-CG2 3.93Å; N658-V661 WeakPolarHBondContact O-CB 3.38Å; N658-V661 PolarHBondContact O-N 3.12Å; N658-V661 VanDerWaalsContact O-N 3.12Å; P659-V661 VanDerWaalsContact C-N 3.34Å; V661-G664 CarbonylContact O-C 3.37Å; V661-G664 WeakPolarHBondContact O-CA 3.47Å; V661-G664 PolarHBondContact O-N 3.13Å; V661-G664 VanDerWaalsContact O-N 3.13Å; V661-A665 PolarHBondContact O-N 3.02Å
662	R	98.1	Very high	96.4	Very high	27 Å²	27	37 Å²	37	10%	0.102	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-49.2	175.4	-63.4	-159.7	-59.9	-81.7	5.4	111.8	T654 S656 Y657 N658 P659 G664 A665 A666 M688 D691 V696	T654-R662 WeakPolarHBondContact O-CD 3.29Å; T654-R662 WeakPolarHBondContact O-CG 3.36Å; S656-R662 WeakPolarHBondContact O-CD 3.19Å; S656-R662 WeakPolarHBondContact O-CG 3.13Å; S656-R662 PolarHBondContact O-NH1 3.28Å; Y657-R662 VanDerWaalsContact C-NH1 3.34Å; Y657-R662 PolarHBondContact O-NH1 3.03Å; N658-R662 PolarHBondContact O-N 3.01Å; N658-R662 VanDerWaalsContact O-N 3.11Å; P659-R662 PolarHBondContact O-N 3Å; R662-G664 VanDerWaalsContact C-N 3.28Å; R662-G664 PolarHBondContact O-N 3.16Å; R662-A665 WeakPolarHBondContact O-CB 3.28Å; R662-A665 PolarHBondContact O-N 2.95Å; R662-A665 VanDerWaalsContact O-N 3.14Å; R662-A666 PolarHBondContact O-N 3.45Å; R662-M688 HydrophobicContact CB-CE 3.91Å; R662-M688 VanDerWaalsContact O-CE 3.27Å; R662-M688 WeakPolarHBondContact O-CE 3.26Å; R662-D691 IonicContact CZ-OD1 3.71Å; R662-D691 IonicContact CZ-OD2 2.66Å; R662-D691 IonicContact NE-OD1 2.84Å; R662-D691 IonicContact NE-OD2 2.87Å; R662-D691 PolarHBondContact NE-OD2 3.01Å; R662-D691 IonicContact NH2-OD1 3.33Å; R662-D691 PolarHBondContact NH2-OD1 3.4Å; R662-D691 IonicContact NH2-OD2 2.77Å; R662-D691 PolarHBondContact NH2-OD2 3.38Å; R662-V696 HydrophobicContact CB-CG1 3.9Å; R662-V696 HydrophobicContact CB-CG2 4.3Å
663	Y	97.9	Very high	96.5	Very high	14 Å²	14	29.3 Å²	29.3	6%	0.055	14%	0.138	C	C	.	.	H	α-helix	trans	-55.2	-46.2	173.2	178.4	-88.5	0	0	0	111.7	R629 P659 A665 A666 I667 F695 G699 W783	R629-Y663 HydrophobicContact CG-CD1 3.81Å; R629-Y663 HydrophobicContact CG-CE1 4.47Å; P659-Y663 WeakPolarHBondContact O-CB 3.49Å; P659-Y663 PolarHBondContact O-N 2.74Å; Y663-A665 VanDerWaalsContact C-N 3.29Å; Y663-A665 PolarHBondContact O-N 2.91Å; Y663-A666 PolarHBondContact O-N 3.28Å; Y663-I667 HydrophobicContact CD1-CG1 4.05Å; Y663-I667 HydrophobicContact CE1-CD1 4.39Å; Y663-I667 HydrophobicContact CE1-CG1 3.54Å; Y663-I667 HydrophobicContact CE2-CG1 4.31Å; Y663-I667 WeakPolarHBondContact O-CG1 3.47Å; Y663-I667 PolarHBondContact O-N 3.46Å; Y663-F695 HydrophobicContact CD2-CD2 4.05Å; Y663-F695 WeakPolarHBondContact CD2-O 3.5Å; Y663-F695 WeakPolarHBondContact CE2-O 3.43Å; Y663-F695 HydrophobicContact CG-CD2 4.26Å; Y663-G699 VanDerWaalsContact CE2-CA 3.46Å; Y663-W783 HydrophobicContact CD1-CZ3 4.17Å; Y663-W783 AromaticContact CD2-CZ3 3.82Å; Y663-W783 HydrophobicContact CD2-CZ3 3.82Å; Y663-W783 AromaticContact CE1-CE3 3.99Å; Y663-W783 HydrophobicContact CE1-CE3 3.99Å; Y663-W783 HydrophobicContact CE1-CZ3 4.04Å; Y663-W783 AromaticContact CE2-CE3 3.99Å; Y663-W783 HydrophobicContact CE2-CE3 3.99Å; Y663-W783 AromaticContact CE2-CZ3 3.65Å; Y663-W783 HydrophobicContact CE2-CZ3 3.65Å; Y663-W783 HydrophobicContact CG-CZ3 4.05Å; Y663-W783 AromaticContact CZ-CE3 3.67Å; Y663-W783 AromaticContact CZ-CZ3 3.76Å
664	G	97.6	Very high	96.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-57.8	-42.6	177.6	0	0	0	0	0	112.4	V632 S633 H660 V661 R662 I667 S668	V632-G664 VanDerWaalsContact CG1-C 3.42Å; S633-G664 WeakPolarHBondContact OG-CA 3.49Å; H660-G664 PolarHBondContact O-N 3.39Å; V661-G664 CarbonylContact O-C 3.37Å; V661-G664 WeakPolarHBondContact O-CA 3.47Å; V661-G664 PolarHBondContact O-N 3.13Å; V661-G664 VanDerWaalsContact O-N 3.13Å; R662-G664 VanDerWaalsContact C-N 3.28Å; R662-G664 PolarHBondContact O-N 3.16Å; G664-I667 PolarHBondContact O-N 3.43Å; G664-S668 WeakPolarHBondContact O-CB 3.22Å; G664-S668 PolarHBondContact O-N 2.96Å
665	A	98.1	Very high	96.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.6	-43.8	178.1	0	0	0	0	0	111.7	V632 V650 L653 T654 V661 R662 Y663 I667 S668 L669	V632-A665 HydrophobicContact CG1-CB 4.01Å; V632-A665 VanDerWaalsContact CG1-N 3.28Å; V650-A665 HydrophobicContact CB-CB 4.28Å; L653-A665 HydrophobicContact CB-CB 4.07Å; T654-A665 HydrophobicContact CG2-CB 3.86Å; V661-A665 PolarHBondContact O-N 3.02Å; R662-A665 WeakPolarHBondContact O-CB 3.28Å; R662-A665 PolarHBondContact O-N 2.95Å; R662-A665 VanDerWaalsContact O-N 3.14Å; Y663-A665 VanDerWaalsContact C-N 3.29Å; Y663-A665 PolarHBondContact O-N 2.91Å; A665-I667 PolarHBondContact O-N 3.35Å; A665-S668 WeakPolarHBondContact O-CB 3.17Å; A665-S668 PolarHBondContact O-N 2.82Å; A665-L669 WeakPolarHBondContact O-CG 3.26Å; A665-L669 PolarHBondContact O-N 2.79Å
666	A	98.3	Very high	96	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.7	-48.9	175.4	0	0	0	0	0	111.6	R662 Y663 S668 L669 G670 L685 M688 A703	R662-A666 PolarHBondContact O-N 3.45Å; Y663-A666 PolarHBondContact O-N 3.28Å; A666-S668 VanDerWaalsContact C-N 3.34Å; A666-S668 PolarHBondContact O-N 3.39Å; A666-L669 PolarHBondContact O-N 3.36Å; A666-G670 PolarHBondContact O-N 3.48Å; A666-L685 HydrophobicContact CB-CD2 3.74Å; A666-M688 HydrophobicContact CB-CE 3.86Å; A666-M688 HydrophobicContact CB-SD 4.24Å; A666-A703 HydrophobicContact CB-CB 4.49Å; A666-A703 WeakPolarHBondContact O-CB 3.45Å
667	I	97.8	Very high	95.8	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-63.4	-39.1	177.1	-67.8	-58.1	0	0	0	111.8	Y663 G664 A665 L669 G670 I671 L780	Y663-I667 HydrophobicContact CD1-CG1 4.05Å; Y663-I667 HydrophobicContact CE1-CD1 4.39Å; Y663-I667 HydrophobicContact CE1-CG1 3.54Å; Y663-I667 HydrophobicContact CE2-CG1 4.31Å; Y663-I667 WeakPolarHBondContact O-CG1 3.47Å; Y663-I667 PolarHBondContact O-N 3.46Å; G664-I667 PolarHBondContact O-N 3.43Å; A665-I667 PolarHBondContact O-N 3.35Å; I667-L669 VanDerWaalsContact C-N 3.32Å; I667-L669 PolarHBondContact O-N 3.07Å; I667-G670 PolarHBondContact O-N 3Å; I667-I671 HydrophobicContact CG2-CD1 3.7Å; I667-I671 HydrophobicContact CG2-CG1 4.25Å; I667-I671 WeakPolarHBondContact O-CG1 3.5Å; I667-I671 PolarHBondContact O-N 3.38Å; I667-L780 HydrophobicContact CG2-CD1 4.16Å; I667-L780 HydrophobicContact CG2-CD2 3.48Å; I667-L780 VanDerWaalsContact CG2-CD2 3.48Å; I667-L780 HydrophobicContact CG2-CG 4.47Å
668	S	97.6	Very high	95.8	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.7	-44.8	176	-175.2	0	0	0	0	111.7	V632 G636 C646 G664 A665 A666 I671 A672	V632-S668 WeakPolarHBondContact O-CB 3.37Å; V632-S668 PolarHBondContact O-OG 2.97Å; G636-S668 WeakPolarHBondContact CA-O 3.2Å; G636-S668 WeakPolarHBondContact CA-OG 3.31Å; G636-S668 PolarHBondContact N-OG 3.13Å; C646-S668 PolarHBondContact SG-OG 3.14Å; G664-S668 WeakPolarHBondContact O-CB 3.22Å; G664-S668 PolarHBondContact O-N 2.96Å; A665-S668 WeakPolarHBondContact O-CB 3.17Å; A665-S668 PolarHBondContact O-N 2.82Å; A666-S668 VanDerWaalsContact C-N 3.34Å; A666-S668 PolarHBondContact O-N 3.39Å; S668-I671 PolarHBondContact O-N 3.16Å; S668-A672 WeakPolarHBondContact O-CB 3.35Å; S668-A672 PolarHBondContact O-N 3.47Å
669	L	97.7	Very high	95.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.8	-45.5	174.1	-69.7	173.2	0	0	0	111.2	A647 V650 T654 A665 A666 I667 I671 A672 C673 A681 L684 L685	A647-L669 HydrophobicContact CB-CD2 3.89Å; V650-L669 HydrophobicContact CG2-CD1 4.14Å; V650-L669 HydrophobicContact CG2-CD2 3.45Å; V650-L669 VanDerWaalsContact CG2-CD2 3.45Å; V650-L669 HydrophobicContact CG2-CG 3.66Å; T654-L669 HydrophobicContact CG2-CD1 4.4Å; A665-L669 WeakPolarHBondContact O-CG 3.26Å; A665-L669 PolarHBondContact O-N 2.79Å; A666-L669 PolarHBondContact O-N 3.36Å; I667-L669 VanDerWaalsContact C-N 3.32Å; I667-L669 PolarHBondContact O-N 3.07Å; L669-I671 VanDerWaalsContact C-N 3.34Å; L669-I671 PolarHBondContact O-N 3.44Å; L669-A672 PolarHBondContact O-N 2.97Å; L669-C673 WeakPolarHBondContact O-CA 3.39Å; L669-C673 WeakPolarHBondContact O-CB 3.41Å; L669-C673 PolarHBondContact O-N 3.16Å; L669-A681 HydrophobicContact CD2-CB 4.14Å; L669-L684 HydrophobicContact CD1-CB 3.83Å; L669-L684 HydrophobicContact CD1-CD1 4.13Å; L669-L684 HydrophobicContact CD2-CD1 4.44Å; L669-L685 HydrophobicContact CB-CD1 4.11Å; L669-L685 HydrophobicContact CB-CD2 4.32Å; L669-L685 HydrophobicContact CB-CG 4.32Å; L669-L685 HydrophobicContact CD1-CD1 4.44Å; L669-L685 HydrophobicContact CD1-CD2 3.98Å; L669-L685 HydrophobicContact CD1-CG 3.83Å
670	G	96.6	Very high	95.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.5	-43.9	177.6	0	0	0	0	0	113.2	A666 I667 A674	A666-G670 PolarHBondContact O-N 3.48Å; I667-G670 PolarHBondContact O-N 3Å; G670-A674 WeakPolarHBondContact O-CB 3.37Å; G670-A674 PolarHBondContact O-N 2.96Å
671	I	96.4	Very high	95.4	Very high	2 Å²	2	18 Å²	18	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-70.1	-47.2	178.9	-66.7	169	0	0	0	111.4	F637 I667 S668 L669 L761 L780	F637-I671 HydrophobicContact CD1-CG2 4.31Å; F637-I671 HydrophobicContact CD2-CD1 4.21Å; F637-I671 HydrophobicContact CE1-CG2 4.44Å; F637-I671 HydrophobicContact CE2-CD1 3.74Å; F637-I671 HydrophobicContact CG-CG2 4.45Å; F637-I671 HydrophobicContact CZ-CD1 4Å; I667-I671 HydrophobicContact CG2-CD1 3.7Å; I667-I671 HydrophobicContact CG2-CG1 4.25Å; I667-I671 WeakPolarHBondContact O-CG1 3.5Å; I667-I671 PolarHBondContact O-N 3.38Å; S668-I671 PolarHBondContact O-N 3.16Å; L669-I671 VanDerWaalsContact C-N 3.34Å; L669-I671 PolarHBondContact O-N 3.44Å; I671-L761 HydrophobicContact CG2-CD1 3.42Å; I671-L761 VanDerWaalsContact CG2-CD1 3.42Å; I671-L780 HydrophobicContact CD1-CD1 3.99Å; I671-L780 HydrophobicContact CD1-CD2 4.21Å; I671-L780 HydrophobicContact CD1-CG 4.49Å
672	A	94.7	Very high	95.3	Very high	5 Å²	5	18.1 Å²	18.1	4%	0.041	11%	0.108	C	C	.	.	H	α-helix	trans	-73.2	-32.8	-175.6	0	0	0	0	0	112.8	C646 S668 L669	C646-A672 HydrophobicContact CB-CB 3.83Å; C646-A672 VanDerWaalsContact SG-CB 3.57Å; S668-A672 WeakPolarHBondContact O-CB 3.35Å; S668-A672 PolarHBondContact O-N 3.47Å; L669-A672 PolarHBondContact O-N 2.97Å
673	C	94.6	Very high	95.2	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	17.7	-172.4	-53.5	0	0	0	0	112.7	L669 G675 T676 L678 A681 V707	L669-C673 WeakPolarHBondContact O-CA 3.39Å; L669-C673 WeakPolarHBondContact O-CB 3.41Å; L669-C673 PolarHBondContact O-N 3.16Å; C673-G675 PolarHBondContact O-N 2.88Å; C673-T676 WeakPolarHBondContact CA-OG1 3.15Å; C673-T676 WeakPolarHBondContact CB-OG1 3.49Å; C673-T676 PolarHBondContact O-N 3.28Å; C673-T676 VanDerWaalsContact O-N 3.13Å; C673-T676 PolarHBondContact O-OG1 3.36Å; C673-L678 HydrophobicContact CB-CB 4.49Å; C673-A681 HydrophobicContact CB-CB 4.11Å; C673-V707 HydrophobicContact CB-CG2 3.93Å
674	A	93.3	Very high	95.1	Very high	18 Å²	18	25.6 Å²	25.6	15%	0.149	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	126	179.7	0	0	0	0	0	111.4	G670 T676 M706 I759	G670-A674 WeakPolarHBondContact O-CB 3.37Å; G670-A674 PolarHBondContact O-N 2.96Å; A674-T676 PolarHBondContact O-N 2.84Å; A674-M706 CarbonylContact C-O 3.59Å; A674-M706 WeakPolarHBondContact CA-O 3.18Å; A674-M706 HydrophobicContact CB-CB 4.35Å; A674-I759 HydrophobicContact CB-CB 4.12Å; A674-I759 HydrophobicContact CB-CG2 4.14Å
675	G	90.2	Very high	95.2	Very high	25 Å²	25	25.6 Å²	25.6	26%	0.258	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	19	-179.5	0	0	0	0	0	115.6	C673 M706 H711	C673-G675 PolarHBondContact O-N 2.88Å; G675-M706 PolarHBondContact N-O 3.3Å; G675-H711 PolarHBondContact O-NE2 3.25Å
676	T	89.8	Confident	95.1	Very high	62 Å²	62	28.7 Å²	28.7	38%	0.38	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-21.4	179.8	65.3	0	0	0	0	114	C673 A674 L678	C673-T676 WeakPolarHBondContact CA-OG1 3.15Å; C673-T676 WeakPolarHBondContact CB-OG1 3.49Å; C673-T676 PolarHBondContact O-N 3.28Å; C673-T676 VanDerWaalsContact O-N 3.13Å; C673-T676 PolarHBondContact O-OG1 3.36Å; A674-T676 PolarHBondContact O-N 2.84Å; T676-L678 PolarHBondContact O-N 3.5Å; T676-L678 VanDerWaalsContact O-N 3.11Å; T676-L678 PolarHBondContact OG1-N 3.45Å
677	A	90.3	Very high	95	Very high	8 Å²	8	32.8 Å²	32.8	7%	0.066	18%	0.18	C	C	.	.			trans	41.9	39.2	-166.1	0	0	0	0	0	114.8	P679 I682 V707 Y708 H711 T716	A677-P679 WeakPolarHBondContact O-CD 3.27Å; A677-I682 HydrophobicContact CB-CD1 4.22Å; A677-I682 WeakPolarHBondContact O-CD1 3.43Å; A677-V707 PolarHBondContact N-O 2.91Å; A677-V707 VanDerWaalsContact N-O 3.13Å; A677-Y708 HydrophobicContact CB-CD1 4.27Å; A677-H711 WeakPolarHBondContact CB-CE1 3.39Å; A677-H711 VanDerWaalsContact CB-ND1 3.32Å; A677-H711 WeakPolarHBondContact CB-ND1 3.44Å; A677-H711 WeakPolarHBondContact CB-NE2 3.35Å; A677-H711 PolarHBondContact N-NE2 3.04Å; A677-T716 HydrophobicContact CB-CG2 4.38Å
678	L	93.2	Very high	94.9	Very high	25 Å²	25	33.1 Å²	33.1	13%	0.131	18%	0.182	C	C	.	.			trans	-56.1	120.8	-179.1	-175.7	70.4	0	0	0	111	P643 A647 C673 T676 E680 A681 I682	P643-L678 HydrophobicContact CB-CD2 4.44Å; A647-L678 HydrophobicContact CB-CD2 4.26Å; C673-L678 HydrophobicContact CB-CB 4.49Å; T676-L678 PolarHBondContact O-N 3.5Å; T676-L678 VanDerWaalsContact O-N 3.11Å; T676-L678 PolarHBondContact OG1-N 3.45Å; L678-E680 VanDerWaalsContact C-N 3.29Å; L678-E680 VanDerWaalsContact CD1-OE2 3.23Å; L678-E680 WeakPolarHBondContact CD1-OE2 3.39Å; L678-E680 HydrophobicContact CD2-CB 4.45Å; L678-E680 HydrophobicContact CG-CB 4.42Å; L678-E680 WeakPolarHBondContact CG-OE2 3.42Å; L678-E680 PolarHBondContact O-N 2.85Å; L678-A681 HydrophobicContact CB-CB 4.08Å; L678-A681 HydrophobicContact CD2-CB 4.3Å; L678-A681 HydrophobicContact CG-CB 4.48Å; L678-A681 PolarHBondContact O-N 3.45Å; L678-A681 VanDerWaalsContact O-N 3.09Å; L678-I682 WeakPolarHBondContact O-CG1 3.32Å; L678-I682 PolarHBondContact O-N 3.33Å
679	P	93.6	Very high	94.8	Very high	89 Å²	89	34.4 Å²	34.4	58%	0.578	19%	0.188	S	C	*	.	H	α-helix	trans	-57.2	-38.8	-176	-28	36.2	0	0	0	114	A677 I682 Y683	A677-P679 WeakPolarHBondContact O-CD 3.27Å; P679-I682 PolarHBondContact O-N 2.9Å; P679-Y683 WeakPolarHBondContact O-CB 3.43Å; P679-Y683 PolarHBondContact O-N 3.04Å
680	E	93.9	Very high	94.7	Very high	97 Å²	97	41 Å²	41	45%	0.453	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-41.4	177.9	-64.9	81.1	176.2	0	0	111.6	A647 L678 Y683 L684	A647-E680 HydrophobicContact CB-CB 4.38Å; L678-E680 VanDerWaalsContact C-N 3.29Å; L678-E680 VanDerWaalsContact CD1-OE2 3.23Å; L678-E680 WeakPolarHBondContact CD1-OE2 3.39Å; L678-E680 HydrophobicContact CD2-CB 4.45Å; L678-E680 HydrophobicContact CG-CB 4.42Å; L678-E680 WeakPolarHBondContact CG-OE2 3.42Å; L678-E680 PolarHBondContact O-N 2.85Å; E680-Y683 PolarHBondContact O-N 2.99Å; E680-L684 WeakPolarHBondContact O-CG 3.45Å; E680-L684 PolarHBondContact O-N 3.32Å; E680-L684 VanDerWaalsContact O-N 3.16Å
681	A	95.1	Very high	94.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-41	176.6	0	0	0	0	0	111.2	L669 C673 L678 L684 L685	L669-A681 HydrophobicContact CD2-CB 4.14Å; C673-A681 HydrophobicContact CB-CB 4.11Å; L678-A681 HydrophobicContact CB-CB 4.08Å; L678-A681 HydrophobicContact CD2-CB 4.3Å; L678-A681 HydrophobicContact CG-CB 4.48Å; L678-A681 PolarHBondContact O-N 3.45Å; L678-A681 VanDerWaalsContact O-N 3.09Å; A681-L684 PolarHBondContact O-N 3.49Å; A681-L685 WeakPolarHBondContact O-CB 3.35Å; A681-L685 VanDerWaalsContact O-CG 3.28Å; A681-L685 WeakPolarHBondContact O-CG 3.4Å; A681-L685 PolarHBondContact O-N 3.38Å
682	I	96.2	Very high	94.7	Very high	6 Å²	6	47 Å²	47	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-46.7	176.1	-67.1	164.8	0	0	0	110.5	A677 L678 P679 L684 L685 E686 L704 V707 Y708 K718	A677-I682 HydrophobicContact CB-CD1 4.22Å; A677-I682 WeakPolarHBondContact O-CD1 3.43Å; L678-I682 WeakPolarHBondContact O-CG1 3.32Å; L678-I682 PolarHBondContact O-N 3.33Å; P679-I682 PolarHBondContact O-N 2.9Å; I682-L684 PolarHBondContact O-N 2.96Å; I682-L685 PolarHBondContact O-N 2.9Å; I682-E686 HydrophobicContact CG2-CG 3.95Å; I682-E686 VanDerWaalsContact CG2-OE1 3.29Å; I682-E686 WeakPolarHBondContact CG2-OE1 3.49Å; I682-E686 WeakPolarHBondContact O-CB 3.25Å; I682-E686 WeakPolarHBondContact O-CG 3.5Å; I682-E686 PolarHBondContact O-N 2.96Å; I682-L704 HydrophobicContact CG1-CD2 4.42Å; I682-V707 HydrophobicContact CD1-CG1 4.5Å; I682-V707 HydrophobicContact CG1-CG1 4.01Å; I682-Y708 HydrophobicContact CD1-CD1 4.47Å; I682-Y708 HydrophobicContact CD1-CE1 3.53Å; I682-Y708 HydrophobicContact CG1-CE1 4.11Å; I682-Y708 VanDerWaalsContact CG2-OH 3.29Å; I682-Y708 WeakPolarHBondContact CG2-OH 3.49Å; I682-K718 HydrophobicContact CG2-CD 4.14Å
683	Y	96	Very high	94.8	Very high	173 Å²	173	48.6 Å²	48.6	68%	0.678	28%	0.279	S	S	*	.	H	α-helix	trans	-58.3	-37	178.7	177.5	-97.4	0	0	0	112.5	P679 E680 P687	P679-Y683 WeakPolarHBondContact O-CB 3.43Å; P679-Y683 PolarHBondContact O-N 3.04Å; E680-Y683 PolarHBondContact O-N 2.99Å; Y683-P687 WeakPolarHBondContact O-CD 3.48Å
684	L	97.2	Very high	94.9	Very high	26 Å²	26	51.1 Å²	51.1	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-75.5	-36.6	176.6	-68.2	174.1	0	0	0	113	A647 T654 L669 E680 A681 I682 M688	A647-L684 HydrophobicContact CB-CD1 4.44Å; T654-L684 HydrophobicContact CG2-CB 4.32Å; L669-L684 HydrophobicContact CD1-CB 3.83Å; L669-L684 HydrophobicContact CD1-CD1 4.13Å; L669-L684 HydrophobicContact CD2-CD1 4.44Å; E680-L684 WeakPolarHBondContact O-CG 3.45Å; E680-L684 PolarHBondContact O-N 3.32Å; E680-L684 VanDerWaalsContact O-N 3.16Å; A681-L684 PolarHBondContact O-N 3.49Å; I682-L684 PolarHBondContact O-N 2.96Å; L684-M688 WeakPolarHBondContact O-CG 3.33Å
685	L	98	Very high	95	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-81.7	-34.8	-175.4	-73.1	169.6	0	0	0	113.9	A666 L669 A681 I682 M688 L689 A703 L704 V707	A666-L685 HydrophobicContact CB-CD2 3.74Å; L669-L685 HydrophobicContact CB-CD1 4.11Å; L669-L685 HydrophobicContact CB-CD2 4.32Å; L669-L685 HydrophobicContact CB-CG 4.32Å; L669-L685 HydrophobicContact CD1-CD1 4.44Å; L669-L685 HydrophobicContact CD1-CD2 3.98Å; L669-L685 HydrophobicContact CD1-CG 3.83Å; A681-L685 WeakPolarHBondContact O-CB 3.35Å; A681-L685 VanDerWaalsContact O-CG 3.28Å; A681-L685 WeakPolarHBondContact O-CG 3.4Å; A681-L685 PolarHBondContact O-N 3.38Å; I682-L685 PolarHBondContact O-N 2.9Å; L685-M688 HydrophobicContact CD2-SD 4.41Å; L685-M688 WeakPolarHBondContact O-CB 3.11Å; L685-M688 PolarHBondContact O-N 3.08Å; L685-L689 PolarHBondContact O-N 3.02Å; L685-A703 HydrophobicContact CD1-CB 4.03Å; L685-A703 HydrophobicContact CD2-CB 3.81Å; L685-L704 HydrophobicContact CB-CD1 4.06Å; L685-L704 HydrophobicContact CB-CD2 3.69Å; L685-L704 HydrophobicContact CB-CG 3.7Å; L685-L704 HydrophobicContact CD1-CD2 3.74Å; L685-L704 HydrophobicContact CD1-CG 3.95Å; L685-L704 HydrophobicContact CG-CD2 4.37Å; L685-L704 HydrophobicContact CG-CG 4.41Å; L685-V707 HydrophobicContact CD1-CG2 4.09Å
686	E	96	Very high	95.4	Very high	65 Å²	65	50.9 Å²	50.9	30%	0.304	28%	0.281	S	S	.	.	H	α-helix	trans	-56.3	-47.4	-176.7	-83.9	177.8	172.9	0	0	113.6	I682 M688 L689 K718	I682-E686 HydrophobicContact CG2-CG 3.95Å; I682-E686 VanDerWaalsContact CG2-OE1 3.29Å; I682-E686 WeakPolarHBondContact CG2-OE1 3.49Å; I682-E686 WeakPolarHBondContact O-CB 3.25Å; I682-E686 WeakPolarHBondContact O-CG 3.5Å; I682-E686 PolarHBondContact O-N 2.96Å; E686-M688 PolarHBondContact O-N 3.46Å; E686-L689 WeakPolarHBondContact O-CB 3.39Å; E686-L689 PolarHBondContact O-N 3.3Å; E686-K718 WeakPolarHBondContact OE1-CD 3.3Å; E686-K718 WeakPolarHBondContact OE1-CE 3.42Å; E686-K718 IonicContact OE1-NZ 2.71Å; E686-K718 PolarHBondContact OE1-NZ 3.4Å; E686-K718 IonicContact OE2-NZ 2.82Å; E686-K718 PolarHBondContact OE2-NZ 3.46Å
687	P	96.1	Very high	95.7	Very high	86 Å²	86	49.2 Å²	49.2	56%	0.558	27%	0.268	S	S	*	.	H	α-helix	trans	-59.5	-32.9	176.2	-24.5	35	0	0	0	112.9	Y683 L689 N690	Y683-P687 WeakPolarHBondContact O-CD 3.48Å; P687-L689 PolarHBondContact O-N 2.86Å; P687-N690 PolarHBondContact O-N 3.14Å
688	M	97	Very high	96	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.039	27%	0.267	C	S	.	.	H	α-helix	trans	-71.8	-15.2	-177.5	-54.7	179.6	70.3	0	0	113.3	T654 R662 A666 L684 L685 E686 N690 D691 V696 A700	T654-M688 HydrophobicContact CG2-SD 4.04Å; R662-M688 HydrophobicContact CB-CE 3.91Å; R662-M688 VanDerWaalsContact O-CE 3.27Å; R662-M688 WeakPolarHBondContact O-CE 3.26Å; A666-M688 HydrophobicContact CB-CE 3.86Å; A666-M688 HydrophobicContact CB-SD 4.24Å; L684-M688 WeakPolarHBondContact O-CG 3.33Å; L685-M688 HydrophobicContact CD2-SD 4.41Å; L685-M688 WeakPolarHBondContact O-CB 3.11Å; L685-M688 PolarHBondContact O-N 3.08Å; E686-M688 PolarHBondContact O-N 3.46Å; M688-N690 PolarHBondContact O-N 2.97Å; M688-D691 WeakPolarHBondContact O-CB 3.43Å; M688-D691 PolarHBondContact O-N 3.14Å; M688-D691 VanDerWaalsContact O-N 3.16Å; M688-V696 HydrophobicContact CE-CG1 3.61Å; M688-A700 HydrophobicContact CB-CB 3.72Å
689	L	96.2	Very high	96.2	Very high	27 Å²	27	48.2 Å²	48.2	14%	0.141	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.1	171.1	-66.9	-178.2	0	0	0	112.6	L685 E686 P687 R697 A700 L701 L704 F722	L685-L689 PolarHBondContact O-N 3.02Å; E686-L689 WeakPolarHBondContact O-CB 3.39Å; E686-L689 PolarHBondContact O-N 3.3Å; P687-L689 PolarHBondContact O-N 2.86Å; L689-R697 WeakPolarHBondContact O-CG 3.48Å; L689-R697 PolarHBondContact O-NE 3.17Å; L689-A700 HydrophobicContact CD2-CB 4.04Å; L689-L701 HydrophobicContact CD2-CB 4.48Å; L689-L701 HydrophobicContact CD2-CD2 3.58Å; L689-L701 HydrophobicContact CD2-CG 3.71Å; L689-L704 HydrophobicContact CD1-CD1 3.72Å; L689-L704 HydrophobicContact CD2-CD1 3.9Å; L689-L704 HydrophobicContact CG-CD1 3.88Å; L689-F722 HydrophobicContact CD1-CD2 4.46Å; L689-F722 HydrophobicContact CD1-CE2 4.43Å
690	N	95.1	Very high	96.4	Very high	140 Å²	140	44 Å²	44	75%	0.749	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.9	20.5	177.9	-59.2	-57.3	0	0	0	112.4	P687 M688	P687-N690 PolarHBondContact O-N 3.14Å; M688-N690 PolarHBondContact O-N 2.97Å
691	D	97	Very high	96.6	Very high	28 Å²	28	39.6 Å²	39.6	15%	0.15	21%	0.213	C	C	.	.			trans	-57.5	147.1	176.4	-167	-75.3	0	0	0	111.3	R662 M688 V693 V696 R697	R662-D691 IonicContact CZ-OD1 3.71Å; R662-D691 IonicContact CZ-OD2 2.66Å; R662-D691 IonicContact NE-OD1 2.84Å; R662-D691 IonicContact NE-OD2 2.87Å; R662-D691 PolarHBondContact NE-OD2 3.01Å; R662-D691 IonicContact NH2-OD1 3.33Å; R662-D691 PolarHBondContact NH2-OD1 3.4Å; R662-D691 IonicContact NH2-OD2 2.77Å; R662-D691 PolarHBondContact NH2-OD2 3.38Å; M688-D691 WeakPolarHBondContact O-CB 3.43Å; M688-D691 PolarHBondContact O-N 3.14Å; M688-D691 VanDerWaalsContact O-N 3.16Å; D691-V693 PolarHBondContact O-N 3.44Å; D691-V693 VanDerWaalsContact O-N 3.13Å; D691-V693 WeakPolarHBondContact OD1-CB 3.38Å; D691-V693 PolarHBondContact OD1-N 3.41Å; D691-V696 HydrophobicContact CB-CB 4.12Å; D691-V696 HydrophobicContact CB-CG1 3.94Å; D691-R697 HydrophobicContact CB-CG 3.99Å; D691-R697 WeakPolarHBondContact O-CD 3.4Å; D691-R697 WeakPolarHBondContact O-CG 3.32Å
692	A	95.3	Very high	96.8	Very high	100 Å²	100	39.8 Å²	39.8	83%	0.826	21%	0.214	S	C	*	.	S	Bend	trans	-62.1	-21.7	177.9	0	0	0	0	0	113.4
693	V	97	Very high	96.9	Very high	37 Å²	37	39.5 Å²	39.5	22%	0.224	21%	0.213	C	C	.	.	S	Bend	trans	-105	117.6	-175.3	-177.8	0	0	0	0	111.2	P659 D691 F695 V696 R697	P659-V693 HydrophobicContact CB-CB 4.17Å; P659-V693 HydrophobicContact CB-CG1 4.01Å; P659-V693 HydrophobicContact CB-CG2 3.94Å; P659-V693 HydrophobicContact CG-CG2 3.85Å; D691-V693 PolarHBondContact O-N 3.44Å; D691-V693 VanDerWaalsContact O-N 3.13Å; D691-V693 WeakPolarHBondContact OD1-CB 3.38Å; D691-V693 PolarHBondContact OD1-N 3.41Å; V693-F695 VanDerWaalsContact C-N 3.34Å; V693-F695 HydrophobicContact CG1-CD1 3.34Å; V693-F695 HydrophobicContact CG1-CD2 4.23Å; V693-F695 HydrophobicContact CG1-CE1 3.23Å; V693-F695 HydrophobicContact CG1-CE2 4.16Å; V693-F695 HydrophobicContact CG1-CG 3.89Å; V693-F695 HydrophobicContact CG1-CZ 3.71Å; V693-F695 PolarHBondContact O-N 2.81Å; V693-V696 HydrophobicContact CB-CB 4.37Å; V693-V696 HydrophobicContact CB-CG2 3.9Å; V693-V696 HydrophobicContact CG1-CG2 4.02Å; V693-V696 WeakPolarHBondContact O-CB 3.32Å; V693-V696 PolarHBondContact O-N 2.71Å; V693-R697 PolarHBondContact O-N 3.04Å; V693-R697 VanDerWaalsContact O-N 3.17Å
694	N	95.8	Very high	97	Very high	54 Å²	54	31.3 Å²	31.3	29%	0.289	18%	0.18	S	C	.	.	H	α-helix	trans	-61.1	-34.1	-171.9	-67.7	-39	0	0	0	115.1	V696 R697 Q698 D736 L738	N694-V696 VanDerWaalsContact C-N 3.32Å; N694-R697 WeakPolarHBondContact O-CB 3.28Å; N694-R697 PolarHBondContact O-N 3.21Å; N694-R697 PolarHBondContact OD1-NH1 3.21Å; N694-R697 VanDerWaalsContact OD1-NH1 3.13Å; N694-Q698 PolarHBondContact O-N 3.18Å; N694-D736 HydrophobicContact CB-CB 4.1Å; N694-D736 WeakPolarHBondContact CB-OD1 3.43Å; N694-D736 VanDerWaalsContact CG-CB 3.46Å; N694-D736 VanDerWaalsContact ND2-CB 3.29Å; N694-D736 WeakPolarHBondContact ND2-CB 3.37Å; N694-L738 HydrophobicContact CB-CB 4.44Å
695	F	95.9	Very high	97	Very high	37 Å²	37	30 Å²	30	16%	0.162	17%	0.174	C	C	.	.	H	α-helix	trans	-71.5	-29.4	176	69.1	-109.9	0	0	0	112.1	P659 Y663 V693 R697 Q698 G699 L738 W783	P659-F695 HydrophobicContact CB-CE1 4.43Å; P659-F695 HydrophobicContact CB-CE2 3.97Å; P659-F695 HydrophobicContact CB-CZ 3.59Å; Y663-F695 HydrophobicContact CD2-CD2 4.05Å; Y663-F695 WeakPolarHBondContact CD2-O 3.5Å; Y663-F695 WeakPolarHBondContact CE2-O 3.43Å; Y663-F695 HydrophobicContact CG-CD2 4.26Å; V693-F695 VanDerWaalsContact C-N 3.34Å; V693-F695 HydrophobicContact CG1-CD1 3.34Å; V693-F695 HydrophobicContact CG1-CD2 4.23Å; V693-F695 HydrophobicContact CG1-CE1 3.23Å; V693-F695 HydrophobicContact CG1-CE2 4.16Å; V693-F695 HydrophobicContact CG1-CG 3.89Å; V693-F695 HydrophobicContact CG1-CZ 3.71Å; V693-F695 PolarHBondContact O-N 2.81Å; F695-R697 VanDerWaalsContact C-N 3.34Å; F695-Q698 WeakPolarHBondContact O-CB 3.26Å; F695-Q698 PolarHBondContact O-N 3.36Å; F695-G699 PolarHBondContact O-N 2.91Å; F695-L738 HydrophobicContact CB-CD1 4.28Å; F695-W783 HydrophobicContact CB-CH2 3.66Å; F695-W783 HydrophobicContact CB-CZ3 3.79Å; F695-W783 AromaticContact CD1-CH2 3.99Å; F695-W783 HydrophobicContact CD1-CH2 3.99Å; F695-W783 AromaticContact CD2-CH2 3.31Å; F695-W783 HydrophobicContact CD2-CH2 3.31Å; F695-W783 AromaticContact CD2-CZ3 3.69Å; F695-W783 HydrophobicContact CD2-CZ3 3.69Å; F695-W783 HydrophobicContact CE1-CH2 4.36Å; F695-W783 AromaticContact CE2-CH2 3.75Å; F695-W783 HydrophobicContact CE2-CH2 3.75Å; F695-W783 HydrophobicContact CE2-CZ3 4.41Å; F695-W783 AromaticContact CG-CH2 3.4Å; F695-W783 HydrophobicContact CG-CH2 3.4Å; F695-W783 VanDerWaalsContact CG-CH2 3.4Å; F695-W783 HydrophobicContact CG-CZ2 4.43Å; F695-W783 AromaticContact CG-CZ3 3.93Å; F695-W783 HydrophobicContact CG-CZ3 3.93Å; F695-W783 HydrophobicContact CZ-CH2 4.23Å
696	V	97.9	Very high	96.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66	-43.6	173.3	-179.5	0	0	0	0	109.1	P659 R662 M688 D691 V693 N694 Q698 G699 A700	P659-V696 HydrophobicContact CB-CG2 3.82Å; P659-V696 VanDerWaalsContact O-CG2 3.28Å; P659-V696 WeakPolarHBondContact O-CG2 3.4Å; R662-V696 HydrophobicContact CB-CG1 3.9Å; R662-V696 HydrophobicContact CB-CG2 4.3Å; M688-V696 HydrophobicContact CE-CG1 3.61Å; D691-V696 HydrophobicContact CB-CB 4.12Å; D691-V696 HydrophobicContact CB-CG1 3.94Å; V693-V696 HydrophobicContact CB-CB 4.37Å; V693-V696 HydrophobicContact CB-CG2 3.9Å; V693-V696 HydrophobicContact CG1-CG2 4.02Å; V693-V696 WeakPolarHBondContact O-CB 3.32Å; V693-V696 PolarHBondContact O-N 2.71Å; N694-V696 VanDerWaalsContact C-N 3.32Å; V696-Q698 VanDerWaalsContact C-N 3.34Å; V696-Q698 PolarHBondContact O-N 3.12Å; V696-G699 PolarHBondContact O-N 3.39Å; V696-G699 VanDerWaalsContact O-N 3.13Å; V696-A700 PolarHBondContact O-N 3.19Å
697	R	97.8	Very high	96.9	Very high	28 Å²	28	27 Å²	27	11%	0.106	16%	0.16	C	C	.	.	H	α-helix	trans	-58.3	-44.3	172.5	-61.3	176.1	57.2	-146.9	3.3	112	L689 D691 V693 N694 F695 G699 A700 L701 E735	L689-R697 WeakPolarHBondContact O-CG 3.48Å; L689-R697 PolarHBondContact O-NE 3.17Å; D691-R697 HydrophobicContact CB-CG 3.99Å; D691-R697 WeakPolarHBondContact O-CD 3.4Å; D691-R697 WeakPolarHBondContact O-CG 3.32Å; V693-R697 PolarHBondContact O-N 3.04Å; V693-R697 VanDerWaalsContact O-N 3.17Å; N694-R697 WeakPolarHBondContact O-CB 3.28Å; N694-R697 PolarHBondContact O-N 3.21Å; N694-R697 PolarHBondContact OD1-NH1 3.21Å; N694-R697 VanDerWaalsContact OD1-NH1 3.13Å; F695-R697 VanDerWaalsContact C-N 3.34Å; R697-G699 VanDerWaalsContact C-N 3.32Å; R697-G699 PolarHBondContact O-N 3.43Å; R697-A700 PolarHBondContact O-N 2.97Å; R697-L701 WeakPolarHBondContact O-CB 3.19Å; R697-L701 WeakPolarHBondContact O-CD1 3.32Å; R697-L701 VanDerWaalsContact O-CG 3.23Å; R697-L701 WeakPolarHBondContact O-CG 3.29Å; R697-L701 PolarHBondContact O-N 3.3Å; R697-E735 IonicContact CZ-OE1 3.65Å; R697-E735 IonicContact CZ-OE2 2.67Å; R697-E735 IonicContact NH1-OE1 3.77Å; R697-E735 PolarHBondContact NH1-OE1 3.38Å; R697-E735 IonicContact NH1-OE2 3.29Å; R697-E735 IonicContact NH2-OE1 3.52Å; R697-E735 PolarHBondContact NH2-OE1 3.41Å; R697-E735 VanDerWaalsContact NH2-OE1 3.14Å; R697-E735 IonicContact NH2-OE2 2.86Å; R697-E735 PolarHBondContact NH2-OE2 3.46Å
698	Q	96.4	Very high	96.9	Very high	12 Å²	12	23.1 Å²	23.1	6%	0.056	13%	0.134	C	C	.	.	H	α-helix	trans	-55.4	-47.4	173.5	179.6	-169.5	21.7	0	0	111.3	N694 F695 V696 L701 I702 L738 F741	N694-Q698 PolarHBondContact O-N 3.18Å; F695-Q698 WeakPolarHBondContact O-CB 3.26Å; F695-Q698 PolarHBondContact O-N 3.36Å; V696-Q698 VanDerWaalsContact C-N 3.34Å; V696-Q698 PolarHBondContact O-N 3.12Å; Q698-L701 PolarHBondContact O-N 3.16Å; Q698-I702 HydrophobicContact CG-CD1 4.07Å; Q698-I702 WeakPolarHBondContact O-CG1 3.16Å; Q698-I702 PolarHBondContact O-N 3.04Å; Q698-L738 WeakPolarHBondContact CB-O 3.25Å; Q698-L738 WeakPolarHBondContact CG-O 3.47Å; Q698-F741 HydrophobicContact CG-CD1 4.38Å
699	G	97.2	Very high	96.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-43.1	176.5	0	0	0	0	0	112.9	Y663 F695 V696 R697 I702 A703	Y663-G699 VanDerWaalsContact CE2-CA 3.46Å; F695-G699 PolarHBondContact O-N 2.91Å; V696-G699 PolarHBondContact O-N 3.39Å; V696-G699 VanDerWaalsContact O-N 3.13Å; R697-G699 VanDerWaalsContact C-N 3.32Å; R697-G699 PolarHBondContact O-N 3.43Å; G699-I702 PolarHBondContact O-N 3.47Å; G699-A703 WeakPolarHBondContact O-CB 3.47Å; G699-A703 PolarHBondContact O-N 3.17Å
700	A	98.3	Very high	96.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-41.2	177.7	0	0	0	0	0	112.6	M688 L689 V696 R697 A703 L704	M688-A700 HydrophobicContact CB-CB 3.72Å; L689-A700 HydrophobicContact CD2-CB 4.04Å; V696-A700 PolarHBondContact O-N 3.19Å; R697-A700 PolarHBondContact O-N 2.97Å; A700-A703 PolarHBondContact O-N 3.47Å; A700-L704 WeakPolarHBondContact O-CB 3.24Å; A700-L704 PolarHBondContact O-N 3.14Å
701	L	98.3	Very high	96	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-48.4	175.3	-71.9	160.7	0	0	0	111.4	L689 R697 Q698 G705 F722 L726 A739 A743 A746	L689-L701 HydrophobicContact CD2-CB 4.48Å; L689-L701 HydrophobicContact CD2-CD2 3.58Å; L689-L701 HydrophobicContact CD2-CG 3.71Å; R697-L701 WeakPolarHBondContact O-CB 3.19Å; R697-L701 WeakPolarHBondContact O-CD1 3.32Å; R697-L701 VanDerWaalsContact O-CG 3.23Å; R697-L701 WeakPolarHBondContact O-CG 3.29Å; R697-L701 PolarHBondContact O-N 3.3Å; Q698-L701 PolarHBondContact O-N 3.16Å; L701-G705 PolarHBondContact O-N 3.15Å; L701-F722 HydrophobicContact CD2-CE2 4.32Å; L701-L726 HydrophobicContact CD2-CD2 3.56Å; L701-A739 VanDerWaalsContact CD1-O 3.26Å; L701-A739 WeakPolarHBondContact CD1-O 3.41Å; L701-A743 HydrophobicContact CD1-CB 4.2Å; L701-A743 HydrophobicContact CD2-CB 4.45Å; L701-A746 VanDerWaalsContact O-CB 3.29Å; L701-A746 WeakPolarHBondContact O-CB 3.3Å
702	I	97.9	Very high	95.5	Very high	5 Å²	5	18.2 Å²	18.2	3%	0.026	11%	0.106	C	C	.	.	H	α-helix	trans	-62.8	-45.6	177.5	-68.4	170.5	0	0	0	110.3	Q698 G699 G705 M706 I745 I749 F779	Q698-I702 HydrophobicContact CG-CD1 4.07Å; Q698-I702 WeakPolarHBondContact O-CG1 3.16Å; Q698-I702 PolarHBondContact O-N 3.04Å; G699-I702 PolarHBondContact O-N 3.47Å; I702-G705 WeakPolarHBondContact O-CA 3.36Å; I702-G705 PolarHBondContact O-N 2.68Å; I702-G705 VanDerWaalsContact O-N 3.16Å; I702-M706 HydrophobicContact CG2-CE 3.85Å; I702-M706 HydrophobicContact CG2-SD 4.44Å; I702-M706 WeakPolarHBondContact O-CG 3.3Å; I702-M706 PolarHBondContact O-N 3.12Å; I702-I745 HydrophobicContact CD1-CG2 4.33Å; I702-I745 HydrophobicContact CG1-CB 4.3Å; I702-I745 HydrophobicContact CG1-CG2 4.12Å; I702-I749 HydrophobicContact CG2-CD1 3.94Å; I702-F779 HydrophobicContact CG2-CE1 4.22Å; I702-F779 HydrophobicContact CG2-CZ 4.1Å
703	A	98.1	Very high	95	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-61.7	-46	179.8	0	0	0	0	0	112.3	A666 L685 G699 A700 G705 M706 V707	A666-A703 HydrophobicContact CB-CB 4.49Å; A666-A703 WeakPolarHBondContact O-CB 3.45Å; L685-A703 HydrophobicContact CD1-CB 4.03Å; L685-A703 HydrophobicContact CD2-CB 3.81Å; G699-A703 WeakPolarHBondContact O-CB 3.47Å; G699-A703 PolarHBondContact O-N 3.17Å; A700-A703 PolarHBondContact O-N 3.47Å; A703-G705 VanDerWaalsContact C-N 3.29Å; A703-G705 PolarHBondContact O-N 3.06Å; A703-M706 WeakPolarHBondContact O-CB 3.48Å; A703-M706 PolarHBondContact O-N 3.25Å; A703-M706 VanDerWaalsContact O-N 3.15Å; A703-V707 VanDerWaalsContact O-CG2 3.3Å; A703-V707 WeakPolarHBondContact O-CG2 3.09Å; A703-V707 PolarHBondContact O-N 2.9Å
704	L	97.9	Very high	94.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.5	-35.2	173.8	-78.5	173	0	0	0	112.2	I682 L685 L689 A700 M706 V707 Y708 F722	I682-L704 HydrophobicContact CG1-CD2 4.42Å; L685-L704 HydrophobicContact CB-CD1 4.06Å; L685-L704 HydrophobicContact CB-CD2 3.69Å; L685-L704 HydrophobicContact CB-CG 3.7Å; L685-L704 HydrophobicContact CD1-CD2 3.74Å; L685-L704 HydrophobicContact CD1-CG 3.95Å; L685-L704 HydrophobicContact CG-CD2 4.37Å; L685-L704 HydrophobicContact CG-CG 4.41Å; L689-L704 HydrophobicContact CD1-CD1 3.72Å; L689-L704 HydrophobicContact CD2-CD1 3.9Å; L689-L704 HydrophobicContact CG-CD1 3.88Å; A700-L704 WeakPolarHBondContact O-CB 3.24Å; A700-L704 PolarHBondContact O-N 3.14Å; L704-M706 VanDerWaalsContact C-N 3.31Å; L704-M706 PolarHBondContact O-N 2.68Å; L704-V707 PolarHBondContact O-N 3.2Å; L704-Y708 HydrophobicContact CB-CD2 4.28Å; L704-Y708 HydrophobicContact CB-CE2 4.41Å; L704-Y708 HydrophobicContact CD2-CD2 4.33Å; L704-Y708 HydrophobicContact CD2-CE2 3.85Å; L704-Y708 WeakPolarHBondContact O-CB 3.43Å; L704-Y708 WeakPolarHBondContact O-CD2 3.45Å; L704-Y708 PolarHBondContact O-N 3.21Å; L704-F722 HydrophobicContact CB-CD2 4.3Å; L704-F722 HydrophobicContact CB-CE1 4.05Å; L704-F722 HydrophobicContact CB-CE2 3.6Å; L704-F722 HydrophobicContact CB-CZ 3.45Å; L704-F722 VanDerWaalsContact CB-CZ 3.45Å; L704-F722 HydrophobicContact CD1-CD2 4.21Å; L704-F722 HydrophobicContact CD1-CE2 3.88Å; L704-F722 HydrophobicContact CG-CE2 4.4Å
705	G	97	Very high	93.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.1	-43.4	170.6	0	0	0	0	0	112.4	L701 I702 A703 M709 I749	L701-G705 PolarHBondContact O-N 3.15Å; I702-G705 WeakPolarHBondContact O-CA 3.36Å; I702-G705 PolarHBondContact O-N 2.68Å; I702-G705 VanDerWaalsContact O-N 3.16Å; A703-G705 VanDerWaalsContact C-N 3.29Å; A703-G705 PolarHBondContact O-N 3.06Å; G705-M709 WeakPolarHBondContact O-CG 3.47Å; G705-M709 PolarHBondContact O-N 3.48Å; G705-I749 WeakPolarHBondContact O-CG2 3.06Å
706	M	97.2	Very high	93.4	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-66.3	-44.6	174.5	-63.3	176	169.1	0	0	111.8	A674 G675 I702 A703 L704 Y708 M709 I749 I759 L776 F779 L792	A674-M706 CarbonylContact C-O 3.59Å; A674-M706 WeakPolarHBondContact CA-O 3.18Å; A674-M706 HydrophobicContact CB-CB 4.35Å; G675-M706 PolarHBondContact N-O 3.3Å; I702-M706 HydrophobicContact CG2-CE 3.85Å; I702-M706 HydrophobicContact CG2-SD 4.44Å; I702-M706 WeakPolarHBondContact O-CG 3.3Å; I702-M706 PolarHBondContact O-N 3.12Å; A703-M706 WeakPolarHBondContact O-CB 3.48Å; A703-M706 PolarHBondContact O-N 3.25Å; A703-M706 VanDerWaalsContact O-N 3.15Å; L704-M706 VanDerWaalsContact C-N 3.31Å; L704-M706 PolarHBondContact O-N 2.68Å; M706-Y708 PolarHBondContact O-N 3.16Å; M706-M709 WeakPolarHBondContact O-CG 3.49Å; M706-M709 PolarHBondContact O-N 3.19Å; M706-I749 HydrophobicContact CE-CD1 4.19Å; M706-I749 HydrophobicContact CG-CD1 4.13Å; M706-I749 HydrophobicContact CG-CG2 4.25Å; M706-I759 HydrophobicContact CB-CD1 4.39Å; M706-I759 HydrophobicContact CE-CD1 4.19Å; M706-I759 HydrophobicContact CG-CD1 3.75Å; M706-I759 HydrophobicContact SD-CD1 4.46Å; M706-L776 HydrophobicContact CE-CD2 4.16Å; M706-F779 HydrophobicContact CE-CD1 4.1Å; M706-F779 HydrophobicContact CE-CE1 3.47Å; M706-F779 VanDerWaalsContact CE-CE1 3.47Å; M706-F779 HydrophobicContact CE-CZ 4.17Å; M706-L792 HydrophobicContact CE-CD1 4.34Å
707	V	96.1	Very high	93	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.7	-39.3	-177.1	169.6	0	0	0	0	112.4	C673 A677 I682 L685 A703 L704	C673-V707 HydrophobicContact CB-CG2 3.93Å; A677-V707 PolarHBondContact N-O 2.91Å; A677-V707 VanDerWaalsContact N-O 3.13Å; I682-V707 HydrophobicContact CD1-CG1 4.5Å; I682-V707 HydrophobicContact CG1-CG1 4.01Å; L685-V707 HydrophobicContact CD1-CG2 4.09Å; A703-V707 VanDerWaalsContact O-CG2 3.3Å; A703-V707 WeakPolarHBondContact O-CG2 3.09Å; A703-V707 PolarHBondContact O-N 2.9Å; L704-V707 PolarHBondContact O-N 3.2Å
708	Y	95.2	Very high	92.6	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.016	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	6.3	-178	-73.2	-50.2	0	0	0	114.6	A677 I682 L704 M706 Q710 H711 T716 K718 V719 F722	A677-Y708 HydrophobicContact CB-CD1 4.27Å; I682-Y708 HydrophobicContact CD1-CD1 4.47Å; I682-Y708 HydrophobicContact CD1-CE1 3.53Å; I682-Y708 HydrophobicContact CG1-CE1 4.11Å; I682-Y708 VanDerWaalsContact CG2-OH 3.29Å; I682-Y708 WeakPolarHBondContact CG2-OH 3.49Å; L704-Y708 HydrophobicContact CB-CD2 4.28Å; L704-Y708 HydrophobicContact CB-CE2 4.41Å; L704-Y708 HydrophobicContact CD2-CD2 4.33Å; L704-Y708 HydrophobicContact CD2-CE2 3.85Å; L704-Y708 WeakPolarHBondContact O-CB 3.43Å; L704-Y708 WeakPolarHBondContact O-CD2 3.45Å; L704-Y708 PolarHBondContact O-N 3.21Å; M706-Y708 PolarHBondContact O-N 3.16Å; Y708-Q710 PolarHBondContact O-N 3.39Å; Y708-H711 PolarHBondContact O-N 3.04Å; Y708-T716 HydrophobicContact CD1-CG2 4.37Å; Y708-T716 HydrophobicContact CE1-CG2 3.82Å; Y708-K718 HydrophobicContact CE1-CB 4.5Å; Y708-K718 WeakPolarHBondContact OH-CB 3.49Å; Y708-V719 HydrophobicContact CD1-CG2 3.4Å; Y708-V719 VanDerWaalsContact CD1-CG2 3.4Å; Y708-V719 HydrophobicContact CE1-CG2 3.9Å; Y708-V719 HydrophobicContact CG-CG2 3.89Å; Y708-F722 HydrophobicContact CD2-CB 4.15Å; Y708-F722 AromaticContact CD2-CD1 3.55Å; Y708-F722 HydrophobicContact CD2-CD1 3.55Å; Y708-F722 HydrophobicContact CD2-CE1 4.07Å; Y708-F722 AromaticContact CD2-CG 3.87Å; Y708-F722 HydrophobicContact CD2-CG 3.87Å; Y708-F722 HydrophobicContact CE2-CB 3.9Å; Y708-F722 HydrophobicContact CE2-CD1 4.08Å; Y708-F722 HydrophobicContact CE2-CD2 4.45Å; Y708-F722 AromaticContact CE2-CG 3.89Å; Y708-F722 HydrophobicContact CE2-CG 3.89Å
709	M	93.1	Very high	92.3	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	130.8	177.4	-76.1	-172.3	85.9	0	0	111.2	G705 M706 H711 I749 A752 V757 I759 F796	G705-M709 WeakPolarHBondContact O-CG 3.47Å; G705-M709 PolarHBondContact O-N 3.48Å; M706-M709 WeakPolarHBondContact O-CG 3.49Å; M706-M709 PolarHBondContact O-N 3.19Å; M709-H711 PolarHBondContact O-CD2 2.85Å; M709-H711 PolarHBondContact O-N 2.85Å; M709-I749 HydrophobicContact CE-CG2 4.2Å; M709-I749 VanDerWaalsContact CE-O 3.28Å; M709-I749 WeakPolarHBondContact CE-O 3.3Å; M709-I749 HydrophobicContact CG-CG2 3.63Å; M709-I749 HydrophobicContact SD-CG2 3.56Å; M709-I749 VanDerWaalsContact SD-CG2 3.56Å; M709-A752 HydrophobicContact CE-CB 3.99Å; M709-V757 HydrophobicContact CE-CG2 4.5Å; M709-V757 VanDerWaalsContact CE-O 3.24Å; M709-V757 WeakPolarHBondContact CE-O 3.38Å; M709-I759 HydrophobicContact CE-CG1 4.17Å; M709-I759 HydrophobicContact SD-CB 3.93Å; M709-I759 HydrophobicContact SD-CD1 3.57Å; M709-I759 VanDerWaalsContact SD-CD1 3.57Å; M709-I759 HydrophobicContact SD-CG1 3.54Å; M709-I759 VanDerWaalsContact SD-CG1 3.54Å; M709-I759 PolarHBondContact SD-N 2.99Å; M709-F796 HydrophobicContact CE-CE1 4.28Å
710	Q	88.1	Confident	92	Very high	73 Å²	73	31.1 Å²	31.1	34%	0.341	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	4.7	178.6	-56.3	-168	-18.2	0	0	117.3	Y708 R755 V757 T799	Y708-Q710 PolarHBondContact O-N 3.39Å; Q710-R755 PolarHBondContact NE2-O 2.94Å; Q710-V757 PolarHBondContact NE2-O 2.96Å; Q710-V757 VanDerWaalsContact NE2-O 3.07Å; Q710-T799 VanDerWaalsContact NE2-CG2 3.3Å; Q710-T799 PolarHBondContact NE2-OG1 3.19Å; Q710-T799 VanDerWaalsContact OE1-CG2 3.23Å
711	H	89	Confident	91.7	Very high	16 Å²	16	36.3 Å²	36.3	7%	0.074	19%	0.191	C	C	.	.			trans	-76.7	128.1	172	-80	-103.2	0	0	0	110.8	G675 A677 Y708 M709 T716 V719	G675-H711 PolarHBondContact O-NE2 3.25Å; A677-H711 WeakPolarHBondContact CB-CE1 3.39Å; A677-H711 VanDerWaalsContact CB-ND1 3.32Å; A677-H711 WeakPolarHBondContact CB-ND1 3.44Å; A677-H711 WeakPolarHBondContact CB-NE2 3.35Å; A677-H711 PolarHBondContact N-NE2 3.04Å; Y708-H711 PolarHBondContact O-N 3.04Å; M709-H711 PolarHBondContact O-CD2 2.85Å; M709-H711 PolarHBondContact O-N 2.85Å; H711-T716 PolarHBondContact ND1-OG1 3.05Å; H711-V719 HydrophobicContact CB-CG2 3.86Å
712	S	85.5	Confident	91.5	Very high	9 Å²	9	36.5 Å²	36.5	6%	0.063	19%	0.192	C	C	.	.			trans	-79.5	160.4	173.7	63.9	0	0	0	0	111.5	A714 M715 T716 L823	S712-A714 PolarHBondContact O-N 3.45Å; S712-M715 PolarHBondContact O-N 3.25Å; S712-M715 WeakPolarHBondContact OG-CB 3.31Å; S712-M715 PolarHBondContact OG-N 3.36Å; S712-T716 PolarHBondContact O-N 3.44Å; S712-L823 WeakPolarHBondContact CB-O 3.37Å; S712-L823 PolarHBondContact OG-O 3.14Å
713	E	85.7	Confident	91.3	Very high	70 Å²	70	37.8 Å²	37.8	33%	0.327	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-30.3	174.5	-59.5	-170.8	178.5	0	0	112	T716 P717 K720	E713-T716 CarbonylContact O-C 3.56Å; E713-P717 VanDerWaalsContact O-CA 3.3Å; E713-P717 WeakPolarHBondContact O-CA 3.5Å; E713-K720 HydrophobicContact CG-CB 4.11Å; E713-K720 WeakPolarHBondContact OE2-CD 3.31Å; E713-K720 IonicContact OE2-NZ 3.11Å
714	A	83.9	Confident	91.1	Very high	54 Å²	54	40.7 Å²	40.7	45%	0.446	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-41.2	177.2	0	0	0	0	0	111.8	S712 S822 L823	S712-A714 PolarHBondContact O-N 3.45Å; A714-S822 WeakPolarHBondContact CB-O 3.32Å; A714-L823 HydrophobicContact CB-CD2 4.17Å
715	M	83.8	Confident	90.9	Very high	99 Å²	99	42.3 Å²	42.3	49%	0.488	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-39.5	177.6	-172.1	178	-177.1	0	0	111.8	S712 L823	S712-M715 PolarHBondContact O-N 3.25Å; S712-M715 WeakPolarHBondContact OG-CB 3.31Å; S712-M715 PolarHBondContact OG-N 3.36Å; M715-L823 HydrophobicContact CB-CD2 4.39Å
716	T	88	Confident	90.8	Very high	22 Å²	22	42.3 Å²	42.3	14%	0.135	23%	0.232	C	C	.	.			trans	-142.8	92.5	-176.6	-51.9	0	0	0	0	110.3	A677 Y708 H711 S712 E713 K718 V719	A677-T716 HydrophobicContact CB-CG2 4.38Å; Y708-T716 HydrophobicContact CD1-CG2 4.37Å; Y708-T716 HydrophobicContact CE1-CG2 3.82Å; H711-T716 PolarHBondContact ND1-OG1 3.05Å; S712-T716 PolarHBondContact O-N 3.44Å; E713-T716 CarbonylContact O-C 3.56Å; T716-K718 HydrophobicContact CG2-CB 4.42Å; T716-K718 PolarHBondContact O-N 2.96Å; T716-K718 VanDerWaalsContact O-N 3.08Å; T716-V719 HydrophobicContact CG2-CG2 4.11Å; T716-V719 WeakPolarHBondContact O-CB 3.41Å; T716-V719 VanDerWaalsContact O-CG2 3.31Å; T716-V719 WeakPolarHBondContact O-CG2 3.36Å; T716-V719 PolarHBondContact O-N 3.41Å
717	P	87.8	Confident	90.7	Very high	90 Å²	90	43.7 Å²	43.7	58%	0.584	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-32.2	-175.2	-29.5	35.8	0	0	0	114.4	E713 V719 K720	E713-P717 VanDerWaalsContact O-CA 3.3Å; E713-P717 WeakPolarHBondContact O-CA 3.5Å; P717-V719 PolarHBondContact O-N 3.38Å; P717-V719 VanDerWaalsContact O-N 3.12Å; P717-K720 WeakPolarHBondContact O-CB 3.45Å; P717-K720 PolarHBondContact O-N 3.45Å; P717-K720 VanDerWaalsContact O-N 3.13Å
718	K	90.6	Very high	90.6	Very high	87 Å²	87	51.2 Å²	51.2	38%	0.378	27%	0.271	S	S	.	.	H	α-helix	trans	-59.1	-22.7	178.5	-70.5	-175.3	160.2	-154.7	0	114.2	I682 E686 Y708 T716 K720 D721 F722	I682-K718 HydrophobicContact CG2-CD 4.14Å; E686-K718 WeakPolarHBondContact OE1-CD 3.3Å; E686-K718 WeakPolarHBondContact OE1-CE 3.42Å; E686-K718 IonicContact OE1-NZ 2.71Å; E686-K718 PolarHBondContact OE1-NZ 3.4Å; E686-K718 IonicContact OE2-NZ 2.82Å; E686-K718 PolarHBondContact OE2-NZ 3.46Å; Y708-K718 HydrophobicContact CE1-CB 4.5Å; Y708-K718 WeakPolarHBondContact OH-CB 3.49Å; T716-K718 HydrophobicContact CG2-CB 4.42Å; T716-K718 PolarHBondContact O-N 2.96Å; T716-K718 VanDerWaalsContact O-N 3.08Å; K718-K720 PolarHBondContact O-N 3.17Å; K718-D721 PolarHBondContact O-N 3.09Å; K718-F722 WeakPolarHBondContact O-CB 3.35Å; K718-F722 PolarHBondContact O-N 3.42Å
719	V	89.8	Confident	90.5	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-58.9	-37.3	177	175.6	0	0	0	0	110.9	Y708 H711 T716 P717 F722 R723	Y708-V719 HydrophobicContact CD1-CG2 3.4Å; Y708-V719 VanDerWaalsContact CD1-CG2 3.4Å; Y708-V719 HydrophobicContact CE1-CG2 3.9Å; Y708-V719 HydrophobicContact CG-CG2 3.89Å; H711-V719 HydrophobicContact CB-CG2 3.86Å; T716-V719 HydrophobicContact CG2-CG2 4.11Å; T716-V719 WeakPolarHBondContact O-CB 3.41Å; T716-V719 VanDerWaalsContact O-CG2 3.31Å; T716-V719 WeakPolarHBondContact O-CG2 3.36Å; T716-V719 PolarHBondContact O-N 3.41Å; P717-V719 PolarHBondContact O-N 3.38Å; P717-V719 VanDerWaalsContact O-N 3.12Å; V719-F722 PolarHBondContact O-N 3.4Å; V719-R723 WeakPolarHBondContact O-CG 3.47Å; V719-R723 PolarHBondContact O-N 2.76Å
720	K	90.6	Very high	90.5	Very high	115 Å²	115	51.8 Å²	51.8	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-48.8	177	-174.3	-179.4	-168	152.5	0	111.5	E713 P717 K718 F722 R723 A724	E713-K720 HydrophobicContact CG-CB 4.11Å; E713-K720 WeakPolarHBondContact OE2-CD 3.31Å; E713-K720 IonicContact OE2-NZ 3.11Å; P717-K720 WeakPolarHBondContact O-CB 3.45Å; P717-K720 PolarHBondContact O-N 3.45Å; P717-K720 VanDerWaalsContact O-N 3.13Å; K718-K720 PolarHBondContact O-N 3.17Å; K720-F722 VanDerWaalsContact C-N 3.3Å; K720-F722 PolarHBondContact O-N 3.32Å; K720-R723 PolarHBondContact O-N 3.45Å; K720-A724 PolarHBondContact O-N 2.92Å
721	D	92	Very high	90.7	Very high	108 Å²	108	49.6 Å²	49.6	58%	0.578	27%	0.268	S	S	*	.	H	α-helix	trans	-63.5	-39.8	178.7	-62.7	-33.1	0	0	0	110.9	K718 A724 S725	K718-D721 PolarHBondContact O-N 3.09Å; D721-A724 PolarHBondContact O-N 3.2Å; D721-S725 WeakPolarHBondContact O-CB 3.42Å; D721-S725 PolarHBondContact O-N 2.89Å
722	F	95.2	Very high	90.9	Very high	9 Å²	9	51.9 Å²	51.9	4%	0.039	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-48.9	175.5	-178.3	-118.6	0	0	0	111.3	L689 L701 L704 Y708 K718 V719 K720 A724 S725 L726 A746 L750	L689-F722 HydrophobicContact CD1-CD2 4.46Å; L689-F722 HydrophobicContact CD1-CE2 4.43Å; L701-F722 HydrophobicContact CD2-CE2 4.32Å; L704-F722 HydrophobicContact CB-CD2 4.3Å; L704-F722 HydrophobicContact CB-CE1 4.05Å; L704-F722 HydrophobicContact CB-CE2 3.6Å; L704-F722 HydrophobicContact CB-CZ 3.45Å; L704-F722 VanDerWaalsContact CB-CZ 3.45Å; L704-F722 HydrophobicContact CD1-CD2 4.21Å; L704-F722 HydrophobicContact CD1-CE2 3.88Å; L704-F722 HydrophobicContact CG-CE2 4.4Å; Y708-F722 HydrophobicContact CD2-CB 4.15Å; Y708-F722 AromaticContact CD2-CD1 3.55Å; Y708-F722 HydrophobicContact CD2-CD1 3.55Å; Y708-F722 HydrophobicContact CD2-CE1 4.07Å; Y708-F722 AromaticContact CD2-CG 3.87Å; Y708-F722 HydrophobicContact CD2-CG 3.87Å; Y708-F722 HydrophobicContact CE2-CB 3.9Å; Y708-F722 HydrophobicContact CE2-CD1 4.08Å; Y708-F722 HydrophobicContact CE2-CD2 4.45Å; Y708-F722 AromaticContact CE2-CG 3.89Å; Y708-F722 HydrophobicContact CE2-CG 3.89Å; K718-F722 WeakPolarHBondContact O-CB 3.35Å; K718-F722 PolarHBondContact O-N 3.42Å; V719-F722 PolarHBondContact O-N 3.4Å; K720-F722 VanDerWaalsContact C-N 3.3Å; K720-F722 PolarHBondContact O-N 3.32Å; F722-A724 VanDerWaalsContact C-N 3.31Å; F722-A724 PolarHBondContact O-N 3Å; F722-S725 CarbonylContact O-C 3.58Å; F722-S725 WeakPolarHBondContact O-CA 3.44Å; F722-S725 WeakPolarHBondContact O-CB 3.49Å; F722-S725 PolarHBondContact O-N 2.67Å; F722-S725 PolarHBondContact O-OG 3.29Å; F722-L726 HydrophobicContact CD1-CD1 4.2Å; F722-L726 HydrophobicContact CD1-CG 4.43Å; F722-L726 HydrophobicContact CE1-CD1 3.78Å; F722-L726 HydrophobicContact CE1-CD2 4.23Å; F722-L726 HydrophobicContact CE1-CG 4.13Å; F722-L726 HydrophobicContact CE2-CD2 3.9Å; F722-L726 HydrophobicContact CE2-CG 4.28Å; F722-L726 HydrophobicContact CZ-CD1 4.1Å; F722-L726 HydrophobicContact CZ-CD2 3.68Å; F722-L726 HydrophobicContact CZ-CG 4.04Å; F722-L726 WeakPolarHBondContact O-CG 3.5Å; F722-L726 PolarHBondContact O-N 3.16Å; F722-A746 HydrophobicContact CZ-CB 4.39Å; F722-L750 HydrophobicContact CD1-CD1 4Å; F722-L750 HydrophobicContact CE1-CD1 3.86Å; F722-L750 HydrophobicContact CE1-CG 4.49Å
723	R	93.1	Very high	90.9	Very high	31 Å²	31	59.4 Å²	59.4	12%	0.117	31%	0.312	C	S	.	.	H	α-helix	trans	-58.5	-42.1	175.5	-75.6	-179.4	175.6	-89.4	-4.4	112.4	V719 K720 S725 L726 I727 L750 D751 R755	V719-R723 WeakPolarHBondContact O-CG 3.47Å; V719-R723 PolarHBondContact O-N 2.76Å; K720-R723 PolarHBondContact O-N 3.45Å; R723-S725 VanDerWaalsContact C-N 3.3Å; R723-S725 PolarHBondContact O-N 3.49Å; R723-L726 PolarHBondContact O-N 3.3Å; R723-I727 PolarHBondContact O-N 2.84Å; R723-I727 VanDerWaalsContact O-N 3.13Å; R723-L750 HydrophobicContact CG-CD1 4.02Å; R723-L750 PolarHBondContact NH2-O 2.59Å; R723-D751 IonicContact CZ-OD1 3.14Å; R723-D751 VanDerWaalsContact CZ-OD1 3.29Å; R723-D751 IonicContact CZ-OD2 3.44Å; R723-D751 IonicContact NH1-OD1 3.81Å; R723-D751 PolarHBondContact NH1-OD1 3.42Å; R723-D751 IonicContact NH1-OD2 2.84Å; R723-D751 PolarHBondContact NH1-OD2 2.89Å; R723-D751 IonicContact NH2-OD1 2.95Å; R723-D751 PolarHBondContact NH2-OD1 2.86Å; R723-D751 IonicContact NH2-OD2 3.37Å; R723-R755 VanDerWaalsContact NH1-NH2 3.13Å
724	A	92.9	Very high	91	Very high	61 Å²	61	64.6 Å²	64.6	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-61.8	-39.6	174.3	0	0	0	0	0	111.7	K720 D721 F722 I727 K728	K720-A724 PolarHBondContact O-N 2.92Å; D721-A724 PolarHBondContact O-N 3.2Å; F722-A724 VanDerWaalsContact C-N 3.31Å; F722-A724 PolarHBondContact O-N 3Å; A724-I727 PolarHBondContact O-N 3.11Å; A724-K728 WeakPolarHBondContact O-CB 3.35Å; A724-K728 PolarHBondContact O-N 2.69Å
725	S	94.5	Very high	91.3	Very high	35 Å²	35	63.9 Å²	63.9	25%	0.245	32%	0.324	C	S	.	.	H	α-helix	trans	-65.4	-37.4	176.4	84.5	0	0	0	0	112.8	D721 F722 R723 K728 T729	D721-S725 WeakPolarHBondContact O-CB 3.42Å; D721-S725 PolarHBondContact O-N 2.89Å; F722-S725 CarbonylContact O-C 3.58Å; F722-S725 WeakPolarHBondContact O-CA 3.44Å; F722-S725 WeakPolarHBondContact O-CB 3.49Å; F722-S725 PolarHBondContact O-N 2.67Å; F722-S725 PolarHBondContact O-OG 3.29Å; R723-S725 VanDerWaalsContact C-N 3.3Å; R723-S725 PolarHBondContact O-N 3.49Å; S725-K728 PolarHBondContact O-N 2.9Å; S725-T729 WeakPolarHBondContact O-CB 3.48Å; S725-T729 PolarHBondContact O-N 2.91Å; S725-T729 PolarHBondContact O-OG1 3.08Å
726	L	95.3	Very high	91.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-51.5	175.7	-66.1	-177.7	0	0	0	110.6	L701 F722 R723 K728 T729 I730 A743 A746 H747 L750	L701-L726 HydrophobicContact CD2-CD2 3.56Å; F722-L726 HydrophobicContact CD1-CD1 4.2Å; F722-L726 HydrophobicContact CD1-CG 4.43Å; F722-L726 HydrophobicContact CE1-CD1 3.78Å; F722-L726 HydrophobicContact CE1-CD2 4.23Å; F722-L726 HydrophobicContact CE1-CG 4.13Å; F722-L726 HydrophobicContact CE2-CD2 3.9Å; F722-L726 HydrophobicContact CE2-CG 4.28Å; F722-L726 HydrophobicContact CZ-CD1 4.1Å; F722-L726 HydrophobicContact CZ-CD2 3.68Å; F722-L726 HydrophobicContact CZ-CG 4.04Å; F722-L726 WeakPolarHBondContact O-CG 3.5Å; F722-L726 PolarHBondContact O-N 3.16Å; R723-L726 PolarHBondContact O-N 3.3Å; L726-K728 VanDerWaalsContact C-N 3.32Å; L726-K728 PolarHBondContact O-N 3.46Å; L726-T729 WeakPolarHBondContact O-CB 3.38Å; L726-T729 PolarHBondContact O-N 3.01Å; L726-I730 VanDerWaalsContact O-CG1 3.27Å; L726-I730 WeakPolarHBondContact O-CG1 3.43Å; L726-I730 PolarHBondContact O-N 3.35Å; L726-A743 HydrophobicContact CD2-CB 3.98Å; L726-A746 HydrophobicContact CD1-CB 4.03Å; L726-A746 HydrophobicContact CD2-CB 3.86Å; L726-H747 VanDerWaalsContact CB-CD2 3.48Å; L726-H747 WeakPolarHBondContact CB-CD2 3.43Å; L726-H747 WeakPolarHBondContact CB-NE2 3.39Å; L726-L750 HydrophobicContact CD1-CD1 3.62Å
727	I	93.7	Very high	91.9	Very high	29 Å²	29	63 Å²	63	15%	0.149	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-42.8	177.6	-65.5	-61.6	0	0	0	111.3	R723 A724 T729 I730 C731 H747 M830	R723-I727 PolarHBondContact O-N 2.84Å; R723-I727 VanDerWaalsContact O-N 3.13Å; A724-I727 PolarHBondContact O-N 3.11Å; I727-T729 PolarHBondContact O-N 3.27Å; I727-I730 PolarHBondContact O-N 2.79Å; I727-C731 VanDerWaalsContact O-CB 3.31Å; I727-C731 WeakPolarHBondContact O-CB 3.41Å; I727-C731 PolarHBondContact O-N 2.67Å; I727-C731 PolarHBondContact O-SG 3.45Å; I727-H747 VanDerWaalsContact CD1-NE2 3.34Å; I727-H747 WeakPolarHBondContact CD1-NE2 3.45Å; I727-M830 HydrophobicContact CD1-CE 3.81Å; I727-M830 HydrophobicContact CG1-CE 3.96Å
728	K	94.1	Very high	92.2	Very high	158 Å²	158	61.6 Å²	61.6	69%	0.687	31%	0.311	S	S	*	.	H	α-helix	trans	-57	-48.7	175.1	-176.4	-176.8	175.4	-173	0	111.5	A724 S725 L726 I730 C731 D732	A724-K728 WeakPolarHBondContact O-CB 3.35Å; A724-K728 PolarHBondContact O-N 2.69Å; S725-K728 PolarHBondContact O-N 2.9Å; L726-K728 VanDerWaalsContact C-N 3.32Å; L726-K728 PolarHBondContact O-N 3.46Å; K728-I730 VanDerWaalsContact C-N 3.33Å; K728-I730 PolarHBondContact O-N 3.33Å; K728-C731 PolarHBondContact O-N 3.42Å; K728-D732 WeakPolarHBondContact O-CB 3.39Å; K728-D732 PolarHBondContact O-N 3.47Å
729	T	93.9	Very high	92.3	Very high	18 Å²	18	57.4 Å²	57.4	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-41	179.2	-55.6	0	0	0	0	111.5	S725 L726 I727 E735 A743	S725-T729 WeakPolarHBondContact O-CB 3.48Å; S725-T729 PolarHBondContact O-N 2.91Å; S725-T729 PolarHBondContact O-OG1 3.08Å; L726-T729 WeakPolarHBondContact O-CB 3.38Å; L726-T729 PolarHBondContact O-N 3.01Å; I727-T729 PolarHBondContact O-N 3.27Å; T729-E735 HydrophobicContact CG2-CG 3.65Å; T729-E735 WeakPolarHBondContact O-CG 3.33Å; T729-A743 HydrophobicContact CG2-CB 4.01Å
730	I	93.3	Very high	92.6	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-43.1	179.8	-66.2	167.8	0	0	0	111.3	I367 L726 I727 K728 K740 A743 I744	I367-I730 HydrophobicContact CD1-CD1 4.27Å; I367-I730 HydrophobicContact CG1-CD1 4.03Å; I367-I730 HydrophobicContact CG1-CG2 4.29Å; I367-I730 HydrophobicContact CG2-CG2 4.35Å; L726-I730 VanDerWaalsContact O-CG1 3.27Å; L726-I730 WeakPolarHBondContact O-CG1 3.43Å; L726-I730 PolarHBondContact O-N 3.35Å; I727-I730 PolarHBondContact O-N 2.79Å; K728-I730 VanDerWaalsContact C-N 3.33Å; K728-I730 PolarHBondContact O-N 3.33Å; I730-K740 PolarHBondContact O-NZ 2.9Å; I730-A743 HydrophobicContact CD1-CB 4.09Å; I730-A743 HydrophobicContact CG1-CB 3.76Å; I730-I744 HydrophobicContact CD1-CG1 3.8Å; I730-I744 HydrophobicContact CG1-CG1 3.94Å
731	C	92.7	Very high	92.8	Very high	27 Å²	27	52.8 Å²	52.8	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-77.2	-22.9	-176.1	-66.5	0	0	0	0	113.6	Y370 I727 K728 K733	Y370-C731 HydrophobicContact CD1-CB 3.94Å; Y370-C731 HydrophobicContact CE1-CB 3.95Å; Y370-C731 HydrophobicContact CG-CB 4.32Å; I727-C731 VanDerWaalsContact O-CB 3.31Å; I727-C731 WeakPolarHBondContact O-CB 3.41Å; I727-C731 PolarHBondContact O-N 2.67Å; I727-C731 PolarHBondContact O-SG 3.45Å; K728-C731 PolarHBondContact O-N 3.42Å; C731-K733 PolarHBondContact O-N 2.94Å
732	D	91.6	Very high	93	Very high	64 Å²	64	47.6 Å²	47.6	34%	0.342	25%	0.245	S	C	.	.			trans	-65.2	124.9	177.8	-169.7	-21.7	0	0	0	110.7	K728 H734 E735 K740	K728-D732 WeakPolarHBondContact O-CB 3.39Å; K728-D732 PolarHBondContact O-N 3.47Å; D732-H734 VanDerWaalsContact C-N 3.33Å; D732-H734 PolarHBondContact OD1-N 3.43Å; D732-E735 HydrophobicContact CB-CB 3.96Å; D732-K740 WeakPolarHBondContact O-CE 3.45Å; D732-K740 PolarHBondContact O-NZ 2.9Å
733	K	87	Confident	93.1	Very high	166 Å²	166	47.2 Å²	47.2	72%	0.722	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.5	-178.3	-67.7	179.9	-178.4	172.9	0	113.3	C731	C731-K733 PolarHBondContact O-N 2.94Å
734	H	87.9	Confident	93.3	Very high	179 Å²	179	45.7 Å²	45.7	83%	0.829	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-3.9	-175.8	-61.5	-64.4	0	0	0	113	D732	D732-H734 VanDerWaalsContact C-N 3.33Å; D732-H734 PolarHBondContact OD1-N 3.43Å
735	E	90	Very high	93.5	Very high	39 Å²	39	42.8 Å²	42.8	18%	0.182	21%	0.213	C	C	.	.	S	Bend	trans	-73.4	143.7	-179.6	-171.9	60.8	-93.9	0	0	112.5	R697 T729 D732 A739 K740	R697-E735 IonicContact CZ-OE1 3.65Å; R697-E735 IonicContact CZ-OE2 2.67Å; R697-E735 IonicContact NH1-OE1 3.77Å; R697-E735 PolarHBondContact NH1-OE1 3.38Å; R697-E735 IonicContact NH1-OE2 3.29Å; R697-E735 IonicContact NH2-OE1 3.52Å; R697-E735 PolarHBondContact NH2-OE1 3.41Å; R697-E735 VanDerWaalsContact NH2-OE1 3.14Å; R697-E735 IonicContact NH2-OE2 2.86Å; R697-E735 PolarHBondContact NH2-OE2 3.46Å; T729-E735 HydrophobicContact CG2-CG 3.65Å; T729-E735 WeakPolarHBondContact O-CG 3.33Å; D732-E735 HydrophobicContact CB-CB 3.96Å; E735-A739 HydrophobicContact CG-CB 4.15Å; E735-K740 HydrophobicContact CB-CG 4.26Å; E735-K740 HydrophobicContact CG-CG 3.97Å
736	D	93	Very high	93.6	Very high	56 Å²	56	41.1 Å²	41.1	30%	0.299	20%	0.202	S	C	.	.			trans	-69.3	149.6	-176.3	-178	-100.5	0	0	0	112.7	N694 L738 A739 K740	N694-D736 HydrophobicContact CB-CB 4.1Å; N694-D736 WeakPolarHBondContact CB-OD1 3.43Å; N694-D736 VanDerWaalsContact CG-CB 3.46Å; N694-D736 VanDerWaalsContact ND2-CB 3.29Å; N694-D736 WeakPolarHBondContact ND2-CB 3.37Å; D736-L738 VanDerWaalsContact C-N 3.28Å; D736-L738 PolarHBondContact O-N 3.28Å; D736-L738 VanDerWaalsContact OD1-CB 3.31Å; D736-L738 WeakPolarHBondContact OD1-CB 3.26Å; D736-L738 PolarHBondContact OD1-N 3.24Å; D736-A739 PolarHBondContact O-N 3.02Å; D736-K740 WeakPolarHBondContact O-CG 3.49Å; D736-K740 PolarHBondContact O-N 3.14Å
737	S	91.7	Very high	93.6	Very high	46 Å²	46	41.2 Å²	41.2	32%	0.322	20%	0.202	S	C	.	.	H	α-helix	trans	-62.4	-32.3	-176.8	-59.2	0	0	0	0	113.2	N373 F741	N373-S737 WeakPolarHBondContact ND2-CB 3.45Å; N373-S737 PolarHBondContact ND2-OG 2.87Å; S737-F741 WeakPolarHBondContact O-CB 3.46Å; S737-F741 PolarHBondContact O-N 3.26Å
738	L	92.7	Very high	93.7	Very high	61 Å²	61	39.9 Å²	39.9	32%	0.319	20%	0.195	S	C	.	.	H	α-helix	trans	-75.8	-41.2	178.4	-64.4	174.8	0	0	0	111.8	N694 F695 Q698 D736 K740 F741 G742	N694-L738 HydrophobicContact CB-CB 4.44Å; F695-L738 HydrophobicContact CB-CD1 4.28Å; Q698-L738 WeakPolarHBondContact CB-O 3.25Å; Q698-L738 WeakPolarHBondContact CG-O 3.47Å; D736-L738 VanDerWaalsContact C-N 3.28Å; D736-L738 PolarHBondContact O-N 3.28Å; D736-L738 VanDerWaalsContact OD1-CB 3.31Å; D736-L738 WeakPolarHBondContact OD1-CB 3.26Å; D736-L738 PolarHBondContact OD1-N 3.24Å; L738-K740 VanDerWaalsContact C-N 3.33Å; L738-F741 WeakPolarHBondContact O-CB 3.39Å; L738-F741 PolarHBondContact O-N 3.11Å; L738-G742 PolarHBondContact O-N 3.44Å
739	A	93.5	Very high	93.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-44.1	174.1	0	0	0	0	0	110.6	L701 E735 D736 F741 G742 A743	L701-A739 VanDerWaalsContact CD1-O 3.26Å; L701-A739 WeakPolarHBondContact CD1-O 3.41Å; E735-A739 HydrophobicContact CG-CB 4.15Å; D736-A739 PolarHBondContact O-N 3.02Å; A739-F741 PolarHBondContact O-N 2.98Å; A739-G742 PolarHBondContact O-N 3.49Å; A739-A743 PolarHBondContact O-N 3.17Å
740	K	95.7	Very high	93.9	Very high	20 Å²	20	31.7 Å²	31.7	9%	0.087	16%	0.158	C	C	.	.	H	α-helix	trans	-60.2	-44.6	172.3	-71.9	-170.9	179.4	-147.6	0	113	I730 D732 E735 D736 L738 G742 A743 I744	I730-K740 PolarHBondContact O-NZ 2.9Å; D732-K740 WeakPolarHBondContact O-CE 3.45Å; D732-K740 PolarHBondContact O-NZ 2.9Å; E735-K740 HydrophobicContact CB-CG 4.26Å; E735-K740 HydrophobicContact CG-CG 3.97Å; D736-K740 WeakPolarHBondContact O-CG 3.49Å; D736-K740 PolarHBondContact O-N 3.14Å; L738-K740 VanDerWaalsContact C-N 3.33Å; K740-G742 VanDerWaalsContact C-N 3.3Å; K740-G742 PolarHBondContact O-N 2.91Å; K740-A743 PolarHBondContact O-N 3.14Å; K740-I744 VanDerWaalsContact O-CG1 3.23Å; K740-I744 WeakPolarHBondContact O-CG1 3.45Å; K740-I744 PolarHBondContact O-N 3.4Å
741	F	94.9	Very high	93.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56.2	-48.6	175.1	-179.6	-77.4	0	0	0	110.5	V375 A379 Q698 S737 L738 A739 A743 I744 I745 T782 F786	V375-F741 HydrophobicContact CG1-CB 4.23Å; V375-F741 HydrophobicContact CG1-CD2 3.65Å; V375-F741 HydrophobicContact CG1-CE2 4.5Å; V375-F741 HydrophobicContact CG1-CG 4.32Å; A379-F741 HydrophobicContact CB-CD2 3.48Å; A379-F741 VanDerWaalsContact CB-CD2 3.48Å; A379-F741 HydrophobicContact CB-CE2 3.82Å; A379-F741 HydrophobicContact CB-CG 4.11Å; Q698-F741 HydrophobicContact CG-CD1 4.38Å; S737-F741 WeakPolarHBondContact O-CB 3.46Å; S737-F741 PolarHBondContact O-N 3.26Å; L738-F741 WeakPolarHBondContact O-CB 3.39Å; L738-F741 PolarHBondContact O-N 3.11Å; A739-F741 PolarHBondContact O-N 2.98Å; F741-A743 VanDerWaalsContact C-N 3.32Å; F741-A743 PolarHBondContact O-N 3.28Å; F741-I744 PolarHBondContact O-N 2.87Å; F741-I745 HydrophobicContact CD1-CG1 3.84Å; F741-I745 HydrophobicContact CE1-CD1 4.32Å; F741-I745 HydrophobicContact CE1-CG1 3.47Å; F741-I745 VanDerWaalsContact CE1-CG1 3.47Å; F741-I745 HydrophobicContact CE2-CG1 4.48Å; F741-I745 HydrophobicContact CZ-CD1 4.17Å; F741-I745 HydrophobicContact CZ-CG1 3.82Å; F741-I745 WeakPolarHBondContact O-CG1 3.21Å; F741-I745 PolarHBondContact O-N 3.45Å; F741-T782 HydrophobicContact CE1-CG2 4.04Å; F741-T782 HydrophobicContact CZ-CG2 3.86Å; F741-F786 HydrophobicContact CD2-CD1 4.44Å; F741-F786 HydrophobicContact CD2-CE1 4.25Å; F741-F786 AromaticContact CE2-CD1 3.56Å; F741-F786 HydrophobicContact CE2-CD1 3.56Å; F741-F786 AromaticContact CE2-CE1 3.8Å; F741-F786 HydrophobicContact CE2-CE1 3.8Å; F741-F786 HydrophobicContact CE2-CG 4.09Å; F741-F786 AromaticContact CZ-CD1 3.62Å; F741-F786 HydrophobicContact CZ-CD1 3.62Å; F741-F786 HydrophobicContact CZ-CE1 4.03Å; F741-F786 HydrophobicContact CZ-CG 4.42Å
742	G	96	Very high	94	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.2	-43.5	177.5	0	0	0	0	0	112.4	L738 A739 K740 I745 A746	L738-G742 PolarHBondContact O-N 3.44Å; A739-G742 PolarHBondContact O-N 3.49Å; K740-G742 VanDerWaalsContact C-N 3.3Å; K740-G742 PolarHBondContact O-N 2.91Å; G742-I745 PolarHBondContact O-N 3.13Å; G742-A746 VanDerWaalsContact O-CB 3.25Å; G742-A746 WeakPolarHBondContact O-CB 3.44Å; G742-A746 PolarHBondContact O-N 2.8Å
743	A	97.1	Very high	94.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.6	-38.8	179.1	0	0	0	0	0	113	L701 L726 T729 I730 A739 K740 F741 A746 H747	L701-A743 HydrophobicContact CD1-CB 4.2Å; L701-A743 HydrophobicContact CD2-CB 4.45Å; L726-A743 HydrophobicContact CD2-CB 3.98Å; T729-A743 HydrophobicContact CG2-CB 4.01Å; I730-A743 HydrophobicContact CD1-CB 4.09Å; I730-A743 HydrophobicContact CG1-CB 3.76Å; A739-A743 PolarHBondContact O-N 3.17Å; K740-A743 PolarHBondContact O-N 3.14Å; F741-A743 VanDerWaalsContact C-N 3.32Å; F741-A743 PolarHBondContact O-N 3.28Å; A743-A746 PolarHBondContact O-N 3.49Å; A743-H747 PolarHBondContact O-N 3.46Å; A743-H747 VanDerWaalsContact O-N 3.09Å
744	I	97.4	Very high	94.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.9	-47.3	176.9	-67	166.1	0	0	0	110.4	I367 V371 C376 A379 S383 I730 K740 F741 A746 H747 G748	I367-I744 HydrophobicContact CD1-CG2 4.38Å; I367-I744 HydrophobicContact CG2-CD1 3.81Å; I367-I744 HydrophobicContact CG2-CG1 3.74Å; I367-I744 HydrophobicContact CG2-CG2 4.19Å; V371-I744 HydrophobicContact CG2-CD1 3.84Å; C376-I744 HydrophobicContact CB-CD1 3.8Å; A379-I744 VanDerWaalsContact C-CG2 3.42Å; A379-I744 HydrophobicContact CB-CB 3.97Å; A379-I744 HydrophobicContact CB-CD1 4.05Å; A379-I744 HydrophobicContact CB-CG2 3.71Å; A379-I744 WeakPolarHBondContact O-CG2 3.3Å; S383-I744 PolarHBondContact OG-O 3.17Å; I730-I744 HydrophobicContact CD1-CG1 3.8Å; I730-I744 HydrophobicContact CG1-CG1 3.94Å; K740-I744 VanDerWaalsContact O-CG1 3.23Å; K740-I744 WeakPolarHBondContact O-CG1 3.45Å; K740-I744 PolarHBondContact O-N 3.4Å; F741-I744 PolarHBondContact O-N 2.87Å; I744-A746 VanDerWaalsContact C-N 3.31Å; I744-A746 PolarHBondContact O-N 3.34Å; I744-H747 WeakPolarHBondContact O-CB 3.24Å; I744-H747 PolarHBondContact O-N 3.49Å; I744-G748 PolarHBondContact O-N 3.12Å
745	I	97	Very high	94.4	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.7	-38.6	176.9	-63.7	-56.1	0	0	0	111	A379 I382 I702 F741 G742 H747 G748 I749 F779	A379-I745 HydrophobicContact CB-CD1 4.41Å; I382-I745 HydrophobicContact CB-CD1 3.88Å; I382-I745 HydrophobicContact CG2-CD1 3.53Å; I702-I745 HydrophobicContact CD1-CG2 4.33Å; I702-I745 HydrophobicContact CG1-CB 4.3Å; I702-I745 HydrophobicContact CG1-CG2 4.12Å; F741-I745 HydrophobicContact CD1-CG1 3.84Å; F741-I745 HydrophobicContact CE1-CD1 4.32Å; F741-I745 HydrophobicContact CE1-CG1 3.47Å; F741-I745 VanDerWaalsContact CE1-CG1 3.47Å; F741-I745 HydrophobicContact CE2-CG1 4.48Å; F741-I745 HydrophobicContact CZ-CD1 4.17Å; F741-I745 HydrophobicContact CZ-CG1 3.82Å; F741-I745 WeakPolarHBondContact O-CG1 3.21Å; F741-I745 PolarHBondContact O-N 3.45Å; G742-I745 PolarHBondContact O-N 3.13Å; I745-H747 VanDerWaalsContact C-N 3.32Å; I745-H747 PolarHBondContact O-N 3.22Å; I745-G748 CarbonylContact O-C 3.59Å; I745-G748 WeakPolarHBondContact O-CA 3.22Å; I745-G748 PolarHBondContact O-N 3.14Å; I745-G748 VanDerWaalsContact O-N 3.07Å; I745-I749 HydrophobicContact CG2-CD1 3.87Å; I745-I749 HydrophobicContact CG2-CG1 4.26Å; I745-I749 WeakPolarHBondContact O-CG1 3.42Å; I745-I749 PolarHBondContact O-N 3.18Å; I745-F779 HydrophobicContact CG2-CZ 4.49Å
746	A	97.4	Very high	94.5	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.7	-41.2	175.3	0	0	0	0	0	112.1	L701 F722 L726 G742 A743 I744 I749 L750	L701-A746 VanDerWaalsContact O-CB 3.29Å; L701-A746 WeakPolarHBondContact O-CB 3.3Å; F722-A746 HydrophobicContact CZ-CB 4.39Å; L726-A746 HydrophobicContact CD1-CB 4.03Å; L726-A746 HydrophobicContact CD2-CB 3.86Å; G742-A746 VanDerWaalsContact O-CB 3.25Å; G742-A746 WeakPolarHBondContact O-CB 3.44Å; G742-A746 PolarHBondContact O-N 2.8Å; A743-A746 PolarHBondContact O-N 3.49Å; I744-A746 VanDerWaalsContact C-N 3.31Å; I744-A746 PolarHBondContact O-N 3.34Å; A746-I749 PolarHBondContact O-N 3.27Å; A746-L750 VanDerWaalsContact O-CB 3.29Å; A746-L750 WeakPolarHBondContact O-CB 3.3Å; A746-L750 VanDerWaalsContact O-CG 3.27Å; A746-L750 WeakPolarHBondContact O-CG 3.48Å; A746-L750 PolarHBondContact O-N 3.23Å
747	H	95	Very high	94.5	Very high	2 Å²	2	8.3 Å²	8.3	1%	0.009	4%	0.044	C	C	.	.	H	α-helix	trans	-59.8	-45.6	170.4	-96.8	-66.7	0	0	0	112.1	I363 I367 L726 I727 A743 I744 I745 I749 L750 D751	I363-H747 HydrophobicContact CG2-CB 4.44Å; I367-H747 HydrophobicContact CD1-CB 4.39Å; L726-H747 VanDerWaalsContact CB-CD2 3.48Å; L726-H747 WeakPolarHBondContact CB-CD2 3.43Å; L726-H747 WeakPolarHBondContact CB-NE2 3.39Å; I727-H747 VanDerWaalsContact CD1-NE2 3.34Å; I727-H747 WeakPolarHBondContact CD1-NE2 3.45Å; A743-H747 PolarHBondContact O-N 3.46Å; A743-H747 VanDerWaalsContact O-N 3.09Å; I744-H747 WeakPolarHBondContact O-CB 3.24Å; I744-H747 PolarHBondContact O-N 3.49Å; I745-H747 VanDerWaalsContact C-N 3.32Å; I745-H747 PolarHBondContact O-N 3.22Å; H747-I749 VanDerWaalsContact C-N 3.29Å; H747-I749 PolarHBondContact O-N 2.99Å; H747-L750 PolarHBondContact O-N 2.96Å; H747-D751 PolarHBondContact O-N 3.5Å
748	G	95.9	Very high	94.6	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.7	-37.8	177.5	0	0	0	0	0	113.8	S383 L386 I744 I745 A752	S383-G748 WeakPolarHBondContact OG-CA 3.42Å; S383-G748 PolarHBondContact OG-N 3.47Å; L386-G748 WeakPolarHBondContact CB-O 3.03Å; I744-G748 PolarHBondContact O-N 3.12Å; I745-G748 CarbonylContact O-C 3.59Å; I745-G748 WeakPolarHBondContact O-CA 3.22Å; I745-G748 PolarHBondContact O-N 3.14Å; I745-G748 VanDerWaalsContact O-N 3.07Å; G748-A752 WeakPolarHBondContact O-CA 3.46Å; G748-A752 WeakPolarHBondContact O-CB 3.22Å; G748-A752 PolarHBondContact O-N 2.92Å; G748-A752 VanDerWaalsContact O-N 3.17Å
749	I	97.1	Very high	94.6	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-70.4	-47.2	175.8	-68	172.3	0	0	0	110.6	L386 I702 G705 M706 M709 I745 A746 H747 D751 A752 I759 L792	L386-I749 HydrophobicContact CD1-CG1 4.22Å; I702-I749 HydrophobicContact CG2-CD1 3.94Å; G705-I749 WeakPolarHBondContact O-CG2 3.06Å; M706-I749 HydrophobicContact CE-CD1 4.19Å; M706-I749 HydrophobicContact CG-CD1 4.13Å; M706-I749 HydrophobicContact CG-CG2 4.25Å; M709-I749 HydrophobicContact CE-CG2 4.2Å; M709-I749 VanDerWaalsContact CE-O 3.28Å; M709-I749 WeakPolarHBondContact CE-O 3.3Å; M709-I749 HydrophobicContact CG-CG2 3.63Å; M709-I749 HydrophobicContact SD-CG2 3.56Å; M709-I749 VanDerWaalsContact SD-CG2 3.56Å; I745-I749 HydrophobicContact CG2-CD1 3.87Å; I745-I749 HydrophobicContact CG2-CG1 4.26Å; I745-I749 WeakPolarHBondContact O-CG1 3.42Å; I745-I749 PolarHBondContact O-N 3.18Å; A746-I749 PolarHBondContact O-N 3.27Å; H747-I749 VanDerWaalsContact C-N 3.29Å; H747-I749 PolarHBondContact O-N 2.99Å; I749-D751 PolarHBondContact O-N 3.1Å; I749-A752 VanDerWaalsContact O-CB 3.27Å; I749-A752 WeakPolarHBondContact O-CB 3.47Å; I749-A752 PolarHBondContact O-N 3.31Å; I749-I759 HydrophobicContact CG2-CD1 3.96Å; I749-L792 HydrophobicContact CD1-CD2 3.88Å; I749-L792 HydrophobicContact CG1-CD2 3.72Å
750	L	94.6	Very high	94.2	Very high	4 Å²	4	5.2 Å²	5.2	2%	0.021	3%	0.027	C	C	.	.	H	α-helix	trans	-60.2	-33.5	-178.5	-85.4	-178.3	0	0	0	113.8	F722 R723 L726 A746 H747	F722-L750 HydrophobicContact CD1-CD1 4Å; F722-L750 HydrophobicContact CE1-CD1 3.86Å; F722-L750 HydrophobicContact CE1-CG 4.49Å; R723-L750 HydrophobicContact CG-CD1 4.02Å; R723-L750 PolarHBondContact NH2-O 2.59Å; L726-L750 HydrophobicContact CD1-CD1 3.62Å; A746-L750 VanDerWaalsContact O-CB 3.29Å; A746-L750 WeakPolarHBondContact O-CB 3.3Å; A746-L750 VanDerWaalsContact O-CG 3.27Å; A746-L750 WeakPolarHBondContact O-CG 3.48Å; A746-L750 PolarHBondContact O-N 3.23Å; H747-L750 PolarHBondContact O-N 2.96Å
751	D	94.1	Very high	93.8	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.024	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	16.7	-178	-61.4	-37.8	0	0	0	112.3	I363 M387 R723 H747 I749 G754 R755	I363-D751 VanDerWaalsContact CD1-OD2 3.28Å; I363-D751 WeakPolarHBondContact CD1-OD2 3.38Å; M387-D751 WeakPolarHBondContact CA-O 3.47Å; M387-D751 HydrophobicContact CE-CB 4Å; M387-D751 HydrophobicContact CG-CB 3.93Å; M387-D751 HydrophobicContact SD-CB 4.48Å; R723-D751 IonicContact CZ-OD1 3.14Å; R723-D751 VanDerWaalsContact CZ-OD1 3.29Å; R723-D751 IonicContact CZ-OD2 3.44Å; R723-D751 IonicContact NH1-OD1 3.81Å; R723-D751 PolarHBondContact NH1-OD1 3.42Å; R723-D751 IonicContact NH1-OD2 2.84Å; R723-D751 PolarHBondContact NH1-OD2 2.89Å; R723-D751 IonicContact NH2-OD1 2.95Å; R723-D751 PolarHBondContact NH2-OD1 2.86Å; R723-D751 IonicContact NH2-OD2 3.37Å; H747-D751 PolarHBondContact O-N 3.5Å; I749-D751 PolarHBondContact O-N 3.1Å; D751-G754 PolarHBondContact O-N 3.48Å; D751-R755 HydrophobicContact CB-CG 4.42Å; D751-R755 PolarHBondContact O-N 2.76Å; D751-R755 IonicContact OD1-CZ 3.69Å; D751-R755 IonicContact OD1-NE 3.99Å; D751-R755 PolarHBondContact OD1-NE 2.94Å; D751-R755 IonicContact OD1-NH1 2.87Å; D751-R755 IonicContact OD1-NH2 2.69Å; D751-R755 PolarHBondContact OD1-NH2 3.38Å
752	A	95.1	Very high	93.3	Very high	1 Å²	1	6.3 Å²	6.3	1%	0.008	3%	0.033	C	C	.	.	G	3₁₀ helix	trans	-56.9	141.4	-175.7	0	0	0	0	0	112.6	L386 M709 G748 I749 G754 R755 N756 V757 F796	L386-A752 CarbonylContact O-C 3.4Å; L386-A752 VanDerWaalsContact O-CA 3.26Å; L386-A752 WeakPolarHBondContact O-CA 3.42Å; M709-A752 HydrophobicContact CE-CB 3.99Å; G748-A752 WeakPolarHBondContact O-CA 3.46Å; G748-A752 WeakPolarHBondContact O-CB 3.22Å; G748-A752 PolarHBondContact O-N 2.92Å; G748-A752 VanDerWaalsContact O-N 3.17Å; I749-A752 VanDerWaalsContact O-CB 3.27Å; I749-A752 WeakPolarHBondContact O-CB 3.47Å; I749-A752 PolarHBondContact O-N 3.31Å; A752-G754 PolarHBondContact O-N 3.35Å; A752-R755 VanDerWaalsContact O-CA 3.27Å; A752-R755 WeakPolarHBondContact O-CA 3.43Å; A752-R755 PolarHBondContact O-N 3.44Å; A752-N756 PolarHBondContact O-N 2.91Å; A752-V757 VanDerWaalsContact C-CG2 3.48Å; A752-V757 HydrophobicContact CB-CG2 3.48Å; A752-V757 VanDerWaalsContact CB-CG2 3.48Å; A752-V757 WeakPolarHBondContact O-CG2 3.25Å; A752-F796 HydrophobicContact CB-CE1 4Å; A752-F796 HydrophobicContact CB-CE2 3.85Å; A752-F796 HydrophobicContact CB-CZ 3.54Å
753	G	92.4	Very high	92.4	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.037	C	C	.	.	G	3₁₀ helix	trans	55	34.1	178.2	0	0	0	0	0	114.3	L386 M387 R755 N756	L386-G753 PolarHBondContact O-N 3.05Å; M387-G753 CarbonylContact O-C 3.58Å; M387-G753 PolarHBondContact O-N 3.25Å; G753-R755 VanDerWaalsContact C-N 3.27Å; G753-R755 PolarHBondContact O-N 3.26Å; G753-N756 VanDerWaalsContact O-CB 3.28Å; G753-N756 WeakPolarHBondContact O-CB 3.11Å; G753-N756 PolarHBondContact O-N 3.04Å; G753-N756 VanDerWaalsContact O-N 3.14Å; G753-N756 PolarHBondContact O-ND2 3.45Å; G753-N756 VanDerWaalsContact O-ND2 3.08Å
754	G	91.3	Very high	91	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	65.1	30.6	-173.1	0	0	0	0	0	113	H358 M387 D751 A752 N756	H358-G754 PolarHBondContact N-O 3.39Å; M387-G754 PolarHBondContact O-N 2.96Å; D751-G754 PolarHBondContact O-N 3.48Å; A752-G754 PolarHBondContact O-N 3.35Å; G754-N756 VanDerWaalsContact C-N 3.28Å; G754-N756 PolarHBondContact O-ND2 3.22Å
755	R	91	Very high	89.4	Confident	38 Å²	38	13.6 Å²	13.6	14%	0.143	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	69	15.8	-171.1	-62.3	176.4	164.5	-116.5	21	115.9	Q710 R723 D751 A752 G753 Y826	Q710-R755 PolarHBondContact NE2-O 2.94Å; R723-R755 VanDerWaalsContact NH1-NH2 3.13Å; D751-R755 HydrophobicContact CB-CG 4.42Å; D751-R755 PolarHBondContact O-N 2.76Å; D751-R755 IonicContact OD1-CZ 3.69Å; D751-R755 IonicContact OD1-NE 3.99Å; D751-R755 PolarHBondContact OD1-NE 2.94Å; D751-R755 IonicContact OD1-NH1 2.87Å; D751-R755 IonicContact OD1-NH2 2.69Å; D751-R755 PolarHBondContact OD1-NH2 3.38Å; A752-R755 VanDerWaalsContact O-CA 3.27Å; A752-R755 WeakPolarHBondContact O-CA 3.43Å; A752-R755 PolarHBondContact O-N 3.44Å; G753-R755 VanDerWaalsContact C-N 3.27Å; G753-R755 PolarHBondContact O-N 3.26Å; R755-Y826 HydrophobicContact CB-CD1 4.1Å; R755-Y826 HydrophobicContact CB-CE1 4.14Å
756	N	92.3	Very high	88.1	Confident	2 Å²	2	18.7 Å²	18.7	1%	0.011	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	9.8	-178.4	-58.9	-57.6	0	0	0	114.5	F352 Y353 N356 A752 G753 G754 T799 Y826	F352-N756 HydrophobicContact CE1-CB 3.47Å; F352-N756 VanDerWaalsContact CE1-CB 3.47Å; F352-N756 HydrophobicContact CZ-CB 3.51Å; Y353-N756 HydrophobicContact CD1-CB 4.34Å; Y353-N756 HydrophobicContact CE1-CB 4.35Å; N356-N756 PolarHBondContact O-ND2 3.42Å; A752-N756 PolarHBondContact O-N 2.91Å; G753-N756 VanDerWaalsContact O-CB 3.28Å; G753-N756 WeakPolarHBondContact O-CB 3.11Å; G753-N756 PolarHBondContact O-N 3.04Å; G753-N756 VanDerWaalsContact O-N 3.14Å; G753-N756 PolarHBondContact O-ND2 3.45Å; G753-N756 VanDerWaalsContact O-ND2 3.08Å; G754-N756 VanDerWaalsContact C-N 3.28Å; G754-N756 PolarHBondContact O-ND2 3.22Å; N756-T799 PolarHBondContact O-N 3.27Å; N756-T799 PolarHBondContact O-OG1 3.18Å; N756-T799 VanDerWaalsContact O-OG1 3.06Å; N756-Y826 PolarHBondContact OD1-OH 3.23Å
757	V	93.3	Very high	87	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.006	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150.8	175.9	-55.5	0	0	0	0	111.7	Y353 M709 Q710 A752 F796 Q797	Y353-V757 HydrophobicContact CE1-CG1 3.46Å; Y353-V757 VanDerWaalsContact CE1-CG1 3.46Å; Y353-V757 VanDerWaalsContact OH-CG1 3.31Å; Y353-V757 WeakPolarHBondContact OH-CG1 3.4Å; M709-V757 HydrophobicContact CE-CG2 4.5Å; M709-V757 VanDerWaalsContact CE-O 3.24Å; M709-V757 WeakPolarHBondContact CE-O 3.38Å; Q710-V757 PolarHBondContact NE2-O 2.96Å; Q710-V757 VanDerWaalsContact NE2-O 3.07Å; A752-V757 VanDerWaalsContact C-CG2 3.48Å; A752-V757 HydrophobicContact CB-CG2 3.48Å; A752-V757 VanDerWaalsContact CB-CG2 3.48Å; A752-V757 WeakPolarHBondContact O-CG2 3.25Å; V757-F796 HydrophobicContact CB-CB 3.97Å; V757-F796 HydrophobicContact CB-CG 4.28Å; V757-F796 HydrophobicContact CG1-CB 4.28Å; V757-F796 HydrophobicContact CG2-CB 3.96Å; V757-F796 HydrophobicContact CG2-CD1 4.03Å; V757-F796 HydrophobicContact CG2-CD2 3.92Å; V757-F796 HydrophobicContact CG2-CE1 4.49Å; V757-F796 HydrophobicContact CG2-CE2 4.4Å; V757-F796 HydrophobicContact CG2-CG 3.72Å; V757-Q797 VanDerWaalsContact CA-O 3.24Å; V757-Q797 WeakPolarHBondContact CA-O 2.75Å; V757-Q797 WeakPolarHBondContact CB-O 3.4Å
758	T	92.2	Very high	86.4	Confident	28 Å²	28	21 Å²	21	17%	0.172	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	156.3	167.7	-170.2	0	0	0	0	109.8	G760 F796 Q797 T799	T758-G760 PolarHBondContact O-N 3.38Å; T758-F796 WeakPolarHBondContact O-CA 3.44Å; T758-Q797 PolarHBondContact N-O 2.82Å; T758-Q797 PolarHBondContact O-N 3.15Å; T758-T799 HydrophobicContact CG2-CG2 3.83Å
759	I	93.8	Very high	85.9	Confident	6 Å²	6	22.5 Å²	22.5	3%	0.031	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	106.6	168.7	-70.1	163.7	0	0	0	107.4	A674 M706 M709 I749 L776 L792 A795 F796	A674-I759 HydrophobicContact CB-CB 4.12Å; A674-I759 HydrophobicContact CB-CG2 4.14Å; M706-I759 HydrophobicContact CB-CD1 4.39Å; M706-I759 HydrophobicContact CE-CD1 4.19Å; M706-I759 HydrophobicContact CG-CD1 3.75Å; M706-I759 HydrophobicContact SD-CD1 4.46Å; M709-I759 HydrophobicContact CE-CG1 4.17Å; M709-I759 HydrophobicContact SD-CB 3.93Å; M709-I759 HydrophobicContact SD-CD1 3.57Å; M709-I759 VanDerWaalsContact SD-CD1 3.57Å; M709-I759 HydrophobicContact SD-CG1 3.54Å; M709-I759 VanDerWaalsContact SD-CG1 3.54Å; M709-I759 PolarHBondContact SD-N 2.99Å; I749-I759 HydrophobicContact CG2-CD1 3.96Å; I759-L776 HydrophobicContact CG2-CD1 3.74Å; I759-L776 HydrophobicContact CG2-CD2 4.09Å; I759-L776 HydrophobicContact CG2-CG 4.29Å; I759-L792 HydrophobicContact CD1-CD1 3.86Å; I759-L792 HydrophobicContact CD1-CD2 4.31Å; I759-L792 HydrophobicContact CD1-CG 4.37Å; I759-L792 HydrophobicContact CG1-CD1 4.24Å; I759-A795 WeakPolarHBondContact CA-O 3.35Å; I759-A795 HydrophobicContact CG2-CB 4.19Å; I759-F796 HydrophobicContact CD1-CE1 4.26Å; I759-F796 HydrophobicContact CG1-CD1 3.83Å; I759-F796 HydrophobicContact CG1-CE1 3.71Å
760	G	84.7	Confident	85.4	Confident	7 Å²	7	24.6 Å²	24.6	7%	0.072	13%	0.129	C	C	.	.			trans	-116.5	101.5	-177.5	0	0	0	0	0	111.9	T758 L762 A772 A795 Q797	T758-G760 PolarHBondContact O-N 3.38Å; G760-L762 VanDerWaalsContact C-N 3.29Å; G760-A772 WeakPolarHBondContact O-CB 3.23Å; G760-A795 PolarHBondContact N-O 2.96Å; G760-Q797 PolarHBondContact O-NE2 3.31Å
761	L	87.1	Confident	85.2	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.021	14%	0.136	C	C	.	.	S	Bend	trans	-72.5	-29.1	164.8	-80.7	178.3	0	0	0	111.8	F637 V640 I671 V768 S769 A772 A773 L776	F637-L761 HydrophobicContact CD1-CD1 3.94Å; F637-L761 HydrophobicContact CD1-CD2 4.28Å; F637-L761 HydrophobicContact CE1-CD1 4.33Å; F637-L761 HydrophobicContact CE1-CD2 4.25Å; V640-L761 HydrophobicContact CB-CD1 4.09Å; V640-L761 HydrophobicContact CG1-CB 4.34Å; V640-L761 HydrophobicContact CG1-CD1 4.33Å; V640-L761 HydrophobicContact CG2-CB 3.91Å; V640-L761 HydrophobicContact CG2-CD1 3.86Å; V640-L761 HydrophobicContact CG2-CG 4.48Å; I671-L761 HydrophobicContact CG2-CD1 3.42Å; I671-L761 VanDerWaalsContact CG2-CD1 3.42Å; L761-V768 CarbonylContact O-C 3.6Å; L761-V768 WeakPolarHBondContact O-CA 3.3Å; L761-S769 PolarHBondContact O-N 3.01Å; L761-A772 HydrophobicContact CD2-CB 4.22Å; L761-A773 HydrophobicContact CD2-CB 3.8Å; L761-L776 HydrophobicContact CD1-CD1 3.94Å; L761-L776 HydrophobicContact CD2-CD1 3.53Å; L761-L776 HydrophobicContact CG-CD1 3.51Å
762	L	84.8	Confident	85.1	Confident	39 Å²	39	25.9 Å²	25.9	20%	0.204	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-97.3	128.9	176.4	-59.4	176.3	0	0	0	108.8	V640 K641 G760 Y767 V768 Q797	V640-L762 HydrophobicContact CG1-CD2 4.01Å; V640-L762 HydrophobicContact CG1-CG 4.25Å; V640-L762 HydrophobicContact CG2-CD1 4.47Å; V640-L762 HydrophobicContact CG2-CG 4.34Å; K641-L762 HydrophobicContact CG-CD1 4.05Å; K641-L762 HydrophobicContact CG-CD2 3.82Å; G760-L762 VanDerWaalsContact C-N 3.29Å; L762-Y767 CarbonylContact C-O 3.37Å; L762-Y767 VanDerWaalsContact CA-O 3.27Å; L762-Y767 WeakPolarHBondContact CA-O 3.46Å; L762-V768 HydrophobicContact CD2-CG2 3.96Å; L762-Q797 PolarHBondContact O-NE2 2.64Å; L762-Q797 PolarHBondContact O-OE1 3.48Å
763	A	76	Confident	85	Confident	9 Å²	9	25.8 Å²	25.8	7%	0.074	14%	0.136	C	C	.	.			trans	-78.7	171.5	168.9	0	0	0	0	0	110.4	M765 N766 Y767	A763-M765 PolarHBondContact O-N 3.44Å; A763-N766 PolarHBondContact O-N 3.26Å; A763-Y767 PolarHBondContact N-O 3.38Å
764	R	68	Low	85.1	Confident	92 Å²	92	25.8 Å²	25.8	35%	0.347	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-14.7	-173.9	-75.1	-177.5	-104.1	145.5	2.9	116.4	D259 Y349 S914 G915	D259-R764 VanDerWaalsContact CG-NH2 3.33Å; D259-R764 IonicContact OD1-NH2 2.87Å; D259-R764 IonicContact OD2-CZ 3.69Å; D259-R764 VanDerWaalsContact OD2-CZ 3.26Å; D259-R764 IonicContact OD2-NH1 3.95Å; D259-R764 IonicContact OD2-NH2 3.62Å; D259-R764 PolarHBondContact OD2-NH2 3.48Å; Y349-R764 PolarHBondContact OH-NH2 3.27Å; Y349-R764 VanDerWaalsContact OH-NH2 3.17Å; R764-S914 WeakPolarHBondContact CD-O 3.48Å; R764-G915 PolarHBondContact NH1-O 3.49Å
765	M	64.9	Low	85.2	Confident	52 Å²	52	25.8 Å²	25.8	26%	0.256	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	30.2	174.2	-64.6	-164	-173	0	0	113.4	Q221 D256 A763 Y767	Q221-M765 HydrophobicContact CG-SD 4.47Å; Q221-M765 PolarHBondContact NE2-SD 2.9Å; D256-M765 HydrophobicContact CB-CE 4.02Å; D256-M765 WeakPolarHBondContact OD2-CE 3.41Å; A763-M765 PolarHBondContact O-N 3.44Å; M765-Y767 HydrophobicContact CB-CD2 3.52Å; M765-Y767 HydrophobicContact CB-CE2 3.37Å; M765-Y767 HydrophobicContact CG-CE2 4.34Å; M765-Y767 PolarHBondContact O-N 2.8Å; M765-Y767 VanDerWaalsContact O-N 3.12Å; M765-Y767 HydrophobicContact SD-CE2 4.15Å
766	N	68.8	Low	85.5	Confident	108 Å²	108	24 Å²	24	58%	0.578	13%	0.13	S	C	*	.	S	Bend	trans	57	24.9	-178.3	-68.8	-24.7	0	0	0	114.5	K641 A763	K641-N766 WeakPolarHBondContact CE-O 3.31Å; K641-N766 PolarHBondContact NZ-O 2.92Å; A763-N766 PolarHBondContact O-N 3.26Å
767	Y	74	Confident	85.7	Confident	14 Å²	14	23.9 Å²	23.9	6%	0.055	13%	0.129	C	C	.	.			trans	-86.6	144.1	172.3	-65.3	-60.7	0	0	0	110.8	I188 Q221 Y225 L762 A763 M765 S769	I188-Y767 HydrophobicContact CG2-CE1 4.08Å; Q221-Y767 PolarHBondContact OE1-OH 3.02Å; Y225-Y767 HydrophobicContact CE2-CD1 4.3Å; Y225-Y767 AromaticContact CE2-CE1 3.55Å; Y225-Y767 HydrophobicContact CE2-CE1 3.55Å; Y225-Y767 AromaticContact CZ-CE1 3.77Å; Y225-Y767 WeakPolarHBondContact OH-CD1 3.28Å; Y225-Y767 VanDerWaalsContact OH-CE1 3.24Å; Y225-Y767 WeakPolarHBondContact OH-CE1 3.46Å; L762-Y767 CarbonylContact C-O 3.37Å; L762-Y767 VanDerWaalsContact CA-O 3.27Å; L762-Y767 WeakPolarHBondContact CA-O 3.46Å; A763-Y767 PolarHBondContact N-O 3.38Å; M765-Y767 HydrophobicContact CB-CD2 3.52Å; M765-Y767 HydrophobicContact CB-CE2 3.37Å; M765-Y767 HydrophobicContact CG-CE2 4.34Å; M765-Y767 PolarHBondContact O-N 2.8Å; M765-Y767 VanDerWaalsContact O-N 3.12Å; M765-Y767 HydrophobicContact SD-CE2 4.15Å; Y767-S769 PolarHBondContact O-N 3.43Å
768	V	82	Confident	85.9	Confident	37 Å²	37	23.9 Å²	23.9	22%	0.224	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-76.9	121.5	175.6	179.9	0	0	0	0	109.2	C604 L761 L762 T770	C604-V768 HydrophobicContact CB-CG1 4.13Å; C604-V768 WeakPolarHBondContact O-CG2 3.43Å; L761-V768 CarbonylContact O-C 3.6Å; L761-V768 WeakPolarHBondContact O-CA 3.3Å; L762-V768 HydrophobicContact CD2-CG2 3.96Å; V768-T770 PolarHBondContact O-N 2.92Å
769	S	85.9	Confident	86.1	Confident	30 Å²	30	22.9 Å²	22.9	21%	0.21	12%	0.122	C	C	.	.			trans	-76.2	111.6	171.7	172.4	0	0	0	0	109.5	L761 Y767 T771 A772 A773	L761-S769 PolarHBondContact O-N 3.01Å; Y767-S769 PolarHBondContact O-N 3.43Å; S769-T771 VanDerWaalsContact C-N 3.26Å; S769-T771 PolarHBondContact O-N 3.01Å; S769-A772 PolarHBondContact O-N 3.47Å; S769-A772 PolarHBondContact OG-N 2.93Å; S769-A773 WeakPolarHBondContact O-CB 3.49Å; S769-A773 PolarHBondContact O-N 3.23Å
770	T	86.3	Confident	86.2	Confident	44 Å²	44	23 Å²	23	27%	0.27	12%	0.123	S	C	.	.	H	α-helix	trans	-55.2	-44.1	174.8	-61.7	0	0	0	0	111.1	C570 V768 A772 A773 I774	C570-T770 HydrophobicContact CB-CG2 4.29Å; V768-T770 PolarHBondContact O-N 2.92Å; T770-A772 PolarHBondContact O-N 3.4Å; T770-A773 PolarHBondContact O-N 3.16Å; T770-I774 HydrophobicContact CG2-CD1 3.63Å; T770-I774 HydrophobicContact CG2-CG1 4.4Å; T770-I774 WeakPolarHBondContact O-CB 3.39Å; T770-I774 WeakPolarHBondContact O-CD1 3.44Å; T770-I774 WeakPolarHBondContact O-CG1 3.36Å; T770-I774 PolarHBondContact O-N 3.5Å
771	T	90.3	Very high	86.7	Confident	30 Å²	30	23 Å²	23	18%	0.184	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-43	179.9	-56.2	0	0	0	0	112	S769 I774 G775 L794	S769-T771 VanDerWaalsContact C-N 3.26Å; S769-T771 PolarHBondContact O-N 3.01Å; T771-I774 PolarHBondContact O-N 3.19Å; T771-G775 PolarHBondContact O-N 2.93Å; T771-L794 HydrophobicContact CG2-CB 4.11Å
772	A	92.1	Very high	86.9	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.008	12%	0.122	C	C	.	.	H	α-helix	trans	-66.5	-41.6	177	0	0	0	0	0	111.8	G760 L761 S769 T770 I774 G775 L776 A795	G760-A772 WeakPolarHBondContact O-CB 3.23Å; L761-A772 HydrophobicContact CD2-CB 4.22Å; S769-A772 PolarHBondContact O-N 3.47Å; S769-A772 PolarHBondContact OG-N 2.93Å; T770-A772 PolarHBondContact O-N 3.4Å; A772-I774 PolarHBondContact O-N 3.17Å; A772-G775 PolarHBondContact O-N 3.08Å; A772-L776 PolarHBondContact O-N 3.21Å; A772-A795 HydrophobicContact CB-CB 4Å
773	A	93.2	Very high	86.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.6	-44.7	177.4	0	0	0	0	0	111.6	M601 L761 S769 T770 L776 L777	M601-A773 HydrophobicContact CE-CB 3.49Å; M601-A773 VanDerWaalsContact CE-CB 3.49Å; L761-A773 HydrophobicContact CD2-CB 3.8Å; S769-A773 WeakPolarHBondContact O-CB 3.49Å; S769-A773 PolarHBondContact O-N 3.23Å; T770-A773 PolarHBondContact O-N 3.16Å; A773-L776 PolarHBondContact O-N 3.44Å; A773-L777 WeakPolarHBondContact O-CB 3.42Å; A773-L777 PolarHBondContact O-N 2.8Å
774	I	94.2	Very high	87.6	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-47.6	174.4	-67.5	165.3	0	0	0	110.6	L499 L531 A534 V567 T770 T771 A772 L776 L777 V778	L499-I774 HydrophobicContact CD1-CG2 4.36Å; L499-I774 HydrophobicContact CD2-CD1 4.28Å; L531-I774 HydrophobicContact CD2-CG2 3.46Å; L531-I774 VanDerWaalsContact CD2-CG2 3.46Å; A534-I774 HydrophobicContact CB-CD1 3.72Å; V567-I774 HydrophobicContact CB-CG1 4.44Å; V567-I774 HydrophobicContact CG1-CD1 3.66Å; V567-I774 HydrophobicContact CG1-CG1 3.8Å; V567-I774 HydrophobicContact CG1-CG2 4.26Å; V567-I774 HydrophobicContact CG2-CG1 4.14Å; V567-I774 HydrophobicContact CG2-CG2 3.95Å; T770-I774 HydrophobicContact CG2-CD1 3.63Å; T770-I774 HydrophobicContact CG2-CG1 4.4Å; T770-I774 WeakPolarHBondContact O-CB 3.39Å; T770-I774 WeakPolarHBondContact O-CD1 3.44Å; T770-I774 WeakPolarHBondContact O-CG1 3.36Å; T770-I774 PolarHBondContact O-N 3.5Å; T771-I774 PolarHBondContact O-N 3.19Å; A772-I774 PolarHBondContact O-N 3.17Å; I774-L776 VanDerWaalsContact C-N 3.34Å; I774-L776 PolarHBondContact O-N 2.86Å; I774-L777 PolarHBondContact O-N 2.99Å; I774-V778 HydrophobicContact CG2-CG2 4.3Å; I774-V778 VanDerWaalsContact O-CG2 3.3Å; I774-V778 WeakPolarHBondContact O-CG2 3.36Å; I774-V778 PolarHBondContact O-N 3.13Å
775	G	94.9	Very high	88.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-53.3	-50.4	177.7	0	0	0	0	0	112.7	T771 A772 F779 F791	T771-G775 PolarHBondContact O-N 2.93Å; A772-G775 PolarHBondContact O-N 3.08Å; G775-F779 VanDerWaalsContact O-CB 3.25Å; G775-F779 WeakPolarHBondContact O-CB 3.45Å; G775-F779 PolarHBondContact O-N 2.9Å; G775-F791 CarbonylContact C-O 3.55Å; G775-F791 VanDerWaalsContact CA-O 3.28Å; G775-F791 WeakPolarHBondContact CA-O 3.38Å
776	L	96.2	Very high	90.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-43.3	177.1	-83.4	164.5	0	0	0	112.3	F637 M706 I759 L761 A772 A773 I774 V778 F779 L780 L792 A795	F637-L776 HydrophobicContact CE1-CB 3.69Å; F637-L776 HydrophobicContact CZ-CB 3.75Å; M706-L776 HydrophobicContact CE-CD2 4.16Å; I759-L776 HydrophobicContact CG2-CD1 3.74Å; I759-L776 HydrophobicContact CG2-CD2 4.09Å; I759-L776 HydrophobicContact CG2-CG 4.29Å; L761-L776 HydrophobicContact CD1-CD1 3.94Å; L761-L776 HydrophobicContact CD2-CD1 3.53Å; L761-L776 HydrophobicContact CG-CD1 3.51Å; A772-L776 PolarHBondContact O-N 3.21Å; A773-L776 PolarHBondContact O-N 3.44Å; I774-L776 VanDerWaalsContact C-N 3.34Å; I774-L776 PolarHBondContact O-N 2.86Å; L776-V778 VanDerWaalsContact C-N 3.32Å; L776-V778 PolarHBondContact O-N 3.25Å; L776-F779 HydrophobicContact CD2-CD1 4.48Å; L776-F779 WeakPolarHBondContact O-CB 3.31Å; L776-F779 PolarHBondContact O-N 3.3Å; L776-L780 WeakPolarHBondContact O-CG 3.41Å; L776-L780 PolarHBondContact O-N 3.45Å; L776-L792 HydrophobicContact CD2-CD1 3.6Å; L776-L792 HydrophobicContact CG-CD1 4.4Å; L776-A795 HydrophobicContact CD1-CB 4.06Å; L776-A795 HydrophobicContact CG-CB 3.77Å
777	L	96.9	Very high	91.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.6	-43	179.6	179.6	69	0	0	0	111.9	V563 V567 Y597 M601 F637 A773 I774 L780 Q781	V563-L777 HydrophobicContact CG1-CD2 4.15Å; V563-L777 HydrophobicContact CG1-CG 4.3Å; V567-L777 HydrophobicContact CG2-CD2 4.17Å; Y597-L777 HydrophobicContact CD1-CD1 3.73Å; Y597-L777 HydrophobicContact CE1-CD1 4.12Å; Y597-L777 HydrophobicContact CG-CD1 3.96Å; M601-L777 HydrophobicContact CG-CD2 3.74Å; M601-L777 HydrophobicContact SD-CB 4.14Å; M601-L777 HydrophobicContact SD-CD1 4.43Å; M601-L777 HydrophobicContact SD-CD2 3.91Å; M601-L777 HydrophobicContact SD-CG 4.38Å; F637-L777 HydrophobicContact CE2-CD1 4.41Å; F637-L777 HydrophobicContact CZ-CB 4.13Å; A773-L777 WeakPolarHBondContact O-CB 3.42Å; A773-L777 PolarHBondContact O-N 2.8Å; I774-L777 PolarHBondContact O-N 2.99Å; L777-L780 WeakPolarHBondContact O-CB 3.41Å; L777-L780 PolarHBondContact O-N 3.23Å; L777-Q781 PolarHBondContact O-NE2 3.18Å; L777-Q781 VanDerWaalsContact O-NE2 3.12Å
778	V	97.5	Very high	92.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-70.6	-39.2	177.2	-178.6	0	0	0	0	110.3	L527 V563 I774 L776 L780 Q781 L788 F791	L527-V778 HydrophobicContact CD1-CG2 3.99Å; L527-V778 HydrophobicContact CD2-CG1 4.09Å; V563-V778 HydrophobicContact CG1-CG2 3.87Å; I774-V778 HydrophobicContact CG2-CG2 4.3Å; I774-V778 VanDerWaalsContact O-CG2 3.3Å; I774-V778 WeakPolarHBondContact O-CG2 3.36Å; I774-V778 PolarHBondContact O-N 3.13Å; L776-V778 VanDerWaalsContact C-N 3.32Å; L776-V778 PolarHBondContact O-N 3.25Å; V778-L780 PolarHBondContact O-N 2.84Å; V778-Q781 WeakPolarHBondContact O-CA 3.36Å; V778-Q781 VanDerWaalsContact O-CB 3.27Å; V778-Q781 WeakPolarHBondContact O-CB 3.29Å; V778-Q781 WeakPolarHBondContact O-CG 3.25Å; V778-Q781 PolarHBondContact O-N 2.97Å; V778-L788 HydrophobicContact CG1-CB 4.17Å; V778-L788 HydrophobicContact CG1-CD1 4.3Å; V778-L788 HydrophobicContact CG1-CD2 3.82Å; V778-L788 HydrophobicContact CG1-CG 4.3Å; V778-F791 HydrophobicContact CB-CB 3.87Å; V778-F791 HydrophobicContact CB-CD1 3.64Å; V778-F791 HydrophobicContact CB-CD2 4.3Å; V778-F791 HydrophobicContact CB-CE1 4.23Å; V778-F791 HydrophobicContact CB-CG 3.69Å; V778-F791 HydrophobicContact CG1-CB 3.87Å; V778-F791 HydrophobicContact CG1-CD1 3.61Å; V778-F791 HydrophobicContact CG1-CD2 3.45Å; V778-F791 VanDerWaalsContact CG1-CD2 3.45Å; V778-F791 HydrophobicContact CG1-CE1 3.94Å; V778-F791 HydrophobicContact CG1-CE2 3.8Å; V778-F791 HydrophobicContact CG1-CG 3.36Å; V778-F791 HydrophobicContact CG1-CZ 4.04Å; V778-F791 HydrophobicContact CG2-CD1 3.9Å; V778-F791 HydrophobicContact CG2-CE1 4.11Å; V778-F791 HydrophobicContact CG2-CG 4.44Å
779	F	97.1	Very high	93.1	Very high	7 Å²	7	17.7 Å²	17.7	3%	0.031	9%	0.085	C	C	.	.	H	α-helix	trans	-56	-36.9	172.4	169.1	-98.9	0	0	0	112.2	I702 M706 I745 G775 L776 Q781 T782 L792	I702-F779 HydrophobicContact CG2-CE1 4.22Å; I702-F779 HydrophobicContact CG2-CZ 4.1Å; M706-F779 HydrophobicContact CE-CD1 4.1Å; M706-F779 HydrophobicContact CE-CE1 3.47Å; M706-F779 VanDerWaalsContact CE-CE1 3.47Å; M706-F779 HydrophobicContact CE-CZ 4.17Å; I745-F779 HydrophobicContact CG2-CZ 4.49Å; G775-F779 VanDerWaalsContact O-CB 3.25Å; G775-F779 WeakPolarHBondContact O-CB 3.45Å; G775-F779 PolarHBondContact O-N 2.9Å; L776-F779 HydrophobicContact CD2-CD1 4.48Å; L776-F779 WeakPolarHBondContact O-CB 3.31Å; L776-F779 PolarHBondContact O-N 3.3Å; F779-Q781 PolarHBondContact O-N 3.44Å; F779-T782 WeakPolarHBondContact O-CB 3.5Å; F779-T782 PolarHBondContact O-N 3.23Å; F779-T782 PolarHBondContact O-OG1 2.93Å; F779-L792 HydrophobicContact CB-CB 4.31Å; F779-L792 HydrophobicContact CB-CD1 4.45Å; F779-L792 HydrophobicContact CD1-CD1 4.17Å; F779-L792 HydrophobicContact CD2-CB 3.65Å; F779-L792 HydrophobicContact CD2-CD1 4.3Å; F779-L792 HydrophobicContact CD2-CD2 4.14Å; F779-L792 HydrophobicContact CD2-CG 4.25Å; F779-L792 HydrophobicContact CE2-CB 4.22Å; F779-L792 HydrophobicContact CE2-CD2 3.9Å; F779-L792 HydrophobicContact CG-CB 4.06Å; F779-L792 HydrophobicContact CG-CD1 4.04Å; F779-L792 HydrophobicContact CG-CG 4.48Å; F779-L792 HydrophobicContact CZ-CD2 4.18Å
780	L	95.9	Very high	93.6	Very high	8 Å²	8	16.2 Å²	16.2	4%	0.042	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-61.7	-16.6	175.6	-63.4	-166.9	0	0	0	113.9	F637 I667 I671 L776 L777 V778 T782	F637-L780 HydrophobicContact CE2-CD1 3.82Å; F637-L780 HydrophobicContact CZ-CD1 4.35Å; I667-L780 HydrophobicContact CG2-CD1 4.16Å; I667-L780 HydrophobicContact CG2-CD2 3.48Å; I667-L780 VanDerWaalsContact CG2-CD2 3.48Å; I667-L780 HydrophobicContact CG2-CG 4.47Å; I671-L780 HydrophobicContact CD1-CD1 3.99Å; I671-L780 HydrophobicContact CD1-CD2 4.21Å; I671-L780 HydrophobicContact CD1-CG 4.49Å; L776-L780 WeakPolarHBondContact O-CG 3.41Å; L776-L780 PolarHBondContact O-N 3.45Å; L777-L780 WeakPolarHBondContact O-CB 3.41Å; L777-L780 PolarHBondContact O-N 3.23Å; V778-L780 PolarHBondContact O-N 2.84Å; L780-T782 VanDerWaalsContact C-N 3.29Å
781	Q	94.8	Very high	94.2	Very high	7 Å²	7	14.1 Å²	14.1	3%	0.033	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-85.9	0	174.9	-44	-50.4	-49.2	0	0	113.1	V563 Y597 L777 V778 F779 W783 Y784 W785 L788	V563-Q781 HydrophobicContact CG2-CG 3.57Å; Y597-Q781 PolarHBondContact OH-NE2 3.43Å; Y597-Q781 VanDerWaalsContact OH-NE2 3.12Å; Y597-Q781 PolarHBondContact OH-OE1 3.28Å; L777-Q781 PolarHBondContact O-NE2 3.18Å; L777-Q781 VanDerWaalsContact O-NE2 3.12Å; V778-Q781 WeakPolarHBondContact O-CA 3.36Å; V778-Q781 VanDerWaalsContact O-CB 3.27Å; V778-Q781 WeakPolarHBondContact O-CB 3.29Å; V778-Q781 WeakPolarHBondContact O-CG 3.25Å; V778-Q781 PolarHBondContact O-N 2.97Å; F779-Q781 PolarHBondContact O-N 3.44Å; Q781-W783 PolarHBondContact O-N 3.08Å; Q781-Y784 PolarHBondContact O-N 2.92Å; Q781-W785 PolarHBondContact O-N 3.14Å; Q781-L788 HydrophobicContact CB-CD1 3.63Å
782	T	90.5	Very high	94.5	Very high	9 Å²	9	12.7 Å²	12.7	6%	0.055	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-48.8	-31.5	168.6	-67.5	0	0	0	0	111.6	F741 F779 L780 Y784 W785 F786 S789	F741-T782 HydrophobicContact CE1-CG2 4.04Å; F741-T782 HydrophobicContact CZ-CG2 3.86Å; F779-T782 WeakPolarHBondContact O-CB 3.5Å; F779-T782 PolarHBondContact O-N 3.23Å; F779-T782 PolarHBondContact O-OG1 2.93Å; L780-T782 VanDerWaalsContact C-N 3.29Å; T782-Y784 PolarHBondContact O-N 3.43Å; T782-W785 CarbonylContact O-C 3.6Å; T782-W785 PolarHBondContact O-N 3.42Å; T782-F786 HydrophobicContact CG2-CD1 4.12Å; T782-S789 WeakPolarHBondContact CG2-OG 3.3Å; T782-S789 WeakPolarHBondContact OG1-CA 3.46Å; T782-S789 PolarHBondContact OG1-N 2.9Å; T782-S789 PolarHBondContact OG1-OG 3.46Å
783	W	85.5	Confident	94.6	Very high	68 Å²	68	12.7 Å²	12.7	26%	0.258	5%	0.054	S	C	.	.	G	3₁₀ helix	trans	-49.5	-38.5	172.2	-175.7	-77	0	0	0	113.6	Y663 F695 Q781	Y663-W783 HydrophobicContact CD1-CZ3 4.17Å; Y663-W783 AromaticContact CD2-CZ3 3.82Å; Y663-W783 HydrophobicContact CD2-CZ3 3.82Å; Y663-W783 AromaticContact CE1-CE3 3.99Å; Y663-W783 HydrophobicContact CE1-CE3 3.99Å; Y663-W783 HydrophobicContact CE1-CZ3 4.04Å; Y663-W783 AromaticContact CE2-CE3 3.99Å; Y663-W783 HydrophobicContact CE2-CE3 3.99Å; Y663-W783 AromaticContact CE2-CZ3 3.65Å; Y663-W783 HydrophobicContact CE2-CZ3 3.65Å; Y663-W783 HydrophobicContact CG-CZ3 4.05Å; Y663-W783 AromaticContact CZ-CE3 3.67Å; Y663-W783 AromaticContact CZ-CZ3 3.76Å; F695-W783 HydrophobicContact CB-CH2 3.66Å; F695-W783 HydrophobicContact CB-CZ3 3.79Å; F695-W783 AromaticContact CD1-CH2 3.99Å; F695-W783 HydrophobicContact CD1-CH2 3.99Å; F695-W783 AromaticContact CD2-CH2 3.31Å; F695-W783 HydrophobicContact CD2-CH2 3.31Å; F695-W783 AromaticContact CD2-CZ3 3.69Å; F695-W783 HydrophobicContact CD2-CZ3 3.69Å; F695-W783 HydrophobicContact CE1-CH2 4.36Å; F695-W783 AromaticContact CE2-CH2 3.75Å; F695-W783 HydrophobicContact CE2-CH2 3.75Å; F695-W783 HydrophobicContact CE2-CZ3 4.41Å; F695-W783 AromaticContact CG-CH2 3.4Å; F695-W783 HydrophobicContact CG-CH2 3.4Å; F695-W783 VanDerWaalsContact CG-CH2 3.4Å; F695-W783 HydrophobicContact CG-CZ2 4.43Å; F695-W783 AromaticContact CG-CZ3 3.93Å; F695-W783 HydrophobicContact CG-CZ3 3.93Å; F695-W783 HydrophobicContact CZ-CH2 4.23Å; Q781-W783 PolarHBondContact O-N 3.08Å
784	Y	90.4	Very high	94.7	Very high	57 Å²	57	13.1 Å²	13.1	22%	0.224	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-30.8	-178.7	-61.2	-68.7	0	0	0	113	R593 D626 R629 Q781 T782	R593-Y784 PolarHBondContact NH1-OH 3.46Å; D626-Y784 PolarHBondContact OD1-OH 2.78Å; D626-Y784 PolarHBondContact OD2-OH 3.07Å; R629-Y784 PolarHBondContact NH2-OH 3.47Å; R629-Y784 VanDerWaalsContact NH2-OH 3.15Å; Q781-Y784 PolarHBondContact O-N 2.92Å; T782-Y784 PolarHBondContact O-N 3.43Å
785	W	93.9	Very high	94.7	Very high	35 Å²	35	13.1 Å²	13.1	13%	0.133	6%	0.056	C	C	.	.			trans	-153.1	106.3	-177	-168.1	51.2	0	0	0	111.4	W410 F413 H488 L492 Q781 T782 P787 L788	W410-W785 AromaticContact CD2-NE1 3.96Å; W410-W785 AromaticContact CE3-CZ2 3.64Å; W410-W785 HydrophobicContact CE3-CZ2 3.64Å; W410-W785 AromaticContact CE3-NE1 3.88Å; W410-W785 HydrophobicContact CH2-CZ2 4.34Å; W410-W785 HydrophobicContact CZ3-CH2 4.45Å; W410-W785 AromaticContact CZ3-CZ2 3.52Å; W410-W785 HydrophobicContact CZ3-CZ2 3.52Å; F413-W785 HydrophobicContact CD1-CH2 4.44Å; F413-W785 HydrophobicContact CD1-CZ2 4.14Å; F413-W785 AromaticContact CE1-CH2 3.6Å; F413-W785 HydrophobicContact CE1-CH2 3.6Å; F413-W785 AromaticContact CE1-CZ2 3.73Å; F413-W785 HydrophobicContact CE1-CZ2 3.73Å; F413-W785 AromaticContact CZ-CH2 3.96Å; F413-W785 HydrophobicContact CZ-CH2 3.96Å; F413-W785 HydrophobicContact CZ-CZ2 4.28Å; H488-W785 AromaticContact CD2-CH2 3.71Å; H488-W785 AromaticContact NE2-CE3 3.99Å; H488-W785 AromaticContact NE2-CH2 2.92Å; H488-W785 WeakPolarHBondContact NE2-CH2 3.47Å; H488-W785 AromaticContact NE2-CZ2 3.32Å; H488-W785 VanDerWaalsContact NE2-CZ2 3.32Å; H488-W785 WeakPolarHBondContact NE2-CZ2 3.34Å; H488-W785 AromaticContact NE2-CZ3 3.28Å; H488-W785 VanDerWaalsContact NE2-CZ3 3.28Å; H488-W785 WeakPolarHBondContact NE2-CZ3 3.28Å; L492-W785 HydrophobicContact CD1-CH2 3.52Å; L492-W785 HydrophobicContact CD1-CZ3 3.54Å; Q781-W785 PolarHBondContact O-N 3.14Å; T782-W785 CarbonylContact O-C 3.6Å; T782-W785 PolarHBondContact O-N 3.42Å; W785-P787 HydrophobicContact CD2-CB 4.24Å; W785-P787 HydrophobicContact CD2-CG 4.01Å; W785-P787 HydrophobicContact CE3-CB 4.39Å; W785-P787 HydrophobicContact CG-CG 4.44Å; W785-P787 HydrophobicContact CH2-CB 3.61Å; W785-P787 HydrophobicContact CH2-CG 4.02Å; W785-P787 HydrophobicContact CZ2-CB 3.56Å; W785-P787 HydrophobicContact CZ2-CG 3.41Å; W785-P787 VanDerWaalsContact CZ2-CG 3.41Å; W785-P787 HydrophobicContact CZ3-CB 4.07Å; W785-L788 HydrophobicContact CB-CD1 4.47Å; W785-L788 HydrophobicContact CD2-CG 4.43Å; W785-L788 HydrophobicContact CE3-CD1 3.99Å; W785-L788 HydrophobicContact CE3-CD2 3.67Å; W785-L788 HydrophobicContact CE3-CG 3.45Å; W785-L788 VanDerWaalsContact CE3-CG 3.45Å; W785-L788 HydrophobicContact CZ3-CD2 3.6Å; W785-L788 HydrophobicContact CZ3-CG 3.9Å; W785-L788 WeakPolarHBondContact O-CB 3.36Å; W785-L788 PolarHBondContact O-N 3.09Å; W785-L788 VanDerWaalsContact O-N 3.15Å
786	F	92	Very high	94.6	Very high	59 Å²	59	13.7 Å²	13.7	26%	0.259	6%	0.058	S	C	.	.	G	3₁₀ helix	trans	-53.8	-34.8	-174.5	-55.9	-50.8	0	0	0	116.3	V375 I382 F741 T782 L788 S789	V375-F786 HydrophobicContact CG1-CE2 4.14Å; V375-F786 HydrophobicContact CG1-CZ 3.86Å; V375-F786 HydrophobicContact CG2-CE2 4.18Å; V375-F786 HydrophobicContact CG2-CZ 4.4Å; I382-F786 HydrophobicContact CD1-CB 4.26Å; F741-F786 HydrophobicContact CD2-CD1 4.44Å; F741-F786 HydrophobicContact CD2-CE1 4.25Å; F741-F786 AromaticContact CE2-CD1 3.56Å; F741-F786 HydrophobicContact CE2-CD1 3.56Å; F741-F786 AromaticContact CE2-CE1 3.8Å; F741-F786 HydrophobicContact CE2-CE1 3.8Å; F741-F786 HydrophobicContact CE2-CG 4.09Å; F741-F786 AromaticContact CZ-CD1 3.62Å; F741-F786 HydrophobicContact CZ-CD1 3.62Å; F741-F786 HydrophobicContact CZ-CE1 4.03Å; F741-F786 HydrophobicContact CZ-CG 4.42Å; T782-F786 HydrophobicContact CG2-CD1 4.12Å; F786-L788 PolarHBondContact O-N 3.48Å; F786-L788 VanDerWaalsContact O-N 3.1Å; F786-S789 VanDerWaalsContact O-CB 3.23Å; F786-S789 WeakPolarHBondContact O-CB 3.32Å; F786-S789 PolarHBondContact O-N 3.36Å; F786-S789 PolarHBondContact O-OG 3.13Å
787	P	94.8	Very high	94.4	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.019	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-61.2	-20.6	179.2	-26	36.5	0	0	0	114.3	F413 T414 Y456 W785 S789 H790	F413-P787 HydrophobicContact CD1-CB 3.99Å; F413-P787 HydrophobicContact CD1-CG 4.06Å; F413-P787 HydrophobicContact CE1-CB 3.8Å; F413-P787 HydrophobicContact CE1-CG 4.3Å; T414-P787 WeakPolarHBondContact OG1-CG 3.36Å; Y456-P787 PolarHBondContact OH-O 2.81Å; W785-P787 HydrophobicContact CD2-CB 4.24Å; W785-P787 HydrophobicContact CD2-CG 4.01Å; W785-P787 HydrophobicContact CE3-CB 4.39Å; W785-P787 HydrophobicContact CG-CG 4.44Å; W785-P787 HydrophobicContact CH2-CB 3.61Å; W785-P787 HydrophobicContact CH2-CG 4.02Å; W785-P787 HydrophobicContact CZ2-CB 3.56Å; W785-P787 HydrophobicContact CZ2-CG 3.41Å; W785-P787 VanDerWaalsContact CZ2-CG 3.41Å; W785-P787 HydrophobicContact CZ3-CB 4.07Å; P787-S789 PolarHBondContact O-N 3.25Å; P787-H790 PolarHBondContact O-N 3.34Å
788	L	96.3	Very high	94.1	Very high	13 Å²	13	17.5 Å²	17.5	7%	0.068	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-67.3	-11.8	172.4	-62.7	178.6	0	0	0	112.9	L527 V778 Q781 W785 F786 H790 F791	L527-L788 HydrophobicContact CD2-CD2 4.15Å; V778-L788 HydrophobicContact CG1-CB 4.17Å; V778-L788 HydrophobicContact CG1-CD1 4.3Å; V778-L788 HydrophobicContact CG1-CD2 3.82Å; V778-L788 HydrophobicContact CG1-CG 4.3Å; Q781-L788 HydrophobicContact CB-CD1 3.63Å; W785-L788 HydrophobicContact CB-CD1 4.47Å; W785-L788 HydrophobicContact CD2-CG 4.43Å; W785-L788 HydrophobicContact CE3-CD1 3.99Å; W785-L788 HydrophobicContact CE3-CD2 3.67Å; W785-L788 HydrophobicContact CE3-CG 3.45Å; W785-L788 VanDerWaalsContact CE3-CG 3.45Å; W785-L788 HydrophobicContact CZ3-CD2 3.6Å; W785-L788 HydrophobicContact CZ3-CG 3.9Å; W785-L788 WeakPolarHBondContact O-CB 3.36Å; W785-L788 PolarHBondContact O-N 3.09Å; W785-L788 VanDerWaalsContact O-N 3.15Å; F786-L788 PolarHBondContact O-N 3.48Å; F786-L788 VanDerWaalsContact O-N 3.1Å; L788-H790 PolarHBondContact O-N 3.19Å; L788-F791 HydrophobicContact CD2-CD2 4Å; L788-F791 HydrophobicContact CD2-CE2 3.82Å; L788-F791 WeakPolarHBondContact O-CB 3.06Å; L788-F791 PolarHBondContact O-N 3.04Å
789	S	96.6	Very high	93.7	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-58.8	-28.7	173	-62.8	0	0	0	0	112.7	T782 F786 P787 F791 L792	T782-S789 WeakPolarHBondContact CG2-OG 3.3Å; T782-S789 WeakPolarHBondContact OG1-CA 3.46Å; T782-S789 PolarHBondContact OG1-N 2.9Å; T782-S789 PolarHBondContact OG1-OG 3.46Å; F786-S789 VanDerWaalsContact O-CB 3.23Å; F786-S789 WeakPolarHBondContact O-CB 3.32Å; F786-S789 PolarHBondContact O-N 3.36Å; F786-S789 PolarHBondContact O-OG 3.13Å; P787-S789 PolarHBondContact O-N 3.25Å; S789-F791 PolarHBondContact O-N 3.36Å; S789-L792 VanDerWaalsContact O-CB 3.28Å; S789-L792 WeakPolarHBondContact O-CB 3.15Å; S789-L792 PolarHBondContact O-N 3.27Å
790	H	97.4	Very high	93.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-62.6	-22	176.5	-66.7	-38.7	0	0	0	112.9	T414 S418 V421 Y456 L460 P787 L788 L792 S793	T414-H790 PolarHBondContact O-NE2 3.03Å; S418-H790 PolarHBondContact N-NE2 3.39Å; V421-H790 HydrophobicContact CG2-CB 3.79Å; Y456-H790 HydrophobicContact CE1-CB 4.39Å; L460-H790 HydrophobicContact CD1-CB 3.92Å; L460-H790 HydrophobicContact CD2-CB 4.37Å; P787-H790 PolarHBondContact O-N 3.34Å; L788-H790 PolarHBondContact O-N 3.19Å; H790-L792 PolarHBondContact O-N 3.39Å; H790-S793 VanDerWaalsContact O-CB 3.27Å; H790-S793 WeakPolarHBondContact O-CB 3.36Å; H790-S793 PolarHBondContact O-N 3.49Å; H790-S793 VanDerWaalsContact O-N 3.17Å; H790-S793 PolarHBondContact O-OG 2.94Å
791	F	97.1	Very high	93	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-65	-18.3	173.6	-85.2	-102.6	0	0	0	113.6	Y456 L496 L527 L531 G775 V778 L788 S789 S793 L794	Y456-F791 AromaticContact CE2-CE2 3.89Å; Y456-F791 HydrophobicContact CE2-CE2 3.89Å; Y456-F791 HydrophobicContact CE2-CZ 4.49Å; Y456-F791 AromaticContact CZ-CE2 3.84Å; Y456-F791 WeakPolarHBondContact OH-CD2 3.41Å; Y456-F791 WeakPolarHBondContact OH-CE2 3.36Å; L496-F791 HydrophobicContact CD1-CZ 4.35Å; L496-F791 HydrophobicContact CD2-CD1 4.09Å; L496-F791 HydrophobicContact CD2-CE1 3.45Å; L496-F791 VanDerWaalsContact CD2-CE1 3.45Å; L496-F791 HydrophobicContact CD2-CZ 3.76Å; L496-F791 HydrophobicContact CG-CE1 4.2Å; L496-F791 HydrophobicContact CG-CZ 4Å; L527-F791 HydrophobicContact CD2-CZ 4.4Å; L531-F791 HydrophobicContact CD1-CE1 3.92Å; L531-F791 HydrophobicContact CD1-CZ 3.99Å; L531-F791 HydrophobicContact CD2-CE1 4.21Å; G775-F791 CarbonylContact C-O 3.55Å; G775-F791 VanDerWaalsContact CA-O 3.28Å; G775-F791 WeakPolarHBondContact CA-O 3.38Å; V778-F791 HydrophobicContact CB-CB 3.87Å; V778-F791 HydrophobicContact CB-CD1 3.64Å; V778-F791 HydrophobicContact CB-CD2 4.3Å; V778-F791 HydrophobicContact CB-CE1 4.23Å; V778-F791 HydrophobicContact CB-CG 3.69Å; V778-F791 HydrophobicContact CG1-CB 3.87Å; V778-F791 HydrophobicContact CG1-CD1 3.61Å; V778-F791 HydrophobicContact CG1-CD2 3.45Å; V778-F791 VanDerWaalsContact CG1-CD2 3.45Å; V778-F791 HydrophobicContact CG1-CE1 3.94Å; V778-F791 HydrophobicContact CG1-CE2 3.8Å; V778-F791 HydrophobicContact CG1-CG 3.36Å; V778-F791 HydrophobicContact CG1-CZ 4.04Å; V778-F791 HydrophobicContact CG2-CD1 3.9Å; V778-F791 HydrophobicContact CG2-CE1 4.11Å; V778-F791 HydrophobicContact CG2-CG 4.44Å; L788-F791 HydrophobicContact CD2-CD2 4Å; L788-F791 HydrophobicContact CD2-CE2 3.82Å; L788-F791 WeakPolarHBondContact O-CB 3.06Å; L788-F791 PolarHBondContact O-N 3.04Å; S789-F791 PolarHBondContact O-N 3.36Å; F791-S793 PolarHBondContact O-N 2.93Å; F791-L794 HydrophobicContact CD1-CD1 3.63Å; F791-L794 HydrophobicContact CE1-CD1 4.14Å; F791-L794 WeakPolarHBondContact O-CB 3.36Å; F791-L794 PolarHBondContact O-N 3.19Å
792	L	97	Very high	92.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-57.9	-30.9	173.6	-171.3	58.5	0	0	0	111.8	L386 M706 I749 I759 L776 F779 S789 H790 L794 A795 F796	L386-L792 HydrophobicContact CD1-CD2 4.04Å; L386-L792 HydrophobicContact CD2-CB 4.24Å; L386-L792 HydrophobicContact CD2-CD2 4.4Å; M706-L792 HydrophobicContact CE-CD1 4.34Å; I749-L792 HydrophobicContact CD1-CD2 3.88Å; I749-L792 HydrophobicContact CG1-CD2 3.72Å; I759-L792 HydrophobicContact CD1-CD1 3.86Å; I759-L792 HydrophobicContact CD1-CD2 4.31Å; I759-L792 HydrophobicContact CD1-CG 4.37Å; I759-L792 HydrophobicContact CG1-CD1 4.24Å; L776-L792 HydrophobicContact CD2-CD1 3.6Å; L776-L792 HydrophobicContact CG-CD1 4.4Å; F779-L792 HydrophobicContact CB-CB 4.31Å; F779-L792 HydrophobicContact CB-CD1 4.45Å; F779-L792 HydrophobicContact CD1-CD1 4.17Å; F779-L792 HydrophobicContact CD2-CB 3.65Å; F779-L792 HydrophobicContact CD2-CD1 4.3Å; F779-L792 HydrophobicContact CD2-CD2 4.14Å; F779-L792 HydrophobicContact CD2-CG 4.25Å; F779-L792 HydrophobicContact CE2-CB 4.22Å; F779-L792 HydrophobicContact CE2-CD2 3.9Å; F779-L792 HydrophobicContact CG-CB 4.06Å; F779-L792 HydrophobicContact CG-CD1 4.04Å; F779-L792 HydrophobicContact CG-CG 4.48Å; F779-L792 HydrophobicContact CZ-CD2 4.18Å; S789-L792 VanDerWaalsContact O-CB 3.28Å; S789-L792 WeakPolarHBondContact O-CB 3.15Å; S789-L792 PolarHBondContact O-N 3.27Å; H790-L792 PolarHBondContact O-N 3.39Å; L792-L794 PolarHBondContact O-N 2.92Å; L792-L794 VanDerWaalsContact O-N 3.09Å; L792-A795 WeakPolarHBondContact O-CB 3.42Å; L792-A795 PolarHBondContact O-N 3.23Å; L792-F796 HydrophobicContact CD2-CE1 4.27Å; L792-F796 HydrophobicContact CD2-CZ 4.27Å; L792-F796 HydrophobicContact CG-CE1 3.94Å; L792-F796 HydrophobicContact CG-CZ 4.13Å
793	S	95.6	Very high	92.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.007	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-60.8	-17	176.3	72.1	0	0	0	0	114.3	H389 K424 H790 F791 A795	H389-S793 PolarHBondContact CE1-O 3.31Å; K424-S793 PolarHBondContact NZ-O 3.41Å; H790-S793 VanDerWaalsContact O-CB 3.27Å; H790-S793 WeakPolarHBondContact O-CB 3.36Å; H790-S793 PolarHBondContact O-N 3.49Å; H790-S793 VanDerWaalsContact O-N 3.17Å; H790-S793 PolarHBondContact O-OG 2.94Å; F791-S793 PolarHBondContact O-N 2.93Å; S793-A795 VanDerWaalsContact C-N 3.32Å
794	L	93.7	Very high	93.1	Very high	8 Å²	8	18.5 Å²	18.5	4%	0.042	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-77.8	-19.8	173.2	-58.4	-175.6	0	0	0	112.7	L496 L499 T771 F791 L792	L496-L794 HydrophobicContact CD2-CD1 3.73Å; L496-L794 HydrophobicContact CD2-CD2 4.31Å; L496-L794 HydrophobicContact CD2-CG 4.47Å; L499-L794 HydrophobicContact CD1-CD1 4.3Å; T771-L794 HydrophobicContact CG2-CB 4.11Å; F791-L794 HydrophobicContact CD1-CD1 3.63Å; F791-L794 HydrophobicContact CE1-CD1 4.14Å; F791-L794 WeakPolarHBondContact O-CB 3.36Å; F791-L794 PolarHBondContact O-N 3.19Å; L792-L794 PolarHBondContact O-N 2.92Å; L792-L794 VanDerWaalsContact O-N 3.09Å
795	A	93.9	Very high	93.1	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	-94	-5.4	177.8	0	0	0	0	0	113.5	I759 G760 A772 L776 L792 S793 Q797	I759-A795 WeakPolarHBondContact CA-O 3.35Å; I759-A795 HydrophobicContact CG2-CB 4.19Å; G760-A795 PolarHBondContact N-O 2.96Å; A772-A795 HydrophobicContact CB-CB 4Å; L776-A795 HydrophobicContact CD1-CB 4.06Å; L776-A795 HydrophobicContact CG-CB 3.77Å; L792-A795 WeakPolarHBondContact O-CB 3.42Å; L792-A795 PolarHBondContact O-N 3.23Å; S793-A795 VanDerWaalsContact C-N 3.32Å; A795-Q797 PolarHBondContact O-N 3.01Å
796	F	94.2	Very high	92.6	Very high	12 Å²	12	16 Å²	16	5%	0.053	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.8	175	-68.4	-17.8	0	0	0	111.1	L386 H389 M709 A752 V757 T758 I759 L792	L386-F796 HydrophobicContact CB-CE2 4.25Å; L386-F796 HydrophobicContact CB-CZ 4.21Å; L386-F796 HydrophobicContact CD2-CE2 3.75Å; L386-F796 HydrophobicContact CD2-CZ 3.76Å; L386-F796 HydrophobicContact CG-CZ 4.41Å; H389-F796 HydrophobicContact CB-CD2 4.07Å; H389-F796 HydrophobicContact CB-CE2 4.25Å; H389-F796 AromaticContact CD2-CD2 3.89Å; H389-F796 AromaticContact CE1-CD2 3.93Å; H389-F796 AromaticContact CG-CD2 3.69Å; H389-F796 AromaticContact ND1-CD2 3.8Å; M709-F796 HydrophobicContact CE-CE1 4.28Å; A752-F796 HydrophobicContact CB-CE1 4Å; A752-F796 HydrophobicContact CB-CE2 3.85Å; A752-F796 HydrophobicContact CB-CZ 3.54Å; V757-F796 HydrophobicContact CB-CB 3.97Å; V757-F796 HydrophobicContact CB-CG 4.28Å; V757-F796 HydrophobicContact CG1-CB 4.28Å; V757-F796 HydrophobicContact CG2-CB 3.96Å; V757-F796 HydrophobicContact CG2-CD1 4.03Å; V757-F796 HydrophobicContact CG2-CD2 3.92Å; V757-F796 HydrophobicContact CG2-CE1 4.49Å; V757-F796 HydrophobicContact CG2-CE2 4.4Å; V757-F796 HydrophobicContact CG2-CG 3.72Å; T758-F796 WeakPolarHBondContact O-CA 3.44Å; I759-F796 HydrophobicContact CD1-CE1 4.26Å; I759-F796 HydrophobicContact CG1-CD1 3.83Å; I759-F796 HydrophobicContact CG1-CE1 3.71Å; L792-F796 HydrophobicContact CD2-CE1 4.27Å; L792-F796 HydrophobicContact CD2-CZ 4.27Å; L792-F796 HydrophobicContact CG-CE1 3.94Å; L792-F796 HydrophobicContact CG-CZ 4.13Å
797	Q	90.6	Very high	92.2	Very high	46 Å²	46	19.2 Å²	19.2	22%	0.215	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131	173	-64.9	-172	-2	0	0	109.5	V757 T758 G760 L762 A795	V757-Q797 VanDerWaalsContact CA-O 3.24Å; V757-Q797 WeakPolarHBondContact CA-O 2.75Å; V757-Q797 WeakPolarHBondContact CB-O 3.4Å; T758-Q797 PolarHBondContact N-O 2.82Å; T758-Q797 PolarHBondContact O-N 3.15Å; G760-Q797 PolarHBondContact O-NE2 3.31Å; L762-Q797 PolarHBondContact O-NE2 2.64Å; L762-Q797 PolarHBondContact O-OE1 3.48Å; A795-Q797 PolarHBondContact O-N 3.01Å
798	P	91.8	Very high	91.8	Very high	35 Å²	35	19.5 Å²	19.5	23%	0.227	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.7	176.1	23.8	-30.1	0	0	0	111.1	Y349 Y353	Y349-P798 HydrophobicContact CD1-CB 3.98Å; Y349-P798 HydrophobicContact CD1-CG 3.7Å; Y349-P798 HydrophobicContact CD2-CG 4.04Å; Y349-P798 HydrophobicContact CE1-CB 4.13Å; Y349-P798 HydrophobicContact CE1-CG 3.55Å; Y349-P798 HydrophobicContact CE2-CG 3.91Å; Y349-P798 HydrophobicContact CG-CB 4.43Å; Y349-P798 HydrophobicContact CG-CG 3.96Å; Y353-P798 HydrophobicContact CE1-CB 4.33Å; Y353-P798 WeakPolarHBondContact OH-CB 3.48Å
799	T	89.5	Confident	91.5	Very high	53 Å²	53	23 Å²	23	33%	0.325	12%	0.12	S	C	.	.			trans	-110.1	82	174.1	60.7	0	0	0	0	109.6	Q710 N756 T758	Q710-T799 VanDerWaalsContact NE2-CG2 3.3Å; Q710-T799 PolarHBondContact NE2-OG1 3.19Å; Q710-T799 VanDerWaalsContact OE1-CG2 3.23Å; N756-T799 PolarHBondContact O-N 3.27Å; N756-T799 PolarHBondContact O-OG1 3.18Å; N756-T799 VanDerWaalsContact O-OG1 3.06Å; T758-T799 HydrophobicContact CG2-CG2 3.83Å
800	C	88.7	Confident	91	Very high	19 Å²	19	25.1 Å²	25.1	13%	0.128	13%	0.13	C	C	.	.			trans	-139.6	164.1	-177.5	63.1	0	0	0	0	111.4	F352 I802 G916	F352-C800 HydrophobicContact CD1-CB 3.9Å; F352-C800 HydrophobicContact CD2-CB 3.78Å; F352-C800 HydrophobicContact CE1-CB 3.64Å; F352-C800 HydrophobicContact CE2-CB 3.56Å; F352-C800 HydrophobicContact CG-CB 3.95Å; F352-C800 HydrophobicContact CZ-CB 3.47Å; F352-C800 VanDerWaalsContact CZ-CB 3.47Å; C800-I802 HydrophobicContact CB-CG1 4.35Å; C800-G916 WeakPolarHBondContact O-CA 3.46Å; C800-G916 PolarHBondContact O-N 3.26Å
801	L	89.2	Confident	90.6	Very high	32 Å²	32	25.3 Å²	25.3	17%	0.168	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.1	164.2	177.4	65.9	0	0	0	106.9	F815 M898 L912 G916 I918	L801-F815 HydrophobicContact CD2-CB 4.4Å; L801-F815 HydrophobicContact CD2-CD1 3.66Å; L801-F815 HydrophobicContact CD2-CD2 3.81Å; L801-F815 HydrophobicContact CD2-CE1 3.75Å; L801-F815 HydrophobicContact CD2-CE2 3.9Å; L801-F815 HydrophobicContact CD2-CG 3.68Å; L801-F815 HydrophobicContact CD2-CZ 3.87Å; L801-F815 HydrophobicContact CG-CD2 4.34Å; L801-F815 HydrophobicContact CG-CE1 4.3Å; L801-F815 HydrophobicContact CG-CE2 3.99Å; L801-F815 HydrophobicContact CG-CZ 3.97Å; L801-M898 HydrophobicContact CD2-CE 3.49Å; L801-M898 VanDerWaalsContact CD2-CE 3.49Å; L801-M898 HydrophobicContact CD2-SD 3.96Å; L801-L912 HydrophobicContact CD1-CD2 4.4Å; L801-L912 HydrophobicContact CD2-CB 4.47Å; L801-L912 HydrophobicContact CD2-CD2 4.29Å; L801-G916 WeakPolarHBondContact CA-O 3.16Å; L801-I918 HydrophobicContact CD1-CD1 3.56Å; L801-I918 HydrophobicContact CD1-CG1 3.96Å
802	I	90.6	Very high	90	Very high	9 Å²	9	31.1 Å²	31.1	5%	0.046	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	116.8	-179.3	-57.5	176.7	0	0	0	107.1	L348 Y349 F352 C800 I804 M810 G916 I917 I918	L348-I802 HydrophobicContact CB-CD1 4.02Å; L348-I802 HydrophobicContact CD1-CG2 4.35Å; L348-I802 HydrophobicContact CD2-CG2 4.21Å; Y349-I802 HydrophobicContact CD1-CD1 4.13Å; Y349-I802 HydrophobicContact CE1-CD1 4.39Å; F352-I802 HydrophobicContact CB-CD1 4.22Å; C800-I802 HydrophobicContact CB-CG1 4.35Å; I802-I804 HydrophobicContact CG2-CG2 4.17Å; I802-M810 HydrophobicContact CG2-CG 4.44Å; I802-M810 HydrophobicContact CG2-SD 3.75Å; I802-G916 PolarHBondContact N-O 2.98Å; I802-I917 HydrophobicContact CB-CG1 4.26Å; I802-I917 HydrophobicContact CD1-CG1 4.4Å; I802-I917 CarbonylContact O-C 3.6Å; I802-I917 WeakPolarHBondContact O-CA 3.4Å; I802-I918 PolarHBondContact O-N 3.04Å
803	G	90.1	Very high	89.4	Confident	6 Å²	6	32.3 Å²	32.3	6%	0.062	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	128.9	170.7	0	0	0	0	0	110.5	I918	G803-I918 WeakPolarHBondContact CA-O 3.45Å
804	I	91.6	Very high	89	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143	171.5	61.5	171.3	0	0	0	110.5	L255 L344 L348 I802 L808 Q809 I917 I918 V919 L920	L255-I804 HydrophobicContact CD1-CD1 4.07Å; L344-I804 HydrophobicContact CD2-CD1 3.82Å; L348-I804 HydrophobicContact CD1-CG2 3.71Å; L348-I804 HydrophobicContact CD2-CG2 4.28Å; I802-I804 HydrophobicContact CG2-CG2 4.17Å; I804-L808 HydrophobicContact CD1-CD2 4.05Å; I804-Q809 CarbonylContact C-O 3.54Å; I804-Q809 VanDerWaalsContact CA-O 3.25Å; I804-Q809 WeakPolarHBondContact CA-O 3.36Å; I804-I917 HydrophobicContact CD1-CG2 3.69Å; I804-I917 HydrophobicContact CG1-CG2 3.93Å; I804-I917 HydrophobicContact CG2-CG2 4.12Å; I804-I918 PolarHBondContact N-O 2.83Å; I804-V919 HydrophobicContact CD1-CG2 4.09Å; I804-V919 HydrophobicContact CG1-CG2 4.07Å; I804-V919 CarbonylContact O-C 3.48Å; I804-V919 WeakPolarHBondContact O-CA 3.15Å; I804-L920 WeakPolarHBondContact O-CB 3.43Å; I804-L920 PolarHBondContact O-N 3.43Å
805	N	89.5	Confident	88.7	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.208	C	C	.	.			trans	-78	178.4	174.7	68.9	9.5	0	0	0	111.7	K807 L808 Q809 P811 E929	N805-K807 PolarHBondContact O-N 2.96Å; N805-K807 WeakPolarHBondContact OD1-CA 3.46Å; N805-K807 WeakPolarHBondContact OD1-CB 3.41Å; N805-K807 PolarHBondContact OD1-N 3.31Å; N805-L808 PolarHBondContact O-N 3.28Å; N805-L808 PolarHBondContact OD1-N 3.34Å; N805-L808 VanDerWaalsContact OD1-N 3.1Å; N805-Q809 PolarHBondContact N-O 3.32Å; N805-Q809 PolarHBondContact OD1-N 3.29Å; N805-Q809 PolarHBondContact OD1-O 3.12Å; N805-P811 HydrophobicContact CB-CG 4.36Å; N805-E929 PolarHBondContact ND2-OE2 2.85Å
806	T	83.8	Confident	88.3	Confident	38 Å²	38	44.2 Å²	44.2	23%	0.233	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19	176.7	52.2	0	0	0	0	113.7	A248 Y251 L808	A248-T806 HydrophobicContact CB-CG2 4.01Å; Y251-T806 WeakPolarHBondContact CE2-O 3.49Å; T806-L808 VanDerWaalsContact C-N 3.29Å
807	K	85.1	Confident	87.9	Confident	128 Å²	128	45 Å²	45	56%	0.557	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	5.8	173.9	-59.1	170.3	-171.7	148.9	0	113.2	N805 Q809 E929	N805-K807 PolarHBondContact O-N 2.96Å; N805-K807 WeakPolarHBondContact OD1-CA 3.46Å; N805-K807 WeakPolarHBondContact OD1-CB 3.41Å; N805-K807 PolarHBondContact OD1-N 3.31Å; K807-Q809 HydrophobicContact CB-CG 4.36Å; K807-Q809 PolarHBondContact O-N 2.69Å; K807-E929 IonicContact NZ-OE1 3.32Å; K807-E929 PolarHBondContact NZ-OE1 3.14Å
808	L	86	Confident	87.5	Confident	9 Å²	9	48 Å²	48	5%	0.047	25%	0.251	C	S	.	.	S	Bend	trans	60.7	28.7	-176	-48.8	-177.8	0	0	0	114.1	Y251 A335 I339 L344 I804 N805 T806	Y251-L808 HydrophobicContact CD2-CD2 4Å; Y251-L808 HydrophobicContact CE2-CD2 4.26Å; Y251-L808 HydrophobicContact CG-CD2 4.38Å; A335-L808 HydrophobicContact CB-CD1 3.61Å; A335-L808 HydrophobicContact CB-CG 4.36Å; I339-L808 HydrophobicContact CD1-CD1 4.33Å; I339-L808 HydrophobicContact CD1-CD2 3.97Å; I339-L808 HydrophobicContact CG1-CD1 4.32Å; L344-L808 HydrophobicContact CD1-CB 4.15Å; L344-L808 HydrophobicContact CD2-CB 4.15Å; L344-L808 HydrophobicContact CD2-CD1 4.19Å; L344-L808 HydrophobicContact CD2-CD2 4Å; L344-L808 HydrophobicContact CD2-CG 4.35Å; I804-L808 HydrophobicContact CD1-CD2 4.05Å; N805-L808 PolarHBondContact O-N 3.28Å; N805-L808 PolarHBondContact OD1-N 3.34Å; N805-L808 VanDerWaalsContact OD1-N 3.1Å; T806-L808 VanDerWaalsContact C-N 3.29Å
809	Q	88.4	Confident	87.1	Confident	87 Å²	87	47.2 Å²	47.2	41%	0.407	25%	0.246	S	C	.	.			trans	-104.5	160.7	172.7	-59.1	174	-50	0	0	109.7	I804 N805 K807 P811 L931	I804-Q809 CarbonylContact C-O 3.54Å; I804-Q809 VanDerWaalsContact CA-O 3.25Å; I804-Q809 WeakPolarHBondContact CA-O 3.36Å; N805-Q809 PolarHBondContact N-O 3.32Å; N805-Q809 PolarHBondContact OD1-N 3.29Å; N805-Q809 PolarHBondContact OD1-O 3.12Å; K807-Q809 HydrophobicContact CB-CG 4.36Å; K807-Q809 PolarHBondContact O-N 2.69Å; Q809-P811 WeakPolarHBondContact O-CD 3.49Å; Q809-L931 HydrophobicContact CB-CD1 4.19Å; Q809-L931 HydrophobicContact CB-CD2 3.9Å; Q809-L931 HydrophobicContact CG-CD1 4.43Å
810	M	87.8	Confident	86.9	Confident	43 Å²	43	49.3 Å²	49.3	21%	0.212	26%	0.255	C	S	.	.			trans	-100.9	97.8	-176.9	-174.2	165.6	61.8	0	0	110.1	L348 I802 V932	L348-M810 HydrophobicContact CD2-SD 4.4Å; I802-M810 HydrophobicContact CG2-CG 4.44Å; I802-M810 HydrophobicContact CG2-SD 3.75Å; M810-V932 HydrophobicContact CE-CB 3.72Å; M810-V932 HydrophobicContact CE-CG1 3.6Å; M810-V932 HydrophobicContact CE-CG2 4.31Å; M810-V932 HydrophobicContact CG-CB 4.21Å; M810-V932 HydrophobicContact CG-CG2 4.04Å; M810-V932 PolarHBondContact O-N 2.88Å
811	P	87.7	Confident	86.7	Confident	5 Å²	5	52 Å²	52	3%	0.032	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-68.8	152.1	174.7	30	-35.7	0	0	0	111.2	N805 Q809 V813 Y906 L920 E930	N805-P811 HydrophobicContact CB-CG 4.36Å; Q809-P811 WeakPolarHBondContact O-CD 3.49Å; P811-V813 HydrophobicContact CB-CG2 4.1Å; P811-V813 HydrophobicContact CG-CG2 3.93Å; P811-V813 PolarHBondContact O-N 2.99Å; P811-V813 VanDerWaalsContact O-N 3.16Å; P811-Y906 HydrophobicContact CB-CE1 4.23Å; P811-Y906 HydrophobicContact CB-CE2 3.74Å; P811-Y906 WeakPolarHBondContact CB-OH 3.37Å; P811-Y906 HydrophobicContact CG-CE1 4.15Å; P811-Y906 HydrophobicContact CG-CE2 4.17Å; P811-L920 HydrophobicContact CG-CD1 4.23Å; P811-E930 WeakPolarHBondContact CA-O 3.47Å
812	Q	85.7	Confident	86.4	Confident	122 Å²	122	53 Å²	53	57%	0.57	28%	0.283	S	S	*	.			trans	-74.3	104.5	173.6	-174.7	172.3	-24	0	0	109.4	E930 V932	Q812-E930 PolarHBondContact N-O 3.47Å; Q812-V932 HydrophobicContact CB-CG2 4.08Å
813	V	84.6	Confident	86.1	Confident	25 Å²	25	54.7 Å²	54.7	15%	0.152	29%	0.291	C	S	.	.			trans	-132.7	129.4	-177.1	-179.8	0	0	0	0	109.5	P811 F815 M900 Y906 L920	P811-V813 HydrophobicContact CB-CG2 4.1Å; P811-V813 HydrophobicContact CG-CG2 3.93Å; P811-V813 PolarHBondContact O-N 2.99Å; P811-V813 VanDerWaalsContact O-N 3.16Å; V813-F815 HydrophobicContact CG1-CE1 4.29Å; V813-F815 HydrophobicContact CG1-CZ 4.37Å; V813-M900 HydrophobicContact CG1-CE 3.99Å; V813-Y906 HydrophobicContact CG2-CD2 3.53Å; V813-Y906 HydrophobicContact CG2-CE2 3.89Å; V813-Y906 HydrophobicContact CG2-CG 4.28Å; V813-L920 HydrophobicContact CB-CD1 4.5Å; V813-L920 HydrophobicContact CG2-CD1 3.95Å
814	D	86.5	Confident	85.8	Confident	127 Å²	127	59.3 Å²	59.3	68%	0.679	31%	0.307	S	S	*	.			trans	-89.8	139.2	171.9	-67.7	-35	0	0	0	110.7	P901	D814-P901 WeakPolarHBondContact O-CD 3.45Å
815	F	86.6	Confident	85.5	Confident	56 Å²	56	61.6 Å²	61.6	25%	0.246	33%	0.326	C	S	.	.			trans	-109.7	139.3	173.5	-58.3	-76	0	0	0	110.3	L801 V813 M898 M900 L912	L801-F815 HydrophobicContact CD2-CB 4.4Å; L801-F815 HydrophobicContact CD2-CD1 3.66Å; L801-F815 HydrophobicContact CD2-CD2 3.81Å; L801-F815 HydrophobicContact CD2-CE1 3.75Å; L801-F815 HydrophobicContact CD2-CE2 3.9Å; L801-F815 HydrophobicContact CD2-CG 3.68Å; L801-F815 HydrophobicContact CD2-CZ 3.87Å; L801-F815 HydrophobicContact CG-CD2 4.34Å; L801-F815 HydrophobicContact CG-CE1 4.3Å; L801-F815 HydrophobicContact CG-CE2 3.99Å; L801-F815 HydrophobicContact CG-CZ 3.97Å; V813-F815 HydrophobicContact CG1-CE1 4.29Å; V813-F815 HydrophobicContact CG1-CZ 4.37Å; F815-M898 HydrophobicContact CB-CE 3.61Å; F815-M898 HydrophobicContact CG-CE 4.19Å; F815-M900 HydrophobicContact CD1-SD 3.85Å; F815-M900 HydrophobicContact CE1-SD 3.74Å; F815-L912 HydrophobicContact CD1-CD1 3.81Å; F815-L912 HydrophobicContact CD1-CD2 4.36Å; F815-L912 HydrophobicContact CE1-CD1 4.25Å; F815-L912 HydrophobicContact CE1-CD2 3.96Å
816	I	86.9	Confident	85.4	Confident	75 Å²	75	65.9 Å²	65.9	39%	0.385	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.4	177.2	-58.4	175.1	0	0	0	108.7	M898 T899 P901	I816-M898 WeakPolarHBondContact O-CA 3.39Å; I816-T899 PolarHBondContact N-O 3.29Å; I816-T899 PolarHBondContact O-N 2.95Å; I816-P901 HydrophobicContact CD1-CB 4.08Å; I816-P901 HydrophobicContact CD1-CG 4.06Å; I816-P901 HydrophobicContact CG1-CG 4.14Å
817	S	84.3	Confident	85.4	Confident	30 Å²	30	65.7 Å²	65.7	21%	0.21	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	124.3	166.5	174.7	0	0	0	0	109.6	S819 N894	S817-S819 PolarHBondContact O-N 2.97Å; S817-S819 WeakPolarHBondContact OG-CB 3.26Å; S817-S819 PolarHBondContact OG-N 3.2Å; S817-S819 VanDerWaalsContact OG-N 3.14Å; S817-N894 VanDerWaalsContact CB-OD1 3.3Å; S817-N894 WeakPolarHBondContact CB-OD1 3.43Å; S817-N894 PolarHBondContact OG-OD1 3.48Å
818	N	84.2	Confident	85.2	Confident	109 Å²	109	64.5 Å²	64.5	58%	0.583	35%	0.348	S	S	*	.			trans	-87	11.2	171.4	-59.2	-64.9	0	0	0	112.7	V897 T899	N818-V897 HydrophobicContact CB-CB 4.17Å; N818-V897 HydrophobicContact CB-CG2 4.41Å; N818-V897 PolarHBondContact N-O 3.45Å; N818-V897 PolarHBondContact ND2-O 2.96Å; N818-T899 PolarHBondContact ND2-OG1 3.33Å
819	S	83.1	Confident	85	Confident	18 Å²	18	68.8 Å²	68.8	13%	0.126	38%	0.376	C	S	.	.	S	Bend	trans	-92.2	152.8	175.8	179.6	0	0	0	0	110.6	S817 P821	S817-S819 PolarHBondContact O-N 2.97Å; S817-S819 WeakPolarHBondContact OG-CB 3.26Å; S817-S819 PolarHBondContact OG-N 3.2Å; S817-S819 VanDerWaalsContact OG-N 3.14Å; S819-P821 WeakPolarHBondContact O-CD 3.47Å
820	N	85	Confident	84.6	Confident	96 Å²	96	67.8 Å²	67.8	51%	0.513	37%	0.372	S	S	.	.			trans	-60.2	126.2	170.9	-175.4	-28.3	0	0	0	110.1	S822 L823	N820-S822 PolarHBondContact ND2-OG 3.5Å; N820-S822 PolarHBondContact O-N 3.26Å; N820-S822 VanDerWaalsContact O-N 3.13Å; N820-S822 PolarHBondContact OD1-N 2.99Å; N820-S822 PolarHBondContact OD1-OG 3.36Å; N820-L823 HydrophobicContact CB-CD1 4.09Å; N820-L823 HydrophobicContact CB-CG 4.22Å; N820-L823 WeakPolarHBondContact O-CB 3.06Å; N820-L823 PolarHBondContact O-N 3.35Å
821	P	83.5	Confident	84	Confident	75 Å²	75	74 Å²	74	49%	0.487	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-53	-34.2	179.9	-29.7	36.3	0	0	0	114.5	S819 L823 Y824 A825	S819-P821 WeakPolarHBondContact O-CD 3.47Å; P821-L823 PolarHBondContact O-N 3.22Å; P821-L823 VanDerWaalsContact O-N 3.13Å; P821-Y824 VanDerWaalsContact CA-CE1 3.46Å; P821-Y824 HydrophobicContact CB-CE1 4.47Å; P821-Y824 PolarHBondContact O-N 3.5Å; P821-A825 WeakPolarHBondContact O-CB 3.31Å; P821-A825 PolarHBondContact O-N 3.5Å
822	S	84.3	Confident	82.9	Confident	55 Å²	55	80.8 Å²	80.8	39%	0.385	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-60.4	-23.9	179	60	0	0	0	0	113.9	A714 N820	A714-S822 WeakPolarHBondContact CB-O 3.32Å; N820-S822 PolarHBondContact ND2-OG 3.5Å; N820-S822 PolarHBondContact O-N 3.26Å; N820-S822 VanDerWaalsContact O-N 3.13Å; N820-S822 PolarHBondContact OD1-N 2.99Å; N820-S822 PolarHBondContact OD1-OG 3.36Å
823	L	83.8	Confident	81.7	Confident	43 Å²	43	83.3 Å²	83.3	23%	0.225	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-74.5	-29.3	-179.2	-65.7	173.6	0	0	0	112.8	S712 A714 M715 N820 P821 A891	S712-L823 WeakPolarHBondContact CB-O 3.37Å; S712-L823 PolarHBondContact OG-O 3.14Å; A714-L823 HydrophobicContact CB-CD2 4.17Å; M715-L823 HydrophobicContact CB-CD2 4.39Å; N820-L823 HydrophobicContact CB-CD1 4.09Å; N820-L823 HydrophobicContact CB-CG 4.22Å; N820-L823 WeakPolarHBondContact O-CB 3.06Å; N820-L823 PolarHBondContact O-N 3.35Å; P821-L823 PolarHBondContact O-N 3.22Å; P821-L823 VanDerWaalsContact O-N 3.13Å; L823-A891 HydrophobicContact CD1-CB 4.01Å
824	Y	84.2	Confident	79.6	Confident	103 Å²	103	92.9 Å²	92.9	40%	0.404	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-3.6	-176.2	64.6	-97.5	0	0	0	114	P821 N894	P821-Y824 VanDerWaalsContact CA-CE1 3.46Å; P821-Y824 HydrophobicContact CB-CE1 4.47Å; P821-Y824 PolarHBondContact O-N 3.5Å; Y824-N894 HydrophobicContact CD1-CB 4.17Å; Y824-N894 HydrophobicContact CG-CB 4.41Å
825	A	84.8	Confident	77.4	Confident	48 Å²	48	92.5 Å²	92.5	40%	0.397	48%	0.477	S	S	.	.	S	Bend	trans	-60.3	143.6	176.5	0	0	0	0	0	111.3	P821	P821-A825 WeakPolarHBondContact O-CB 3.31Å; P821-A825 PolarHBondContact O-N 3.5Å
826	Y	87.8	Confident	75	Confident	92 Å²	92	98.4 Å²	98.4	36%	0.361	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-60.7	132.7	167.6	-59.9	-74.1	0	0	0	109	H358 R755 N756	H358-Y826 HydrophobicContact CB-CD1 3.97Å; H358-Y826 HydrophobicContact CB-CE1 4.29Å; H358-Y826 HydrophobicContact CB-CG 4.15Å; H358-Y826 AromaticContact CD2-CD2 3.62Å; H358-Y826 AromaticContact CD2-CE2 3.99Å; H358-Y826 AromaticContact CD2-CG 3.91Å; H358-Y826 AromaticContact CE1-CD2 3.68Å; H358-Y826 AromaticContact CE1-CE2 3.22Å; H358-Y826 WeakPolarHBondContact CE1-CE2 3.49Å; H358-Y826 AromaticContact CE1-CZ 3.61Å; H358-Y826 AromaticContact CG-CD1 3.93Å; H358-Y826 AromaticContact CG-CD2 3.79Å; H358-Y826 AromaticContact CG-CE2 3.92Å; H358-Y826 AromaticContact CG-CG 3.8Å; H358-Y826 AromaticContact ND1-CD2 3.81Å; H358-Y826 AromaticContact ND1-CE1 3.73Å; H358-Y826 AromaticContact ND1-CE2 3.44Å; H358-Y826 WeakPolarHBondContact ND1-CE2 3.5Å; H358-Y826 AromaticContact ND1-CZ 3.39Å; H358-Y826 AromaticContact NE2-CD2 3.56Å; H358-Y826 AromaticContact NE2-CE2 3.57Å; R755-Y826 HydrophobicContact CB-CD1 4.1Å; R755-Y826 HydrophobicContact CB-CE1 4.14Å; N756-Y826 PolarHBondContact OD1-OH 3.23Å
827	P	82.3	Confident	72.4	Confident	33 Å²	33	102.7 Å²	102.7	21%	0.214	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-66	154.3	174.6	23.8	-30.2	0	0	0	110.7
828	P	82.4	Confident	70.2	Confident	104 Å²	104	107.9 Å²	107.9	68%	0.675	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-61.8	144.7	-177.1	26.3	-34.6	0	0	0	110.7
829	P	80.7	Confident	67.8	Low	98 Å²	98	110.4 Å²	110.4	64%	0.636	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-59.4	151.9	172.1	26.6	-33.7	0	0	0	110.1	E831	P829-E831 PolarHBondContact O-N 3.2Å
830	M	80.3	Confident	65.3	Low	66 Å²	66	119 Å²	119	33%	0.325	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-55.6	133.9	177.8	-174.4	175.9	-70.6	0	0	110.1	D360 L362 I363 I727 E832	D360-M830 VanDerWaalsContact OD2-CB 3.25Å; D360-M830 WeakPolarHBondContact OD2-CB 3.31Å; D360-M830 PolarHBondContact OD2-N 2.91Å; L362-M830 HydrophobicContact CB-CB 4.49Å; L362-M830 HydrophobicContact CD2-CB 3.88Å; L362-M830 HydrophobicContact CD2-CG 3.98Å; L362-M830 WeakPolarHBondContact CD2-O 3.42Å; L362-M830 HydrophobicContact CD2-SD 4.45Å; L362-M830 HydrophobicContact CG-CB 4.42Å; L362-M830 HydrophobicContact CG-SD 4.44Å; I363-M830 HydrophobicContact CG1-CE 3.81Å; I727-M830 HydrophobicContact CD1-CE 3.81Å; I727-M830 HydrophobicContact CG1-CE 3.96Å; M830-E832 PolarHBondContact O-N 2.7Å
831	E	75.5	Confident	62.7	Low	173 Å²	173	121.3 Å²	121.3	81%	0.808	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-65.6	128.7	174	-67.7	-176.9	176.7	0	0	109.8	P829 K833	P829-E831 PolarHBondContact O-N 3.2Å; E831-K833 PolarHBondContact O-N 3.14Å
832	E	64.9	Low	60.5	Low	148 Å²	148	123 Å²	123	69%	0.692	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-55.8	117.5	164.2	-71.7	-173.2	168.8	0	0	107.8	L362 M830 R834	L362-E832 HydrophobicContact CD1-CG 4.45Å; L362-E832 HydrophobicContact CD2-CB 4.48Å; L362-E832 HydrophobicContact CD2-CG 3.92Å; M830-E832 PolarHBondContact O-N 2.7Å; E832-R834 PolarHBondContact O-N 2.81Å
833	K	59.5	Low	57.9	Low	176 Å²	176	124.6 Å²	124.6	77%	0.765	63%	0.628	S	S	*	*			trans	-60.4	95.3	163.8	-74	-178.9	-178.1	171.9	0	105.4	E831 T835	E831-K833 PolarHBondContact O-N 3.14Å; K833-T835 PolarHBondContact O-N 3.31Å
834	R	41	Very low	55.6	Low	225 Å²	225	128.3 Å²	128.3	85%	0.849	65%	0.652	S	S	*	*			trans	-51.9	104	161	-69	-173.8	-177	-172.7	2.1	103.1	E832 K836	E832-R834 PolarHBondContact O-N 2.81Å; R834-K836 PolarHBondContact O-N 3.37Å
835	T	40	Very low	53.2	Low	119 Å²	119	129.3 Å²	129.3	73%	0.73	67%	0.669	S	S	*	*			trans	-56.8	95.1	161.4	28.5	0	0	0	0	102.8	K833 Q837	K833-T835 PolarHBondContact O-N 3.31Å; T835-Q837 PolarHBondContact O-N 3.15Å
836	K	37.3	Very low	50.5	Low	181 Å²	181	134.3 Å²	134.3	79%	0.787	69%	0.688	S	S	*	*			trans	-56.8	83.8	147.5	-74.4	-178.5	178.3	177.4	0	102.3	R834 L838	R834-K836 PolarHBondContact O-N 3.37Å; K836-L838 HydrophobicContact CB-CD1 4.33Å; K836-L838 PolarHBondContact O-N 3.41Å
837	Q	32.5	Very low	47.8	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	70%	0.698	S	S	*	*			trans	-51.1	81.5	131.4	-62.7	-175	13.7	0	0	103	T835 E839	T835-Q837 PolarHBondContact O-N 3.15Å; Q837-E839 PolarHBondContact O-N 3.49Å
838	L	36.9	Very low	45.5	Very low	140 Å²	140	140.9 Å²	140.9	73%	0.733	73%	0.726	S	S	*	*			trans	-53	97.2	142.8	-90.4	126.2	0	0	0	100.6	K836 K840	K836-L838 HydrophobicContact CB-CD1 4.33Å; K836-L838 PolarHBondContact O-N 3.41Å; L838-K840 PolarHBondContact O-N 3.3Å
839	E	33.6	Very low	43.3	Very low	162 Å²	162	145 Å²	145	76%	0.757	73%	0.733	S	S	*	*			trans	-36.8	107.1	153.4	-75.7	-175.5	150	0	0	103.3	Q837 L841	Q837-E839 PolarHBondContact O-N 3.49Å; E839-L841 PolarHBondContact O-N 3.11Å
840	K	30.5	Very low	41.4	Very low	198 Å²	198	144.7 Å²	144.7	86%	0.861	73%	0.733	S	S	*	*			trans	-67.7	81	173.3	-74.1	-179.3	178.8	176.1	0	103	L838 P842	L838-K840 PolarHBondContact O-N 3.3Å; K840-P842 WeakPolarHBondContact O-CD 3.15Å
841	L	31.1	Very low	39.4	Very low	145 Å²	145	151.1 Å²	151.1	76%	0.759	76%	0.76	S	S	*	*			trans	-49.3	116.6	156	-79	168	0	0	0	103.2	E839 A843	E839-L841 PolarHBondContact O-N 3.11Å; L841-A843 PolarHBondContact O-N 2.92Å
842	P	36.8	Very low	37.8	Very low	111 Å²	111	151.6 Å²	151.6	72%	0.721	75%	0.754	S	S	*	*			trans	-56.3	108.2	-173.6	20	-29.9	0	0	0	106.2	K840 V844	K840-P842 WeakPolarHBondContact O-CD 3.15Å; P842-V844 VanDerWaalsContact C-N 3.26Å; P842-V844 PolarHBondContact O-N 3.32Å
843	A	30.9	Very low	36.7	Very low	88 Å²	88	153.6 Å²	153.6	73%	0.727	76%	0.755	S	S	*	*			trans	-63.3	99.5	177.2	0	0	0	0	0	105.1	L841 V845	L841-A843 PolarHBondContact O-N 2.92Å; A843-V845 WeakPolarHBondContact O-CG2 3.24Å; A843-V845 PolarHBondContact O-N 3.24Å
844	V	34.7	Very low	35.9	Very low	120 Å²	120	150.7 Å²	150.7	73%	0.727	75%	0.748	S	S	*	*			trans	-51.3	108	173.5	174.4	0	0	0	0	105.6	P842 L846	P842-V844 VanDerWaalsContact C-N 3.26Å; P842-V844 PolarHBondContact O-N 3.32Å; V844-L846 HydrophobicContact CG1-CG 4.35Å; V844-L846 PolarHBondContact O-N 3.17Å
845	V	32.7	Very low	36	Very low	125 Å²	125	150 Å²	150	76%	0.758	75%	0.745	S	S	*	*			trans	-67.1	85.8	-178.1	-179.6	0	0	0	0	106.6	A843 S847	A843-V845 WeakPolarHBondContact O-CG2 3.24Å; A843-V845 PolarHBondContact O-N 3.24Å; V845-S847 PolarHBondContact O-N 3.5Å
846	L	30	Very low	36.2	Very low	153 Å²	153	149.4 Å²	149.4	80%	0.801	73%	0.734	S	S	*	*			trans	-75.4	77.9	168.8	-75.6	170	0	0	0	107.9	V844 F848	V844-L846 HydrophobicContact CG1-CG 4.35Å; V844-L846 PolarHBondContact O-N 3.17Å; L846-F848 PolarHBondContact O-N 3.08Å
847	S	30	Very low	36.5	Very low	81 Å²	81	148.5 Å²	148.5	57%	0.566	73%	0.73	S	S	*	*			trans	-71.9	50.2	178	70.8	0	0	0	0	112.6	V845	V845-S847 PolarHBondContact O-N 3.5Å
848	F	34.5	Very low	36.9	Very low	181 Å²	181	149 Å²	149	79%	0.794	73%	0.733	S	S	*	*			trans	-145.8	71.5	174.6	-63.9	-76	0	0	0	111.3	L846	L846-F848 PolarHBondContact O-N 3.08Å
849	K	34.9	Very low	37.1	Very low	190 Å²	190	145.4 Å²	145.4	83%	0.826	73%	0.729	S	S	*	*	S	Bend	trans	-164.5	1.6	154.9	-105.8	154.8	-163.8	-171.1	0	117.1
850	S	41	Very low	37.4	Very low	92 Å²	92	146.4 Å²	146.4	64%	0.643	73%	0.731	S	S	*	*	H	α-helix	trans	-78.5	-17.9	177.8	-153.7	0	0	0	0	114.7	R852	S850-R852 PolarHBondContact O-N 2.96Å
851	K	38.8	Very low	37.6	Very low	202 Å²	202	145.6 Å²	145.6	88%	0.878	73%	0.73	S	S	*	*	H	α-helix	trans	-74.6	-3.2	178.1	-94.7	-175.7	177.3	176.6	0	115.4
852	R	42.5	Very low	37.7	Very low	183 Å²	183	147.6 Å²	147.6	69%	0.691	74%	0.736	S	S	*	*	H	α-helix	trans	-103.9	-23.9	177.7	-152.3	173.1	171.5	160.2	3.1	113.8	S850 E856	S850-R852 PolarHBondContact O-N 2.96Å; R852-E856 IonicContact NE-OE1 3.79Å; R852-E856 PolarHBondContact NE-OE1 3.26Å; R852-E856 PolarHBondContact O-N 3.03Å
853	R	42.4	Very low	37.5	Very low	190 Å²	190	151.4 Å²	151.4	72%	0.717	74%	0.744	S	S	*	*	H	α-helix	trans	-76	-30.2	178.6	-89.7	-176.6	167.2	-174.3	-3.5	113.8	R855 E856 K857	R853-R855 VanDerWaalsContact C-N 3.33Å; R853-E856 PolarHBondContact O-N 2.99Å; R853-K857 PolarHBondContact O-N 3.36Å
854	D	41.8	Very low	37.4	Very low	114 Å²	114	155.2 Å²	155.2	61%	0.61	75%	0.746	S	S	*	*	H	α-helix	trans	-75.6	-24.3	177.2	-65.3	-23.1	0	0	0	112.7
855	R	42.9	Very low	37	Very low	212 Å²	212	156 Å²	156	80%	0.8	75%	0.747	S	S	*	*	H	α-helix	trans	-82.5	-27.7	173	-81	-174.7	170.1	-176.5	-3.2	113.8	R853	R853-R855 VanDerWaalsContact C-N 3.33Å
856	E	44.5	Very low	36.9	Very low	105 Å²	105	159.7 Å²	159.7	49%	0.491	75%	0.753	S	S	.	*	H	α-helix	trans	-82	-20.7	178.6	-75.4	173.4	-171	0	0	113.1	R852 R853 G859	R852-E856 IonicContact NE-OE1 3.79Å; R852-E856 PolarHBondContact NE-OE1 3.26Å; R852-E856 PolarHBondContact O-N 3.03Å; R853-E856 PolarHBondContact O-N 2.99Å; E856-G859 PolarHBondContact O-N 3.17Å
857	K	44.6	Very low	37	Very low	163 Å²	163	159 Å²	159	71%	0.709	76%	0.755	S	S	*	*	H	α-helix	trans	-76.1	-23.8	174.9	-77.6	-173.3	175.6	-174.3	0	114.2	R853 G859	R853-K857 PolarHBondContact O-N 3.36Å; K857-G859 VanDerWaalsContact C-N 3.34Å
858	Q	40.7	Very low	36.8	Very low	175 Å²	175	162.9 Å²	162.9	82%	0.818	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-11.3	173.7	-78.4	-176.9	-13.3	0	0	113.7
859	G	40.9	Very low	36.3	Very low	64 Å²	64	163 Å²	163	66%	0.66	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-0.2	-180	0	0	0	0	0	115.8	E856 K857	E856-G859 PolarHBondContact O-N 3.17Å; K857-G859 VanDerWaalsContact C-N 3.34Å
860	K	38.8	Very low	36.2	Very low	182 Å²	182	158.5 Å²	158.5	79%	0.791	76%	0.762	S	S	*	*	S	Bend	trans	-119.8	9.9	-171.3	-78.3	-170.6	173.7	-173.6	0	115.6
861	Q	35.8	Very low	35.6	Very low	181 Å²	181	161.7 Å²	161.7	85%	0.846	77%	0.772	S	S	*	*	S	Bend	trans	-88.7	4.2	173.5	-86.4	-178	-16.1	0	0	114.5
862	E	32.5	Very low	35.3	Very low	188 Å²	188	159.6 Å²	159.6	88%	0.879	77%	0.771	S	S	*	*	S	Bend	trans	-114.6	23.3	-179.6	-78.4	-173.1	161.5	0	0	115.3
863	Q	32.1	Very low	34.7	Very low	190 Å²	190	159.9 Å²	159.9	89%	0.888	78%	0.78	S	S	*	*			trans	-117.3	81.1	162.7	-94.1	178.2	-0.4	0	0	110.7
864	E	29.5	Very low	34.4	Very low	168 Å²	168	156.9 Å²	156.9	79%	0.785	79%	0.785	S	S	*	*			trans	-56.1	141.3	158.3	-71.5	-177.5	139.5	0	0	111.7
865	N	25.8	Very low	34.1	Very low	138 Å²	138	155.9 Å²	155.9	74%	0.738	79%	0.792	S	S	*	*			trans	58.9	104.4	141.1	-67.3	-23	0	0	0	119.8
866	K	30.1	Very low	33.4	Very low	201 Å²	201	151.4 Å²	151.4	87%	0.874	79%	0.794	S	S	*	*			trans	160	125.8	144.3	-88.6	157.8	-172.3	-175.5	0	105.1
867	T	32.5	Very low	32.9	Very low	140 Å²	140	152.5 Å²	152.5	86%	0.859	81%	0.807	S	S	*	*			cis	-169.7	150	48.1	-3.1	0	0	0	0	108.7
868	E	26.5	Very low	32.2	Very low	162 Å²	162	150.2 Å²	150.2	76%	0.757	81%	0.812	S	S	*	*			trans	-65.7	159.1	174.7	-66.5	174.7	127.4	0	0	114.6
869	K	24.4	Very low	32	Very low	184 Å²	184	149.5 Å²	149.5	80%	0.8	81%	0.809	S	S	*	*			trans	62.2	114.5	146.9	-71.5	169	-177.4	177.7	0	119.9
870	A	33.1	Very low	31.6	Very low	94 Å²	94	151.5 Å²	151.5	78%	0.777	82%	0.819	S	S	*	*			trans	-156.9	121.3	132.2	0	0	0	0	0	108.8
871	D	27.3	Very low	31.4	Very low	159 Å²	159	149.5 Å²	149.5	85%	0.85	82%	0.816	S	S	*	*			trans	-70.5	127.8	169.9	-60	-58.8	0	0	0	109.1
872	D	33.1	Very low	31.3	Very low	159 Å²	159	146 Å²	146	85%	0.85	81%	0.812	S	S	*	*			trans	-122.9	103.9	164.6	-90.8	-34.7	0	0	0	107.8
873	E	30.3	Very low	31.3	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.8	128.9	168.9	-73.9	-178.2	148.5	0	0	110.1	A875	E873-A875 PolarHBondContact O-N 3.02Å
874	P	35.7	Very low	31.4	Very low	127 Å²	127	142 Å²	142	83%	0.825	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-79	123	170.7	29.1	-29.4	0	0	0	110.4
875	A	34.3	Very low	31.4	Very low	93 Å²	93	142.9 Å²	142.9	77%	0.769	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-56.1	136.1	177.7	0	0	0	0	0	113.1	E873 V877	E873-A875 PolarHBondContact O-N 3.02Å; A875-V877 PolarHBondContact O-N 3.26Å
876	S	29	Very low	31.8	Very low	119 Å²	119	140.7 Å²	140.7	83%	0.832	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-59	116.7	171.5	52.9	0	0	0	0	112.2
877	V	34	Very low	31.9	Very low	127 Å²	127	139.2 Å²	139.2	77%	0.77	80%	0.802	S	S	*	*			trans	-100.3	104.6	163.5	-175.5	0	0	0	0	107.5	A875 E879	A875-V877 PolarHBondContact O-N 3.26Å; V877-E879 HydrophobicContact CG1-CG 4.46Å; V877-E879 PolarHBondContact O-N 3.03Å
878	S	30.2	Very low	31.9	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	80%	0.801	S	S	*	*			trans	-80.9	95.7	172.6	52.9	0	0	0	0	109.6
879	E	36.1	Very low	32.3	Very low	159 Å²	159	140.2 Å²	140.2	74%	0.743	80%	0.798	S	S	*	*			trans	-107.2	107.2	160.6	-81.3	-174	166.1	0	0	108.5	V877 I881	V877-E879 HydrophobicContact CG1-CG 4.46Å; V877-E879 PolarHBondContact O-N 3.03Å; E879-I881 VanDerWaalsContact C-N 3.29Å; E879-I881 PolarHBondContact O-N 3.3Å
880	A	32.3	Very low	32.8	Very low	107 Å²	107	138.4 Å²	138.4	88%	0.884	80%	0.797	S	S	*	*			trans	-69.6	85.4	173.7	0	0	0	0	0	109.2	S882	A880-S882 PolarHBondContact O-N 2.93Å
881	I	35	Very low	32.9	Very low	140 Å²	140	137.1 Å²	137.1	72%	0.718	79%	0.786	S	S	*	*			trans	-84.9	104.5	162.5	-59	175.8	0	0	0	105.7	E879 E883	E879-I881 VanDerWaalsContact C-N 3.29Å; E879-I881 PolarHBondContact O-N 3.3Å; I881-E883 PolarHBondContact O-N 3.15Å
882	S	32.9	Very low	33.6	Very low	108 Å²	108	134.5 Å²	134.5	76%	0.755	77%	0.768	S	S	*	*			trans	-60.8	96.7	168.9	51.7	0	0	0	0	108.9	A880 P884	A880-S882 PolarHBondContact O-N 2.93Å; S882-P884 WeakPolarHBondContact O-CD 3.41Å
883	E	32.7	Very low	34.9	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.813	75%	0.749	S	S	*	*			trans	-62.4	120.3	163.5	-75.2	-176.4	160.8	0	0	107.3	I881 E885	I881-E883 PolarHBondContact O-N 3.15Å; E883-E885 PolarHBondContact O-N 3.32Å
884	P	33.7	Very low	36.6	Very low	118 Å²	118	123.2 Å²	123.2	77%	0.766	72%	0.718	S	S	*	*			trans	-61.5	128.8	167.9	26.9	-29.9	0	0	0	106.5	S882 A886	S882-P884 WeakPolarHBondContact O-CD 3.41Å; P884-A886 PolarHBondContact O-N 3.27Å
885	E	30.4	Very low	38.3	Very low	188 Å²	188	120.2 Å²	120.2	88%	0.879	70%	0.695	S	S	*	*			trans	-46.5	103.8	175.3	-71.2	179.2	156	0	0	108.7	E883 K887	E883-E885 PolarHBondContact O-N 3.32Å; E885-K887 PolarHBondContact O-N 3.38Å
886	A	34.2	Very low	40.1	Very low	92 Å²	92	120.9 Å²	120.9	76%	0.76	68%	0.68	S	S	*	*			trans	-66.1	92.9	169.7	0	0	0	0	0	105.4	P884 K888	P884-A886 PolarHBondContact O-N 3.27Å; A886-K888 VanDerWaalsContact C-N 3.34Å; A886-K888 PolarHBondContact O-N 2.93Å
887	K	32.7	Very low	42.5	Very low	170 Å²	170	116.7 Å²	116.7	74%	0.739	65%	0.65	S	S	*	*			trans	-49.4	111.7	157.8	-80.1	-176.1	176.5	-180	0	105.1	E885 D889	E885-K887 PolarHBondContact O-N 3.38Å; K887-D889 PolarHBondContact O-N 3.41Å
888	K	31.9	Very low	44.7	Very low	194 Å²	194	112 Å²	112	84%	0.843	62%	0.619	S	S	*	*			trans	-65.8	71.6	163.7	-78.1	179.3	172.7	178.9	0	106	A886 D890	A886-K888 VanDerWaalsContact C-N 3.34Å; A886-K888 PolarHBondContact O-N 2.93Å; K888-D890 VanDerWaalsContact C-N 3.3Å; K888-D890 PolarHBondContact O-N 2.7Å; K888-D890 VanDerWaalsContact O-N 3.1Å
889	D	34.5	Very low	47.3	Very low	129 Å²	129	109.4 Å²	109.4	69%	0.69	60%	0.599	S	S	*	*			trans	-70.3	103.8	162.1	-70.2	-22.2	0	0	0	103.3	K887 A891	K887-D889 PolarHBondContact O-N 3.41Å; D889-A891 PolarHBondContact O-N 3.3Å
890	D	35	Very low	49.5	Very low	146 Å²	146	103.6 Å²	103.6	78%	0.781	57%	0.572	S	S	*	*			trans	-46.4	109.6	174.9	-70.6	-44.7	0	0	0	107.4	K888 E892	K888-D890 VanDerWaalsContact C-N 3.3Å; K888-D890 PolarHBondContact O-N 2.7Å; K888-D890 VanDerWaalsContact O-N 3.1Å; D890-E892 VanDerWaalsContact C-N 3.35Å; D890-E892 PolarHBondContact O-N 3.16Å
891	A	35.1	Very low	51.9	Low	66 Å²	66	100.3 Å²	100.3	55%	0.545	54%	0.542	S	S	.	.			trans	-67.2	94.8	-168.4	0	0	0	0	0	109.2	L823 D889	L823-A891 HydrophobicContact CD1-CB 4.01Å; D889-A891 PolarHBondContact O-N 3.3Å
892	E	42.4	Very low	53.9	Low	104 Å²	104	103 Å²	103	49%	0.486	55%	0.552	S	S	.	*			trans	-71.6	141.7	173.8	-68.4	-162.6	161.8	0	0	109.8	D890 N894 K896 V897	D890-E892 VanDerWaalsContact C-N 3.35Å; D890-E892 PolarHBondContact O-N 3.16Å; E892-N894 PolarHBondContact O-N 3.38Å; E892-K896 HydrophobicContact CB-CB 4.45Å; E892-V897 HydrophobicContact CB-CG1 4.02Å
893	P	59.7	Low	56	Low	69 Å²	69	105.9 Å²	105.9	45%	0.448	56%	0.558	S	S	.	*			trans	-50.6	133.5	172.5	-24.6	30.6	0	0	0	111.1	L895 K896	P893-L895 PolarHBondContact O-N 2.94Å; P893-K896 HydrophobicContact CB-CG 4.5Å; P893-K896 HydrophobicContact CG-CD 4.41Å; P893-K896 WeakPolarHBondContact O-CB 3.37Å; P893-K896 PolarHBondContact O-N 2.97Å
894	N	66.6	Low	58.3	Low	42 Å²	42	98.8 Å²	98.8	23%	0.225	53%	0.528	C	S	.	.	G	3₁₀ helix	trans	-42.5	-45.4	-173.7	-176.1	15.7	0	0	0	113.5	S817 Y824 E892 K896 V897 M898	S817-N894 VanDerWaalsContact CB-OD1 3.3Å; S817-N894 WeakPolarHBondContact CB-OD1 3.43Å; S817-N894 PolarHBondContact OG-OD1 3.48Å; Y824-N894 HydrophobicContact CD1-CB 4.17Å; Y824-N894 HydrophobicContact CG-CB 4.41Å; E892-N894 PolarHBondContact O-N 3.38Å; N894-K896 PolarHBondContact O-N 3.01Å; N894-K896 VanDerWaalsContact O-N 3.17Å; N894-V897 WeakPolarHBondContact O-CG2 3.1Å; N894-V897 PolarHBondContact O-N 3.2Å; N894-V897 VanDerWaalsContact O-N 3.08Å; N894-M898 WeakPolarHBondContact O-CG 3.33Å; N894-M898 PolarHBondContact O-N 2.85Å
895	L	70.9	Confident	60.7	Low	63 Å²	63	95.1 Å²	95.1	33%	0.33	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-57.8	-32.1	-179.1	-169.3	64.1	0	0	0	113.9	P893 V897 M898 L912 K913	P893-L895 PolarHBondContact O-N 2.94Å; L895-V897 PolarHBondContact O-N 3.43Å; L895-M898 HydrophobicContact CD1-SD 3.84Å; L895-L912 VanDerWaalsContact CD1-O 3.3Å; L895-L912 WeakPolarHBondContact CD1-O 3.29Å; L895-K913 WeakPolarHBondContact CD2-O 3.43Å; L895-K913 WeakPolarHBondContact CG-O 3.49Å; L895-K913 WeakPolarHBondContact O-CA 3.47Å
896	K	73.4	Confident	63.3	Low	107 Å²	107	86.9 Å²	86.9	47%	0.465	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-70.6	-20.2	-179.3	-65	-168.4	-174.3	175.9	0	113.4	E892 P893 N894 K913	E892-K896 HydrophobicContact CB-CB 4.45Å; P893-K896 HydrophobicContact CB-CG 4.5Å; P893-K896 HydrophobicContact CG-CD 4.41Å; P893-K896 WeakPolarHBondContact O-CB 3.37Å; P893-K896 PolarHBondContact O-N 2.97Å; N894-K896 PolarHBondContact O-N 3.01Å; N894-K896 VanDerWaalsContact O-N 3.17Å; K896-K913 WeakPolarHBondContact O-CD 3.01Å; K896-K913 WeakPolarHBondContact O-CE 3.26Å; K896-K913 PolarHBondContact O-NZ 3.28Å; K896-K913 VanDerWaalsContact O-NZ 3.09Å
897	V	78.3	Confident	65.8	Low	31 Å²	31	86.8 Å²	86.8	19%	0.188	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-112.2	9	-175	-58.5	0	0	0	0	113.3	N818 E892 N894 L895	N818-V897 HydrophobicContact CB-CB 4.17Å; N818-V897 HydrophobicContact CB-CG2 4.41Å; N818-V897 PolarHBondContact N-O 3.45Å; N818-V897 PolarHBondContact ND2-O 2.96Å; E892-V897 HydrophobicContact CB-CG1 4.02Å; N894-V897 WeakPolarHBondContact O-CG2 3.1Å; N894-V897 PolarHBondContact O-N 3.2Å; N894-V897 VanDerWaalsContact O-N 3.08Å; L895-V897 PolarHBondContact O-N 3.43Å
898	M	81.3	Confident	68.4	Low	28 Å²	28	80.1 Å²	80.1	14%	0.138	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	136	177.3	-64.3	-171.9	77.6	0	0	112.1	L801 F815 I816 N894 L895 L912	L801-M898 HydrophobicContact CD2-CE 3.49Å; L801-M898 VanDerWaalsContact CD2-CE 3.49Å; L801-M898 HydrophobicContact CD2-SD 3.96Å; F815-M898 HydrophobicContact CB-CE 3.61Å; F815-M898 HydrophobicContact CG-CE 4.19Å; I816-M898 WeakPolarHBondContact O-CA 3.39Å; N894-M898 WeakPolarHBondContact O-CG 3.33Å; N894-M898 PolarHBondContact O-N 2.85Å; L895-M898 HydrophobicContact CD1-SD 3.84Å; M898-L912 HydrophobicContact CB-CB 4.34Å; M898-L912 HydrophobicContact CB-CD1 4.49Å
899	T	83.8	Confident	70.8	Confident	62 Å²	62	72.4 Å²	72.4	38%	0.38	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.1	179.6	51.9	0	0	0	0	111.7	I816 N818	I816-T899 PolarHBondContact N-O 3.29Å; I816-T899 PolarHBondContact O-N 2.95Å; N818-T899 PolarHBondContact ND2-OG1 3.33Å
900	M	83.2	Confident	73.2	Confident	37 Å²	37	68.5 Å²	68.5	18%	0.182	36%	0.363	C	S	.	.			trans	-75.1	147.5	168	-65.8	-65.2	-79.5	0	0	109.9	V813 F815 C904 Y906 P908 L912	V813-M900 HydrophobicContact CG1-CE 3.99Å; F815-M900 HydrophobicContact CD1-SD 3.85Å; F815-M900 HydrophobicContact CE1-SD 3.74Å; M900-C904 HydrophobicContact CE-CB 4.14Å; M900-C904 WeakPolarHBondContact CE-SG 3.42Å; M900-Y906 VanDerWaalsContact CE-O 3.23Å; M900-Y906 WeakPolarHBondContact CE-O 3.31Å; M900-P908 HydrophobicContact CG-CG 3.94Å; M900-L912 HydrophobicContact CG-CD1 3.95Å; M900-L912 HydrophobicContact SD-CD1 3.91Å; M900-L912 HydrophobicContact SD-CD2 4.3Å
901	P	83	Confident	75.4	Confident	39 Å²	39	64.8 Å²	64.8	25%	0.253	35%	0.349	S	S	.	.			trans	-57.6	145.6	165.8	-20.1	30.9	0	0	0	111.7	D814 I816 D903 C904	D814-P901 WeakPolarHBondContact O-CD 3.45Å; I816-P901 HydrophobicContact CD1-CB 4.08Å; I816-P901 HydrophobicContact CD1-CG 4.06Å; I816-P901 HydrophobicContact CG1-CG 4.14Å; P901-D903 VanDerWaalsContact C-N 3.33Å; P901-D903 PolarHBondContact O-N 3.21Å; P901-C904 HydrophobicContact CB-CB 4.24Å; P901-C904 HydrophobicContact CG-CB 4.48Å; P901-C904 VanDerWaalsContact O-CB 3.23Å; P901-C904 WeakPolarHBondContact O-CB 3.49Å; P901-C904 PolarHBondContact O-N 2.68Å
902	E	75.8	Confident	77.6	Confident	197 Å²	197	62 Å²	62	92%	0.921	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-40.4	-177.4	-65.1	-175	169.4	0	0	112.5	C904	E902-C904 VanDerWaalsContact C-N 3.28Å; E902-C904 PolarHBondContact O-N 3.26Å
903	D	77.1	Confident	79.4	Confident	167 Å²	167	62.8 Å²	62.8	89%	0.893	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	21.4	179.7	-63.5	-40.4	0	0	0	113.3	P901 R905	P901-D903 VanDerWaalsContact C-N 3.33Å; P901-D903 PolarHBondContact O-N 3.21Å; D903-R905 PolarHBondContact O-N 3.07Å
904	C	81.5	Confident	80.1	Confident	25 Å²	25	60.9 Å²	60.9	17%	0.169	32%	0.315	C	S	.	.			trans	-73.9	130.1	-178.3	-164.3	0	0	0	0	111.9	M900 P901 E902 Y906	M900-C904 HydrophobicContact CE-CB 4.14Å; M900-C904 WeakPolarHBondContact CE-SG 3.42Å; P901-C904 HydrophobicContact CB-CB 4.24Å; P901-C904 HydrophobicContact CG-CB 4.48Å; P901-C904 VanDerWaalsContact O-CB 3.23Å; P901-C904 WeakPolarHBondContact O-CB 3.49Å; P901-C904 PolarHBondContact O-N 2.68Å; E902-C904 VanDerWaalsContact C-N 3.28Å; E902-C904 PolarHBondContact O-N 3.26Å; C904-Y906 PolarHBondContact O-N 3.48Å
905	R	82.8	Confident	80.8	Confident	41 Å²	41	59 Å²	59	16%	0.155	31%	0.306	C	S	.	.	S	Bend	trans	-55.9	-29.1	172.2	173.2	174.1	173.8	175.5	0.7	112.9	D903 D922 K923 E924 K927 E928	D903-R905 PolarHBondContact O-N 3.07Å; R905-D922 WeakPolarHBondContact CG-OD1 3.46Å; R905-D922 IonicContact CZ-OD1 3.86Å; R905-D922 IonicContact CZ-OD2 3.24Å; R905-D922 IonicContact NE-OD1 3.24Å; R905-D922 PolarHBondContact NE-OD1 3.37Å; R905-D922 IonicContact NE-OD2 2.97Å; R905-D922 PolarHBondContact NE-OD2 3.08Å; R905-D922 IonicContact NH2-OD1 2.75Å; R905-D922 IonicContact NH2-OD2 3.63Å; R905-D922 PolarHBondContact NH2-OD2 3.04Å; R905-K923 WeakPolarHBondContact O-CB 3.46Å; R905-K923 WeakPolarHBondContact O-CG 3.17Å; R905-K923 PolarHBondContact O-N 3.38Å; R905-E924 HydrophobicContact CG-CB 4.15Å; R905-E924 HydrophobicContact CG-CG 4.4Å; R905-E924 PolarHBondContact NH2-O 2.72Å; R905-K927 PolarHBondContact NH1-O 2.9Å; R905-K927 PolarHBondContact NH2-O 2.97Å; R905-E928 PolarHBondContact NH1-O 2.82Å
906	Y	86.4	Confident	81.6	Confident	15 Å²	15	56.3 Å²	56.3	6%	0.059	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	144.6	-171.9	-64.7	-77.3	0	0	0	112.7	P811 V813 M900 C904 L920 R921 D922 E929	P811-Y906 HydrophobicContact CB-CE1 4.23Å; P811-Y906 HydrophobicContact CB-CE2 3.74Å; P811-Y906 WeakPolarHBondContact CB-OH 3.37Å; P811-Y906 HydrophobicContact CG-CE1 4.15Å; P811-Y906 HydrophobicContact CG-CE2 4.17Å; V813-Y906 HydrophobicContact CG2-CD2 3.53Å; V813-Y906 HydrophobicContact CG2-CE2 3.89Å; V813-Y906 HydrophobicContact CG2-CG 4.28Å; M900-Y906 VanDerWaalsContact CE-O 3.23Å; M900-Y906 WeakPolarHBondContact CE-O 3.31Å; C904-Y906 PolarHBondContact O-N 3.48Å; Y906-L920 HydrophobicContact CD1-CB 4.1Å; Y906-L920 HydrophobicContact CG-CB 4.37Å; Y906-L920 HydrophobicContact CG-CD1 4.27Å; Y906-R921 CarbonylContact C-O 3.45Å; Y906-R921 VanDerWaalsContact CA-O 3.24Å; Y906-R921 WeakPolarHBondContact CA-O 3.42Å; Y906-D922 HydrophobicContact CD1-CB 4.23Å; Y906-D922 HydrophobicContact CE1-CB 4.03Å; Y906-E929 PolarHBondContact OH-OE2 3Å; Y906-E929 VanDerWaalsContact OH-OE2 3.07Å
907	E	86.5	Confident	82.4	Confident	91 Å²	91	51.2 Å²	51.2	43%	0.425	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.7	173.6	-173.9	172.4	164.8	0	0	111.1	V909 L920 R921 K923	E907-V909 PolarHBondContact O-N 3.09Å; E907-L920 CarbonylContact O-C 3.57Å; E907-R921 HydrophobicContact CB-CB 4.49Å; E907-R921 PolarHBondContact N-O 2.81Å; E907-R921 PolarHBondContact O-N 3.16Å; E907-K923 WeakPolarHBondContact OE2-CE 3.09Å; E907-K923 IonicContact OE2-NZ 3.97Å
908	P	87.5	Confident	83	Confident	30 Å²	30	49.8 Å²	49.8	20%	0.195	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	131.3	-178.1	31.8	-36.4	0	0	0	111.1	M900 K910 L912 I918 L920	M900-P908 HydrophobicContact CG-CG 3.94Å; P908-K910 WeakPolarHBondContact CB-O 3.5Å; P908-K910 PolarHBondContact O-N 2.7Å; P908-L912 HydrophobicContact CB-CD2 3.85Å; P908-L912 HydrophobicContact CG-CD2 4.04Å; P908-L912 HydrophobicContact CG-CG 4.33Å; P908-I918 HydrophobicContact CB-CG2 3.85Å; P908-L920 HydrophobicContact CB-CD2 3.74Å
909	V	83	Confident	83.4	Confident	32 Å²	32	48.5 Å²	48.5	19%	0.194	26%	0.256	C	S	.	.	S	Bend	trans	-61.1	-27.1	177.3	175.6	0	0	0	0	111.7	A248 V249 Q252 E907 V919 R921	A248-V909 HydrophobicContact CB-CG2 4.02Å; V249-V909 HydrophobicContact CB-CG1 4.49Å; V249-V909 HydrophobicContact CG2-CG1 3.92Å; Q252-V909 HydrophobicContact CB-CG1 4.15Å; Q252-V909 HydrophobicContact CG-CG1 4.5Å; E907-V909 PolarHBondContact O-N 3.09Å; V909-V919 HydrophobicContact CB-CB 4.47Å; V909-V919 WeakPolarHBondContact CB-O 3.46Å; V909-V919 HydrophobicContact CG2-CB 4.04Å; V909-V919 HydrophobicContact CG2-CG1 4.08Å; V909-V919 VanDerWaalsContact CG2-O 3.3Å; V909-V919 WeakPolarHBondContact CG2-O 3.5Å; V909-V919 PolarHBondContact N-O 3.29Å; V909-R921 HydrophobicContact CG2-CG 3.71Å
910	K	83.2	Confident	83.7	Confident	46 Å²	46	45.6 Å²	45.6	20%	0.2	24%	0.238	C	C	.	.	S	Bend	trans	-133.3	151.6	-178.6	-176.2	-179.5	-179.9	-173.6	0	109.7	Q252 D256 P908 L912 S914	Q252-K910 HydrophobicContact CG-CB 4.1Å; Q252-K910 HydrophobicContact CG-CD 4.13Å; D256-K910 IonicContact OD1-NZ 3.95Å; D256-K910 PolarHBondContact OD1-NZ 3.23Å; D256-K910 IonicContact OD2-NZ 3.6Å; D256-K910 PolarHBondContact OD2-NZ 3.18Å; P908-K910 WeakPolarHBondContact CB-O 3.5Å; P908-K910 PolarHBondContact O-N 2.7Å; K910-L912 PolarHBondContact O-N 2.84Å; K910-S914 WeakPolarHBondContact CD-OG 3.5Å; K910-S914 VanDerWaalsContact CE-OG 3.28Å; K910-S914 WeakPolarHBondContact CE-OG 3.28Å
911	S	82.1	Confident	83.7	Confident	69 Å²	69	47.3 Å²	47.3	48%	0.483	24%	0.242	S	C	.	.			trans	-53.2	131.8	175.8	-175.1	0	0	0	0	112.4	K913 S914	S911-K913 PolarHBondContact O-N 3.32Å; S911-K913 WeakPolarHBondContact OG-CG 3.45Å; S911-K913 PolarHBondContact OG-N 3.47Å; S911-S914 WeakPolarHBondContact O-CB 3.31Å; S911-S914 PolarHBondContact O-N 3.19Å; S911-S914 PolarHBondContact O-OG 3.42Å
912	L	81	Confident	83.7	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.031	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-54.7	-26.5	174.5	-59.8	-174.4	0	0	0	112.7	L801 F815 L895 M898 M900 P908 K910 S914 G915 I918	L801-L912 HydrophobicContact CD1-CD2 4.4Å; L801-L912 HydrophobicContact CD2-CB 4.47Å; L801-L912 HydrophobicContact CD2-CD2 4.29Å; F815-L912 HydrophobicContact CD1-CD1 3.81Å; F815-L912 HydrophobicContact CD1-CD2 4.36Å; F815-L912 HydrophobicContact CE1-CD1 4.25Å; F815-L912 HydrophobicContact CE1-CD2 3.96Å; L895-L912 VanDerWaalsContact CD1-O 3.3Å; L895-L912 WeakPolarHBondContact CD1-O 3.29Å; M898-L912 HydrophobicContact CB-CB 4.34Å; M898-L912 HydrophobicContact CB-CD1 4.49Å; M900-L912 HydrophobicContact CG-CD1 3.95Å; M900-L912 HydrophobicContact SD-CD1 3.91Å; M900-L912 HydrophobicContact SD-CD2 4.3Å; P908-L912 HydrophobicContact CB-CD2 3.85Å; P908-L912 HydrophobicContact CG-CD2 4.04Å; P908-L912 HydrophobicContact CG-CG 4.33Å; K910-L912 PolarHBondContact O-N 2.84Å; L912-S914 PolarHBondContact O-N 3.2Å; L912-G915 PolarHBondContact O-N 3.41Å; L912-I918 HydrophobicContact CD2-CD1 3.97Å
913	K	80.2	Confident	83.9	Confident	122 Å²	122	43.1 Å²	43.1	53%	0.53	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-58.9	-18.4	178	-57.2	-172.8	-174.5	-153.7	0	114.1	L895 K896 S911	L895-K913 WeakPolarHBondContact CD2-O 3.43Å; L895-K913 WeakPolarHBondContact CG-O 3.49Å; L895-K913 WeakPolarHBondContact O-CA 3.47Å; K896-K913 WeakPolarHBondContact O-CD 3.01Å; K896-K913 WeakPolarHBondContact O-CE 3.26Å; K896-K913 PolarHBondContact O-NZ 3.28Å; K896-K913 VanDerWaalsContact O-NZ 3.09Å; S911-K913 PolarHBondContact O-N 3.32Å; S911-K913 WeakPolarHBondContact OG-CG 3.45Å; S911-K913 PolarHBondContact OG-N 3.47Å
914	S	75.2	Confident	83.9	Confident	29 Å²	29	38.9 Å²	38.9	20%	0.203	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-77.2	-24.2	176.5	62.4	0	0	0	0	113.8	R764 K910 S911 L912	R764-S914 WeakPolarHBondContact CD-O 3.48Å; K910-S914 WeakPolarHBondContact CD-OG 3.5Å; K910-S914 VanDerWaalsContact CE-OG 3.28Å; K910-S914 WeakPolarHBondContact CE-OG 3.28Å; S911-S914 WeakPolarHBondContact O-CB 3.31Å; S911-S914 PolarHBondContact O-N 3.19Å; S911-S914 PolarHBondContact O-OG 3.42Å; L912-S914 PolarHBondContact O-N 3.2Å
915	G	81.7	Confident	83.2	Confident	3 Å²	3	44.1 Å²	44.1	3%	0.031	21%	0.214	C	C	.	.			trans	64.1	177.1	-179.6	0	0	0	0	0	115.1	R764 L912	R764-G915 PolarHBondContact NH1-O 3.49Å; L912-G915 PolarHBondContact O-N 3.41Å
916	G	86.2	Confident	82.5	Confident	5 Å²	5	50.3 Å²	50.3	5%	0.052	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.6	-143.1	-175.4	0	0	0	0	0	113	C800 L801 I802	C800-G916 WeakPolarHBondContact O-CA 3.46Å; C800-G916 PolarHBondContact O-N 3.26Å; L801-G916 WeakPolarHBondContact CA-O 3.16Å; I802-G916 PolarHBondContact N-O 2.98Å
917	I	90.9	Very high	81.9	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.8	-177	-56.9	162.5	0	0	0	109.5	Q252 L255 Q345 L348 Y349 I802 I804	Q252-I917 PolarHBondContact NE2-O 3.42Å; L255-I917 HydrophobicContact CD1-CB 4.33Å; L255-I917 HydrophobicContact CD1-CG2 3.77Å; L255-I917 HydrophobicContact CD2-CB 4.41Å; L255-I917 HydrophobicContact CD2-CD1 4.37Å; L255-I917 HydrophobicContact CD2-CG2 4.24Å; Q345-I917 HydrophobicContact CB-CD1 3.95Å; Q345-I917 HydrophobicContact CG-CD1 3.68Å; L348-I917 HydrophobicContact CB-CD1 4.42Å; L348-I917 HydrophobicContact CD1-CD1 3.88Å; L348-I917 HydrophobicContact CD1-CG1 4.21Å; L348-I917 HydrophobicContact CD1-CG2 4.09Å; Y349-I917 HydrophobicContact CE1-CD1 4.01Å; Y349-I917 HydrophobicContact CE1-CG1 4.1Å; Y349-I917 HydrophobicContact CE2-CD1 4.43Å; I802-I917 HydrophobicContact CB-CG1 4.26Å; I802-I917 HydrophobicContact CD1-CG1 4.4Å; I802-I917 CarbonylContact O-C 3.6Å; I802-I917 WeakPolarHBondContact O-CA 3.4Å; I804-I917 HydrophobicContact CD1-CG2 3.69Å; I804-I917 HydrophobicContact CG1-CG2 3.93Å; I804-I917 HydrophobicContact CG2-CG2 4.12Å
918	I	90.3	Very high	81.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.1	179.6	-60.6	-171.6	0	0	0	109.6	Q252 L801 I802 G803 I804 P908 L912 L920	Q252-I918 VanDerWaalsContact OE1-CA 3.31Å; L801-I918 HydrophobicContact CD1-CD1 3.56Å; L801-I918 HydrophobicContact CD1-CG1 3.96Å; I802-I918 PolarHBondContact O-N 3.04Å; G803-I918 WeakPolarHBondContact CA-O 3.45Å; I804-I918 PolarHBondContact N-O 2.83Å; P908-I918 HydrophobicContact CB-CG2 3.85Å; L912-I918 HydrophobicContact CD2-CD1 3.97Å; I918-L920 HydrophobicContact CG2-CD2 4.4Å
919	V	90.2	Very high	80.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.9	172.3	-174	0	0	0	0	109.2	A248 Q252 L255 I804 V909	A248-V919 HydrophobicContact CB-CG1 4.05Å; Q252-V919 HydrophobicContact CB-CG2 4.18Å; L255-V919 HydrophobicContact CD1-CG2 3.92Å; I804-V919 HydrophobicContact CD1-CG2 4.09Å; I804-V919 HydrophobicContact CG1-CG2 4.07Å; I804-V919 CarbonylContact O-C 3.48Å; I804-V919 WeakPolarHBondContact O-CA 3.15Å; V909-V919 HydrophobicContact CB-CB 4.47Å; V909-V919 WeakPolarHBondContact CB-O 3.46Å; V909-V919 HydrophobicContact CG2-CB 4.04Å; V909-V919 HydrophobicContact CG2-CG1 4.08Å; V909-V919 VanDerWaalsContact CG2-O 3.3Å; V909-V919 WeakPolarHBondContact CG2-O 3.5Å; V909-V919 PolarHBondContact N-O 3.29Å
920	L	89.2	Confident	80.4	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.7	179.4	-61.4	-174.3	0	0	0	108.8	I804 P811 V813 Y906 E907 P908 I918	I804-L920 WeakPolarHBondContact O-CB 3.43Å; I804-L920 PolarHBondContact O-N 3.43Å; P811-L920 HydrophobicContact CG-CD1 4.23Å; V813-L920 HydrophobicContact CB-CD1 4.5Å; V813-L920 HydrophobicContact CG2-CD1 3.95Å; Y906-L920 HydrophobicContact CD1-CB 4.1Å; Y906-L920 HydrophobicContact CG-CB 4.37Å; Y906-L920 HydrophobicContact CG-CD1 4.27Å; E907-L920 CarbonylContact O-C 3.57Å; P908-L920 HydrophobicContact CB-CD2 3.74Å; I918-L920 HydrophobicContact CG2-CD2 4.4Å
921	R	84.4	Confident	80.3	Confident	74 Å²	74	66.9 Å²	66.9	28%	0.279	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.2	168.9	-64.1	-178.2	176.9	154.1	-2.8	109	V249 Y906 E907 V909	V249-R921 VanDerWaalsContact CG2-NH2 3.33Å; Y906-R921 CarbonylContact C-O 3.45Å; Y906-R921 VanDerWaalsContact CA-O 3.24Å; Y906-R921 WeakPolarHBondContact CA-O 3.42Å; E907-R921 HydrophobicContact CB-CB 4.49Å; E907-R921 PolarHBondContact N-O 2.81Å; E907-R921 PolarHBondContact O-N 3.16Å; V909-R921 HydrophobicContact CG2-CG 3.71Å
922	D	82.1	Confident	80.1	Confident	17 Å²	17	65.4 Å²	65.4	9%	0.091	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123	174.7	-172.8	0.4	0	0	0	109.4	R905 Y906 E924 E925	R905-D922 WeakPolarHBondContact CG-OD1 3.46Å; R905-D922 IonicContact CZ-OD1 3.86Å; R905-D922 IonicContact CZ-OD2 3.24Å; R905-D922 IonicContact NE-OD1 3.24Å; R905-D922 PolarHBondContact NE-OD1 3.37Å; R905-D922 IonicContact NE-OD2 2.97Å; R905-D922 PolarHBondContact NE-OD2 3.08Å; R905-D922 IonicContact NH2-OD1 2.75Å; R905-D922 IonicContact NH2-OD2 3.63Å; R905-D922 PolarHBondContact NH2-OD2 3.04Å; Y906-D922 HydrophobicContact CD1-CB 4.23Å; Y906-D922 HydrophobicContact CE1-CB 4.03Å; D922-E924 VanDerWaalsContact C-N 3.32Å; D922-E924 PolarHBondContact OD1-N 2.75Å; D922-E925 HydrophobicContact CB-CG 4.25Å
923	K	79.8	Confident	79.7	Confident	130 Å²	130	72.9 Å²	72.9	57%	0.565	35%	0.347	S	S	*	.	S	Bend	trans	-80.1	-17.1	174.6	-62.5	-179.2	-174.5	175.2	0	112.5	R905 E907	R905-K923 WeakPolarHBondContact O-CB 3.46Å; R905-K923 WeakPolarHBondContact O-CG 3.17Å; R905-K923 PolarHBondContact O-N 3.38Å; E907-K923 WeakPolarHBondContact OE2-CE 3.09Å; E907-K923 IonicContact OE2-NZ 3.97Å
924	E	78	Confident	79.2	Confident	79 Å²	79	72.1 Å²	72.1	37%	0.369	35%	0.348	S	S	.	.			trans	-128.8	56.6	-171.6	-58	-169.9	135.7	0	0	111.8	R905 D922 N926 K927	R905-E924 HydrophobicContact CG-CB 4.15Å; R905-E924 HydrophobicContact CG-CG 4.4Å; R905-E924 PolarHBondContact NH2-O 2.72Å; D922-E924 VanDerWaalsContact C-N 3.32Å; D922-E924 PolarHBondContact OD1-N 2.75Å; E924-N926 PolarHBondContact O-N 3.09Å; E924-K927 HydrophobicContact CB-CD 4.45Å; E924-K927 PolarHBondContact O-N 2.79Å; E924-K927 IonicContact OE1-NZ 3.5Å; E924-K927 PolarHBondContact OE1-NZ 3.5Å; E924-K927 WeakPolarHBondContact OE2-CD 3.46Å; E924-K927 WeakPolarHBondContact OE2-CE 3.4Å; E924-K927 IonicContact OE2-NZ 3.12Å; E924-K927 PolarHBondContact OE2-NZ 3.36Å
925	E	66.6	Low	78.8	Confident	134 Å²	134	73.5 Å²	73.5	63%	0.626	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-21	-176.4	-64.5	-173.8	158.8	0	0	114.9	D922 K927	D922-E925 HydrophobicContact CB-CG 4.25Å; E925-K927 VanDerWaalsContact C-N 3.32Å; E925-K927 PolarHBondContact O-N 2.77Å
926	N	68.7	Low	77.9	Confident	171 Å²	171	81.8 Å²	81.8	91%	0.914	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-10.8	-179.3	-64.5	-31.7	0	0	0	114.5	E924	E924-N926 PolarHBondContact O-N 3.09Å
927	K	73.1	Confident	76.6	Confident	116 Å²	116	83.2 Å²	83.2	50%	0.504	40%	0.399	S	S	.	.	S	Bend	trans	-98.8	148.6	-180	-67.1	-176.1	-169.1	163.6	0	110.8	R905 E924 E925	R905-K927 PolarHBondContact NH1-O 2.9Å; R905-K927 PolarHBondContact NH2-O 2.97Å; E924-K927 HydrophobicContact CB-CD 4.45Å; E924-K927 PolarHBondContact O-N 2.79Å; E924-K927 IonicContact OE1-NZ 3.5Å; E924-K927 PolarHBondContact OE1-NZ 3.5Å; E924-K927 WeakPolarHBondContact OE2-CD 3.46Å; E924-K927 WeakPolarHBondContact OE2-CE 3.4Å; E924-K927 IonicContact OE2-NZ 3.12Å; E924-K927 PolarHBondContact OE2-NZ 3.36Å; E925-K927 VanDerWaalsContact C-N 3.32Å; E925-K927 PolarHBondContact O-N 2.77Å
928	E	72.5	Confident	74.9	Confident	191 Å²	191	88.3 Å²	88.3	89%	0.893	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-62.1	141.9	171.5	-69.9	-174.9	165.9	0	0	110.8	R905	R905-E928 PolarHBondContact NH1-O 2.82Å
929	E	76.1	Confident	73	Confident	36 Å²	36	89.7 Å²	89.7	17%	0.168	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-95.6	128.9	-178.3	-64.6	-177.5	-117	0	0	110.2	N805 K807 Y906 L931	N805-E929 PolarHBondContact ND2-OE2 2.85Å; K807-E929 IonicContact NZ-OE1 3.32Å; K807-E929 PolarHBondContact NZ-OE1 3.14Å; Y906-E929 PolarHBondContact OH-OE2 3Å; Y906-E929 VanDerWaalsContact OH-OE2 3.07Å; E929-L931 HydrophobicContact CB-CD2 4.28Å; E929-L931 PolarHBondContact O-N 2.69Å
930	E	77.3	Confident	71.1	Confident	149 Å²	149	93.7 Å²	93.7	70%	0.696	46%	0.458	S	S	*	.			trans	-80.7	113.8	168.8	-69.2	-177.9	-177	0	0	108.9	P811 Q812	P811-E930 WeakPolarHBondContact CA-O 3.47Å; Q812-E930 PolarHBondContact N-O 3.47Å
931	L	80.9	Confident	68.9	Low	71 Å²	71	96.5 Å²	96.5	37%	0.372	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-98.5	142.9	-178.9	-60.2	-180	0	0	0	110.8	Q809 E929 E933	Q809-L931 HydrophobicContact CB-CD1 4.19Å; Q809-L931 HydrophobicContact CB-CD2 3.9Å; Q809-L931 HydrophobicContact CG-CD1 4.43Å; E929-L931 HydrophobicContact CB-CD2 4.28Å; E929-L931 PolarHBondContact O-N 2.69Å; L931-E933 PolarHBondContact O-N 3.1Å
932	V	78.7	Confident	66.6	Low	38 Å²	38	99.9 Å²	99.9	23%	0.23	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-65.5	129.5	174.8	177.2	0	0	0	0	109.7	M810 Q812 I934	M810-V932 HydrophobicContact CE-CB 3.72Å; M810-V932 HydrophobicContact CE-CG1 3.6Å; M810-V932 HydrophobicContact CE-CG2 4.31Å; M810-V932 HydrophobicContact CG-CB 4.21Å; M810-V932 HydrophobicContact CG-CG2 4.04Å; M810-V932 PolarHBondContact O-N 2.88Å; Q812-V932 HydrophobicContact CB-CG2 4.08Å; V932-I934 PolarHBondContact O-N 2.96Å
933	E	72.6	Confident	64.4	Low	162 Å²	162	107.7 Å²	107.7	76%	0.757	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-58	127.4	178.4	-171.6	178.7	-175.6	0	0	111.4	K355 L931 V935	K355-E933 WeakPolarHBondContact CE-O 3.5Å; K355-E933 PolarHBondContact NZ-O 3.15Å; L931-E933 PolarHBondContact O-N 3.1Å; E933-V935 PolarHBondContact O-N 2.75Å
934	I	69.7	Low	62.4	Low	107 Å²	107	104.8 Å²	104.8	55%	0.549	54%	0.543	S	S	.	.			trans	-79.5	115.1	177.9	-60.6	175.5	0	0	0	107.7	V932 K936	V932-I934 PolarHBondContact O-N 2.96Å; I934-K936 PolarHBondContact O-N 3.41Å
935	V	66.5	Low	60.6	Low	58 Å²	58	108.1 Å²	108.1	35%	0.352	56%	0.563	S	S	.	*			trans	-74.2	114.6	175	171.9	0	0	0	0	107.2	Q351 K355 E933	Q351-V935 PolarHBondContact NE2-O 3.3Å; Q351-V935 PolarHBondContact OE1-O 3.46Å; K355-V935 HydrophobicContact CD-CG2 4.37Å; K355-V935 VanDerWaalsContact CE-CG2 3.4Å; K355-V935 HydrophobicContact CG-CG2 3.98Å; E933-V935 PolarHBondContact O-N 2.75Å
936	K	62.7	Low	58.9	Low	176 Å²	176	110.2 Å²	110.2	77%	0.765	57%	0.573	S	S	*	*			trans	-69.8	131.5	169.4	-70.9	-174.6	-178.6	178.6	0	108.2	I934 V938	I934-K936 PolarHBondContact O-N 3.41Å; K936-V938 PolarHBondContact O-N 3.01Å
937	P	57.8	Low	57.5	Low	35 Å²	35	107.8 Å²	107.8	23%	0.227	57%	0.566	C	S	.	*			trans	-55	132.4	171.1	-11.3	17	0	0	0	110.1	M354 H426 I939	M354-P937 HydrophobicContact CE-CB 3.63Å; M354-P937 HydrophobicContact CE-CG 3.67Å; M354-P937 HydrophobicContact SD-CB 4.32Å; M354-P937 HydrophobicContact SD-CG 4.27Å; H426-P937 WeakPolarHBondContact CE1-CB 3.34Å; H426-P937 WeakPolarHBondContact CE1-CG 3.34Å; P937-I939 PolarHBondContact O-N 3.24Å
938	V	55.7	Low	55.9	Low	109 Å²	109	110.8 Å²	110.8	66%	0.661	58%	0.582	S	S	*	*			trans	-81.9	108.6	173.2	-177.3	0	0	0	0	108	K936 D940	K936-V938 PolarHBondContact O-N 3.01Å; V938-D940 WeakPolarHBondContact CG1-OD1 3.22Å
939	I	50.7	Low	54.4	Low	30 Å²	30	107.1 Å²	107.1	15%	0.154	58%	0.575	C	S	.	*			trans	-103.4	97.5	161.7	-58.7	-170.4	0	0	0	107.1	E429 V433 P937 G941 E942	E429-I939 HydrophobicContact CB-CD1 3.35Å; E429-I939 HydrophobicContact CG-CD1 3.94Å; E429-I939 WeakPolarHBondContact OE2-CD1 3.49Å; E429-I939 WeakPolarHBondContact OE2-CG1 3.36Å; V433-I939 HydrophobicContact CG2-CD1 3.49Å; V433-I939 VanDerWaalsContact CG2-CD1 3.49Å; V433-I939 HydrophobicContact CG2-CG1 4.35Å; P937-I939 PolarHBondContact O-N 3.24Å; I939-G941 PolarHBondContact O-N 3.38Å; I939-G941 VanDerWaalsContact O-N 3.09Å; I939-E942 PolarHBondContact O-N 2.97Å
940	D	49.2	Very low	53	Low	83 Å²	83	111.2 Å²	111.2	44%	0.444	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	117.9	176.8	-68.8	-42.2	0	0	0	109.9	R398 V938	R398-D940 IonicContact CZ-OD2 2.93Å; R398-D940 IonicContact NH1-OD2 2.85Å; R398-D940 PolarHBondContact NH1-OD2 3.16Å; V938-D940 WeakPolarHBondContact CG1-OD1 3.22Å
941	G	42.8	Very low	52.2	Low	60 Å²	60	112.8 Å²	112.8	62%	0.619	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	148.4	-26.6	-160.3	0	0	0	0	0	109.6	I939	I939-G941 PolarHBondContact O-N 3.38Å; I939-G941 VanDerWaalsContact O-N 3.09Å
942	E	37.5	Very low	51.1	Low	146 Å²	146	115.1 Å²	115.1	68%	0.682	63%	0.631	S	S	*	*	S	Bend	trans	-72.1	130.7	137.4	-65.7	-175.6	178.7	0	0	106.6	I939 A944	I939-E942 PolarHBondContact O-N 2.97Å; E942-A944 PolarHBondContact O-N 3.17Å
943	E	34.8	Very low	50	Low	180 Å²	180	121.7 Å²	121.7	84%	0.841	66%	0.657	S	S	*	*			trans	-50.4	103.6	-174.5	-66.1	164.8	167.7	0	0	109.6	N945	E943-N945 PolarHBondContact O-N 3.35Å
944	A	38.1	Very low	49.4	Very low	69 Å²	69	121.1 Å²	121.1	57%	0.57	66%	0.66	S	S	*	*			trans	-55.7	103.7	157.5	0	0	0	0	0	104.1	E942 E946	E942-A944 PolarHBondContact O-N 3.17Å; A944-E946 PolarHBondContact O-N 2.7Å
945	N	40	Very low	48.4	Very low	150 Å²	150	125.1 Å²	125.1	80%	0.802	67%	0.669	S	S	*	*			trans	-40.7	105.8	179.1	-75	-45.4	0	0	0	106.8	E943 P947	E943-N945 PolarHBondContact O-N 3.35Å; N945-P947 VanDerWaalsContact O-N 3.13Å
946	E	31.5	Very low	47.9	Very low	177 Å²	177	128.5 Å²	128.5	83%	0.827	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-49.9	128.8	168.5	-87.2	-176.7	149.6	0	0	104.8	A944 E948	A944-E946 PolarHBondContact O-N 2.7Å; E946-E948 PolarHBondContact O-N 3.29Å; E946-E948 VanDerWaalsContact O-N 3.08Å
947	P	38.3	Very low	47.2	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-49.7	128.5	177.4	19.6	-30.5	0	0	0	107.2	N945	N945-P947 VanDerWaalsContact O-N 3.13Å
948	E	39.6	Very low	46.7	Very low	179 Å²	179	137 Å²	137	84%	0.836	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-46.6	133.1	-176.5	-72.4	-174.5	163.1	0	0	108.7	E946	E946-E948 PolarHBondContact O-N 3.29Å; E946-E948 VanDerWaalsContact O-N 3.08Å
949	P	42.2	Very low	46.2	Very low	115 Å²	115	138.4 Å²	138.4	75%	0.747	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-52.4	133	179.8	20.3	-30.8	0	0	0	108.1	E951	P949-E951 PolarHBondContact O-N 3.13Å
950	P	47	Very low	46	Very low	122 Å²	122	144.4 Å²	144.4	79%	0.792	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-53	139.9	-178.1	19	-30	0	0	0	109.7
951	E	60.7	Low	45.8	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-48.3	136.4	178.8	-74.1	-173.9	158.6	0	0	110	P949 F953	P949-E951 PolarHBondContact O-N 3.13Å; E951-F953 PolarHBondContact O-N 2.7Å
952	P	56.9	Low	46	Very low	120 Å²	120	153.6 Å²	153.6	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-55.3	119.2	-180	19.5	-29	0	0	0	109.5	D954	P952-D954 PolarHBondContact O-N 2.77Å
953	F	55.2	Low	46.5	Very low	177 Å²	177	154.1 Å²	154.1	78%	0.776	81%	0.808	S	S	*	*			trans	-67.6	104.7	176.9	-175.3	-94.4	0	0	0	108.8	E951 Y955	E951-F953 PolarHBondContact O-N 2.7Å; F953-Y955 HydrophobicContact CD1-CD2 4.33Å; F953-Y955 AromaticContact CE1-CD2 3.89Å; F953-Y955 HydrophobicContact CE1-CD2 3.89Å; F953-Y955 PolarHBondContact O-N 2.85Å; F953-Y955 VanDerWaalsContact O-N 3.09Å
954	D	60.1	Low	47.4	Very low	150 Å²	150	152.2 Å²	152.2	80%	0.802	81%	0.805	S	S	*	*			trans	-69.3	104.1	171.8	-95.2	-24.1	0	0	0	109.2	P952 T956	P952-D954 PolarHBondContact O-N 2.77Å; D954-T956 PolarHBondContact O-N 3.13Å
955	Y	49.3	Very low	48.1	Very low	190 Å²	190	158.6 Å²	158.6	75%	0.745	82%	0.823	S	S	*	*			trans	-75.1	104.3	169.6	-154.3	-83.5	0	0	0	108	F953	F953-Y955 HydrophobicContact CD1-CD2 4.33Å; F953-Y955 AromaticContact CE1-CD2 3.89Å; F953-Y955 HydrophobicContact CE1-CD2 3.89Å; F953-Y955 PolarHBondContact O-N 2.85Å; F953-Y955 VanDerWaalsContact O-N 3.09Å
956	T	56.9	Low	48.8	Very low	129 Å²	129	159.3 Å²	159.3	79%	0.791	83%	0.825	S	S	*	*			trans	-77.5	118.1	161.6	37.2	0	0	0	0	108.2	D954	D954-T956 PolarHBondContact O-N 3.13Å
957	E	47.6	Very low	50.3	Low	252 Å²	252	157.7 Å²	157.7	100%	1.178	83%	0.825	S	S	*	*			trans	-54.5	0	175.9	-79	-172	153.9	0	0	113.7

Retrieved 957 of 957 residues in 3193.5 ms (Link to these results)

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