A0A3Q0KM03_SCHMA Loading...

Transporter

AlphaFold DB , UniProt , Accession A0A3Q0KM03, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 817 aa.

						>A0A3Q0KM03_SCHMA|A0A3Q0KM03
MNSENASNPQETTKTKNHVPTLMLTDENSGEACEITVKDEKGNDVDIRLDLEKQQARGGWNGKLEFVMTCIGYAVGLGNVWRFPYLCHKNGGGAFLIPYCLMLILLGLPLFFLEFAFGQFASLGPISVWNISPLFKGIGYAMVILSWILVVYYQIVVAHCLYFLCASFTSRLPWTDCDPSWSSPNCMDASRANFTNITNPKAPSEDYYFNEVIKLSSGLEEFGTPSWSLSLCLLTCWIICALAVIKGVQSLGKVSYFTGIFPYVMLTILLIRSVLLPGAKDGVLYYLTPDFSRLKDPQVWADAATQIFFSLGCCNGGLITMSSYNKFKNNCCRDAVIFAIINCATSVYAGFVIFSNLGFMALTKNTTVAAVATSGPGLAFVVYPEAMTNMPLPSLWSVLFFIMMLTLGLGSQFSILETTLSGTEDELRRLGVVLTTRRKMFYRIIICFVDFLLGLPMVCAGGYYLFSICDSVISGYTPLVIALCETIVICYVYGLKQFRRDIELMIDERPNWYWRICWLVFTPIICFLLIISIFIYSTEFKEGNYTYPQWALIFRQILAAIPVLTIIAWFLYKYCKEGGFVLMKEFLKPVHEWGPAEKEYRTEFISMIKSNESLHRSRIYDIGPGNASTTMAHALSNSQMQMNFNLGGSIVSGLAVATGVMDDTKFFQSKLKVAEKLTEAHTKEVIKRVASNADFAPLDTNLAIAASQTALAAASSAVILNTLQKQIPENSTQTLTSIKLPEQIERGDDDDDDDDNVNIVRIKQITPSNHNHDLNDHHQSATPHCLQQSQYQEENHEVHFDKLNKIQRLIDKVKNSI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.5	Very low	29.4	Very low	237 Å²	237	155.8 Å²	155.8	100%	1.167	86%	0.858	S	S	*	*				0	145.3	0	-90.3	177.5	163.9	0	0	108.3
2	N	30.1	Very low	29.4	Very low	151 Å²	151	153.1 Å²	153.1	81%	0.807	85%	0.849	S	S	*	*			trans	86.3	92.6	-174	-57.8	2	0	0	0	112.7
3	S	25.5	Very low	29.4	Very low	102 Å²	102	151.8 Å²	151.8	71%	0.713	85%	0.849	S	S	*	*				71	111.2	74.8	76.1	0	0	0	0	111.9
4	E	31.3	Very low	29.3	Very low	197 Å²	197	154.5 Å²	154.5	92%	0.921	85%	0.847	S	S	*	*			trans	-166.5	134.6	135.7	-109.1	166.8	-163.2	0	0	111.2
5	N	28.7	Very low	29.2	Very low	170 Å²	170	152.1 Å²	152.1	91%	0.909	84%	0.839	S	S	*	*			trans	-65.3	130	179.7	-71.7	-41.3	0	0	0	111.2
6	A	34.9	Very low	29.1	Very low	95 Å²	95	154.6 Å²	154.6	79%	0.785	84%	0.838	S	S	*	*			trans	-122.7	103.3	157.5	0	0	0	0	0	108.6
7	S	29.4	Very low	29	Very low	116 Å²	116	153.4 Å²	153.4	81%	0.811	83%	0.832	S	S	*	*			trans	-13	116.6	161.2	48.9	0	0	0	0	116.6
8	N	29.1	Very low	29.1	Very low	158 Å²	158	153.1 Å²	153.1	85%	0.845	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-81.2	129	163.2	-138.4	2.9	0	0	0	108.3	Q10	N8-Q10 PolarHBondContact O-N 3.45Å
9	P	29.9	Very low	28.9	Very low	109 Å²	109	149.3 Å²	149.3	71%	0.708	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-71.6	130.2	-174.2	21.7	-20.4	0	0	0	110.8	E11	P9-E11 PolarHBondContact O-N 3.15Å; P9-E11 VanDerWaalsContact O-N 3.15Å
10	Q	28.8	Very low	28.8	Very low	189 Å²	189	145 Å²	145	88%	0.883	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-48.6	116.8	169.4	-75.8	173.4	-44.6	0	0	110	N8 T12	N8-Q10 PolarHBondContact O-N 3.45Å; Q10-T12 PolarHBondContact O-N 3.02Å
11	E	27.7	Very low	28.7	Very low	190 Å²	190	143.1 Å²	143.1	89%	0.888	78%	0.779	S	S	*	*			trans	-57.2	101.2	160.2	-82.1	-179.4	137.6	0	0	108.1	P9 T13	P9-E11 PolarHBondContact O-N 3.15Å; P9-E11 VanDerWaalsContact O-N 3.15Å; E11-T13 PolarHBondContact O-N 2.94Å
12	T	29.1	Very low	28.6	Very low	123 Å²	123	137.5 Å²	137.5	76%	0.755	75%	0.754	S	S	*	*			trans	-56.2	109.6	162.4	44.1	0	0	0	0	107.9	Q10 K14	Q10-T12 PolarHBondContact O-N 3.02Å; T12-K14 PolarHBondContact O-N 3.01Å
13	T	28.8	Very low	28.5	Very low	137 Å²	137	137.2 Å²	137.2	84%	0.84	75%	0.749	S	S	*	*			trans	-41.7	99.5	164	27.3	0	0	0	0	109.7	E11 T15	E11-T13 PolarHBondContact O-N 2.94Å; T13-T15 PolarHBondContact O-N 2.87Å
14	K	28.4	Very low	28.7	Very low	189 Å²	189	138.6 Å²	138.6	82%	0.822	75%	0.748	S	S	*	*			trans	-60.3	107.1	164.9	-76.2	178.8	176.8	174.9	0	106.5	T12 K16	T12-K14 PolarHBondContact O-N 3.01Å; K14-K16 PolarHBondContact O-N 2.84Å
15	T	28.1	Very low	28.6	Very low	119 Å²	119	134.6 Å²	134.6	73%	0.73	74%	0.737	S	S	*	*			trans	-46.4	108.7	159.7	38.3	0	0	0	0	107.1	T13 N17	T13-T15 PolarHBondContact O-N 2.87Å; T15-N17 PolarHBondContact O-N 2.98Å
16	K	27.6	Very low	28.7	Very low	191 Å²	191	133.9 Å²	133.9	83%	0.83	73%	0.733	S	S	*	*			trans	-57.2	108.4	171.3	-79	178.7	175.6	176.7	0	106	K14 H18	K14-K16 PolarHBondContact O-N 2.84Å; K16-H18 VanDerWaalsContact C-N 3.26Å; K16-H18 PolarHBondContact O-N 2.94Å
17	N	27.9	Very low	28.7	Very low	135 Å²	135	138.8 Å²	138.8	72%	0.722	74%	0.74	S	S	*	*			trans	-59	95.2	167.9	-75.2	-11.7	0	0	0	106.8	T15 V19	T15-N17 PolarHBondContact O-N 2.98Å; N17-V19 VanDerWaalsContact C-N 3.29Å; N17-V19 PolarHBondContact O-N 2.95Å
18	H	29.4	Very low	28.9	Very low	147 Å²	147	141.3 Å²	141.3	68%	0.681	74%	0.744	S	S	*	*			trans	-69.7	96.1	167.2	-99.2	-42.7	0	0	0	106.7	K16 P20	K16-H18 VanDerWaalsContact C-N 3.26Å; K16-H18 PolarHBondContact O-N 2.94Å; H18-P20 WeakPolarHBondContact O-CD 3.49Å
19	V	26.8	Very low	29.1	Very low	82 Å²	82	137.7 Å²	137.7	50%	0.497	73%	0.731	S	S	.	*			trans	-59.1	120.7	165.8	-179.8	0	0	0	0	106.9	N17 T21 L702	N17-V19 VanDerWaalsContact C-N 3.29Å; N17-V19 PolarHBondContact O-N 2.95Å; V19-T21 PolarHBondContact O-N 3.46Å; V19-T21 VanDerWaalsContact O-N 3.11Å; V19-L702 HydrophobicContact CG1-CD1 4.12Å
20	P	26.8	Very low	29.6	Very low	62 Å²	62	135.3 Å²	135.3	40%	0.403	73%	0.727	S	S	.	*			trans	-57.7	118.9	174.3	-20.6	31.5	0	0	0	108.8	H18 L22	H18-P20 WeakPolarHBondContact O-CD 3.49Å; P20-L22 PolarHBondContact O-N 3.37Å
21	T	26.7	Very low	30.2	Very low	106 Å²	106	132.6 Å²	132.6	65%	0.65	71%	0.714	S	S	*	*			trans	-80.7	110.1	175.4	-57.1	0	0	0	0	107.5	V19 M23	V19-T21 PolarHBondContact O-N 3.46Å; V19-T21 VanDerWaalsContact O-N 3.11Å; T21-M23 HydrophobicContact CG2-CG 4.14Å; T21-M23 HydrophobicContact CG2-SD 4.35Å; T21-M23 PolarHBondContact O-N 3.41Å
22	L	26.5	Very low	30.7	Very low	120 Å²	120	124.5 Å²	124.5	63%	0.628	68%	0.68	S	S	*	*			trans	-73.1	91.7	173.2	-160.9	115	0	0	0	108.1	P20 L24 I35	P20-L22 PolarHBondContact O-N 3.37Å; L22-L24 HydrophobicContact CD2-CD1 4.49Å; L22-L24 HydrophobicContact CD2-CD2 4.27Å; L22-L24 HydrophobicContact CD2-CG 4.09Å; L22-L24 PolarHBondContact O-N 3.16Å; L22-I35 HydrophobicContact CD1-CG2 4.23Å
23	M	26.5	Very low	31.4	Very low	145 Å²	145	120.7 Å²	120.7	71%	0.714	66%	0.657	S	S	*	*			trans	-81.6	108.3	171.6	-69.6	-80.1	-139	0	0	108	T21 T25	T21-M23 HydrophobicContact CG2-CG 4.14Å; T21-M23 HydrophobicContact CG2-SD 4.35Å; T21-M23 PolarHBondContact O-N 3.41Å; M23-T25 PolarHBondContact O-N 3.42Å
24	L	29.9	Very low	32	Very low	131 Å²	131	118.2 Å²	118.2	69%	0.686	64%	0.637	S	S	*	*			trans	-80.6	110.8	164.4	-68.8	165.6	0	0	0	106.8	L22	L22-L24 HydrophobicContact CD2-CD1 4.49Å; L22-L24 HydrophobicContact CD2-CD2 4.27Å; L22-L24 HydrophobicContact CD2-CG 4.09Å; L22-L24 PolarHBondContact O-N 3.16Å
25	T	28.9	Very low	33.2	Very low	112 Å²	112	111.5 Å²	111.5	69%	0.687	61%	0.609	S	S	*	*			trans	-66.9	142.5	173	45.9	0	0	0	0	110.6	M23	M23-T25 PolarHBondContact O-N 3.42Å
26	D	32.3	Very low	33.9	Very low	156 Å²	156	108.9 Å²	108.9	83%	0.834	59%	0.593	S	S	*	*			trans	-42	139.5	-170.9	-76.1	-41.9	0	0	0	115.7	N28	D26-N28 PolarHBondContact O-N 3.05Å
27	E	34.5	Very low	35.3	Very low	198 Å²	198	102.4 Å²	102.4	93%	0.925	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	18.6	-167.9	-72.2	-172	139.9	0	0	118.2
28	N	34.1	Very low	36.5	Very low	169 Å²	169	101.2 Å²	101.2	90%	0.904	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	13.2	-170.4	-92.5	-7.4	0	0	0	118.1	D26	D26-N28 PolarHBondContact O-N 3.05Å
29	S	33.4	Very low	37.9	Very low	81 Å²	81	97.1 Å²	97.1	57%	0.566	54%	0.541	S	S	*	.	S	Bend	trans	-124	114.3	163.1	56.7	0	0	0	0	109.7	E31	S29-E31 PolarHBondContact O-N 3.4Å
30	G	39.7	Very low	39.2	Very low	60 Å²	60	102.5 Å²	102.5	62%	0.619	56%	0.561	S	S	*	*			trans	-67	78.4	176.9	0	0	0	0	0	111.3
31	E	40.6	Very low	40.8	Very low	131 Å²	131	108.2 Å²	108.2	61%	0.612	58%	0.579	S	S	*	*			trans	-149.4	154.3	-178.6	-76.9	-172.7	-166.4	0	0	108.1	S29 R48	S29-E31 PolarHBondContact O-N 3.4Å; E31-R48 IonicContact OE2-CZ 3.66Å; E31-R48 IonicContact OE2-NH1 3.97Å; E31-R48 IonicContact OE2-NH2 3.71Å; E31-R48 PolarHBondContact OE2-NH2 3.12Å
32	A	39.5	Very low	42.4	Very low	20 Å²	20	105.1 Å²	105.1	17%	0.165	57%	0.568	C	S	.	*			trans	-11.4	138.5	173.6	0	0	0	0	0	119.1	E34 R48 L49 D50	A32-E34 PolarHBondContact O-N 3.18Å; A32-R48 HydrophobicContact CB-CB 4.29Å; A32-R48 HydrophobicContact CB-CG 3.09Å; A32-L49 CarbonylContact C-O 3.6Å; A32-L49 WeakPolarHBondContact CA-O 2.9Å; A32-D50 WeakPolarHBondContact CB-OD1 3.26Å
33	C	44	Very low	43.9	Very low	43 Å²	43	103.7 Å²	103.7	29%	0.291	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.9	103.5	161.5	-156.5	0	0	0	0	107.4	I35 I47 L49 L51	C33-I35 PolarHBondContact O-N 3.19Å; C33-I47 VanDerWaalsContact O-O 3.05Å; C33-L49 HydrophobicContact CB-CB 4.19Å; C33-L49 PolarHBondContact N-O 3.08Å; C33-L49 WeakPolarHBondContact O-CB 3.4Å; C33-L49 PolarHBondContact O-N 3.19Å; C33-L51 HydrophobicContact CB-CD1 4.28Å
34	E	40.1	Very low	45.6	Very low	86 Å²	86	101.8 Å²	101.8	40%	0.402	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.4	107.2	175.9	-157	156.5	-132.5	0	0	107.5	A32 D46 I47	A32-E34 PolarHBondContact O-N 3.18Å; E34-D46 HydrophobicContact CG-CB 3.94Å; E34-I47 WeakPolarHBondContact CA-O 3.35Å
35	I	53.2	Low	47	Very low	48 Å²	48	98.9 Å²	98.9	25%	0.246	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	105.7	177.1	-54.3	177.5	0	0	0	107.2	L22 C33 V37 I47 L49	L22-I35 HydrophobicContact CD1-CG2 4.23Å; C33-I35 PolarHBondContact O-N 3.19Å; I35-V37 HydrophobicContact CG2-CG2 3.8Å; I35-V37 PolarHBondContact O-N 2.85Å; I35-I47 HydrophobicContact CB-CB 4.38Å; I35-I47 PolarHBondContact N-O 3.01Å; I35-I47 WeakPolarHBondContact O-CB 3.27Å; I35-I47 PolarHBondContact O-N 3.26Å; I35-L49 HydrophobicContact CD1-CD1 3.64Å; I35-L49 HydrophobicContact CG1-CD1 4.37Å
36	T	43.6	Very low	48.3	Very low	63 Å²	63	97.9 Å²	97.9	39%	0.387	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	114.4	170.5	-48.5	0	0	0	0	109.7	D44 V45 D46	T36-D44 HydrophobicContact CG2-CB 3.57Å; T36-V45 WeakPolarHBondContact CA-O 3.26Å; T36-D46 VanDerWaalsContact CB-OD1 3.28Å; T36-D46 WeakPolarHBondContact CB-OD1 3.32Å; T36-D46 VanDerWaalsContact CG2-OD1 3.24Å; T36-D46 WeakPolarHBondContact CG2-OD1 3.31Å; T36-D46 PolarHBondContact OG1-OD1 3.34Å
37	V	56.6	Low	49.1	Very low	55 Å²	55	94.3 Å²	94.3	33%	0.333	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.1	175.6	-174.2	0	0	0	0	108.5	I35 V45 I47	I35-V37 HydrophobicContact CG2-CG2 3.8Å; I35-V37 PolarHBondContact O-N 2.85Å; V37-V45 PolarHBondContact N-O 3.35Å; V37-V45 WeakPolarHBondContact O-CA 3.2Å; V37-V45 WeakPolarHBondContact O-CB 3.36Å; V37-V45 PolarHBondContact O-N 3.12Å; V37-I47 HydrophobicContact CB-CD1 4.4Å; V37-I47 HydrophobicContact CG2-CD1 3.72Å; V37-I47 HydrophobicContact CG2-CG1 4.34Å
38	K	53.3	Low	49.5	Very low	111 Å²	111	91 Å²	91	48%	0.483	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.3	173.4	-69.3	-168.9	174.1	-167.8	0	110.9	N43 D44	K38-N43 CarbonylContact C-O 3.56Å; K38-N43 VanDerWaalsContact CA-O 3.3Å; K38-N43 WeakPolarHBondContact CA-O 3.3Å; K38-D44 WeakPolarHBondContact CE-OD1 3.19Å; K38-D44 WeakPolarHBondContact CG-OD1 3.43Å
39	D	57.9	Low	49.9	Very low	60 Å²	60	85.8 Å²	85.8	32%	0.321	46%	0.463	S	S	.	.			trans	-69.7	175.9	171.9	76.4	4.7	0	0	0	111.9	K41 G42 N43 V45	D39-K41 PolarHBondContact O-N 2.82Å; D39-K41 VanDerWaalsContact OD1-C 3.27Å; D39-K41 VanDerWaalsContact OD1-CA 3.26Å; D39-K41 WeakPolarHBondContact OD1-CA 3.35Å; D39-K41 WeakPolarHBondContact OD1-CB 3.37Å; D39-K41 PolarHBondContact OD1-N 3Å; D39-G42 PolarHBondContact O-N 2.98Å; D39-G42 PolarHBondContact OD1-N 2.95Å; D39-N43 PolarHBondContact N-O 3.4Å; D39-N43 PolarHBondContact OD1-N 3.33Å; D39-N43 PolarHBondContact OD2-ND2 2.95Å; D39-V45 HydrophobicContact CB-CG2 3.92Å
40	E	54.6	Low	50.3	Low	196 Å²	196	83.9 Å²	83.9	92%	0.916	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.5	178.1	-66.1	-174.8	165.6	0	0	113.8
41	K	60.2	Low	50.7	Low	182 Å²	182	85.5 Å²	85.5	79%	0.791	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-1.3	177.2	-61.9	-178.4	-179.6	179	0	112.5	D39	D39-K41 PolarHBondContact O-N 2.82Å; D39-K41 VanDerWaalsContact OD1-C 3.27Å; D39-K41 VanDerWaalsContact OD1-CA 3.26Å; D39-K41 WeakPolarHBondContact OD1-CA 3.35Å; D39-K41 WeakPolarHBondContact OD1-CB 3.37Å; D39-K41 PolarHBondContact OD1-N 3Å
42	G	60.5	Low	50.7	Low	40 Å²	40	84.3 Å²	84.3	41%	0.412	43%	0.434	S	S	.	.	S	Bend	trans	82.3	10.7	-178.6	0	0	0	0	0	114.8	D39	D39-G42 PolarHBondContact O-N 2.98Å; D39-G42 PolarHBondContact OD1-N 2.95Å
43	N	57.8	Low	50.8	Low	91 Å²	91	91.2 Å²	91.2	49%	0.487	46%	0.461	S	S	.	.			trans	-78.7	140.7	174.7	-54	-49.8	0	0	0	110.2	K38 D39 V45	K38-N43 CarbonylContact C-O 3.56Å; K38-N43 VanDerWaalsContact CA-O 3.3Å; K38-N43 WeakPolarHBondContact CA-O 3.3Å; D39-N43 PolarHBondContact N-O 3.4Å; D39-N43 PolarHBondContact OD1-N 3.33Å; D39-N43 PolarHBondContact OD2-ND2 2.95Å; N43-V45 PolarHBondContact O-N 3.45Å
44	D	63.5	Low	50.8	Low	105 Å²	105	94.2 Å²	94.2	56%	0.561	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	122.8	173.4	-67.2	-27.3	0	0	0	109.8	T36 K38	T36-D44 HydrophobicContact CG2-CB 3.57Å; K38-D44 WeakPolarHBondContact CE-OD1 3.19Å; K38-D44 WeakPolarHBondContact CG-OD1 3.43Å
45	V	58.2	Low	51.2	Low	69 Å²	69	97 Å²	97	42%	0.418	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.6	173	-179.2	0	0	0	0	108.1	T36 V37 D39 N43 I47	T36-V45 WeakPolarHBondContact CA-O 3.26Å; V37-V45 PolarHBondContact N-O 3.35Å; V37-V45 WeakPolarHBondContact O-CA 3.2Å; V37-V45 WeakPolarHBondContact O-CB 3.36Å; V37-V45 PolarHBondContact O-N 3.12Å; D39-V45 HydrophobicContact CB-CG2 3.92Å; N43-V45 PolarHBondContact O-N 3.45Å; V45-I47 PolarHBondContact O-N 3.31Å
46	D	57.5	Low	51.4	Low	92 Å²	92	98.4 Å²	98.4	49%	0.492	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	111.4	177.6	-62.6	-40.7	0	0	0	110.7	E34 T36 R48	E34-D46 HydrophobicContact CG-CB 3.94Å; T36-D46 VanDerWaalsContact CB-OD1 3.28Å; T36-D46 WeakPolarHBondContact CB-OD1 3.32Å; T36-D46 VanDerWaalsContact CG2-OD1 3.24Å; T36-D46 WeakPolarHBondContact CG2-OD1 3.31Å; T36-D46 PolarHBondContact OG1-OD1 3.34Å; D46-R48 PolarHBondContact O-N 3.48Å
47	I	49.1	Very low	52.6	Low	81 Å²	81	97.7 Å²	97.7	42%	0.415	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	96.4	173.1	-55	179.3	0	0	0	108	C33 E34 I35 V37 V45 L49	C33-I47 VanDerWaalsContact O-O 3.05Å; E34-I47 WeakPolarHBondContact CA-O 3.35Å; I35-I47 HydrophobicContact CB-CB 4.38Å; I35-I47 PolarHBondContact N-O 3.01Å; I35-I47 WeakPolarHBondContact O-CB 3.27Å; I35-I47 PolarHBondContact O-N 3.26Å; V37-I47 HydrophobicContact CB-CD1 4.4Å; V37-I47 HydrophobicContact CG2-CD1 3.72Å; V37-I47 HydrophobicContact CG2-CG1 4.34Å; V45-I47 PolarHBondContact O-N 3.31Å; I47-L49 HydrophobicContact CG2-CG 4.28Å; I47-L49 PolarHBondContact O-N 3.37Å
48	R	42	Very low	53.5	Low	128 Å²	128	97 Å²	97	48%	0.483	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	97.2	175.6	-167.3	174.9	171.2	148	6.1	111.3	E31 A32 D46 D50	E31-R48 IonicContact OE2-CZ 3.66Å; E31-R48 IonicContact OE2-NH1 3.97Å; E31-R48 IonicContact OE2-NH2 3.71Å; E31-R48 PolarHBondContact OE2-NH2 3.12Å; A32-R48 HydrophobicContact CB-CB 4.29Å; A32-R48 HydrophobicContact CB-CG 3.09Å; D46-R48 PolarHBondContact O-N 3.48Å; R48-D50 IonicContact NE-OD1 2.91Å; R48-D50 PolarHBondContact O-N 2.77Å
49	L	43.3	Very low	55.1	Low	60 Å²	60	93.3 Å²	93.3	31%	0.314	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	92.4	173.2	-73.5	162.6	0	0	0	110.7	A32 C33 I35 I47 L51	A32-L49 CarbonylContact C-O 3.6Å; A32-L49 WeakPolarHBondContact CA-O 2.9Å; C33-L49 HydrophobicContact CB-CB 4.19Å; C33-L49 PolarHBondContact N-O 3.08Å; C33-L49 WeakPolarHBondContact O-CB 3.4Å; C33-L49 PolarHBondContact O-N 3.19Å; I35-L49 HydrophobicContact CD1-CD1 3.64Å; I35-L49 HydrophobicContact CG1-CD1 4.37Å; I47-L49 HydrophobicContact CG2-CG 4.28Å; I47-L49 PolarHBondContact O-N 3.37Å; L49-L51 PolarHBondContact O-N 3.29Å
50	D	41.2	Very low	56.8	Low	41 Å²	41	91.9 Å²	91.9	22%	0.219	48%	0.48	C	S	.	.			trans	-66.5	79.8	166.1	-85.5	-19.8	0	0	0	110.1	A32 R48 E52 K53 Q54	A32-D50 WeakPolarHBondContact CB-OD1 3.26Å; R48-D50 IonicContact NE-OD1 2.91Å; R48-D50 PolarHBondContact O-N 2.77Å; D50-E52 PolarHBondContact O-N 2.84Å; D50-K53 HydrophobicContact CB-CB 4.12Å; D50-K53 HydrophobicContact CB-CD 4.31Å; D50-K53 HydrophobicContact CB-CG 4.3Å; D50-K53 PolarHBondContact O-N 3.24Å; D50-K53 WeakPolarHBondContact OD2-CD 3.39Å; D50-K53 WeakPolarHBondContact OD2-CE 3.35Å; D50-K53 IonicContact OD2-NZ 3.58Å; D50-K53 PolarHBondContact OD2-NZ 3.12Å; D50-Q54 PolarHBondContact O-N 2.86Å
51	L	47.7	Very low	58.3	Low	94 Å²	94	87.1 Å²	87.1	49%	0.492	46%	0.461	S	S	.	.	H	α-helix	trans	-56.5	-32.5	175.9	-74.5	164.6	0	0	0	111.7	C33 L49 Q54 Q55	C33-L51 HydrophobicContact CB-CD1 4.28Å; L49-L51 PolarHBondContact O-N 3.29Å; L51-Q54 PolarHBondContact O-N 2.9Å; L51-Q55 PolarHBondContact O-N 3.07Å
52	E	41.7	Very low	59.6	Low	105 Å²	105	79.9 Å²	79.9	49%	0.491	44%	0.438	S	S	.	.	H	α-helix	trans	-67.4	-43.4	179.6	-64.1	-169.6	162.8	0	0	112.8	D50 Q54 Q55 A56 K598	D50-E52 PolarHBondContact O-N 2.84Å; E52-Q54 VanDerWaalsContact C-N 3.31Å; E52-Q54 PolarHBondContact O-N 3.15Å; E52-Q55 PolarHBondContact O-N 3.41Å; E52-A56 WeakPolarHBondContact O-CB 3.47Å; E52-A56 PolarHBondContact O-N 3.22Å; E52-K598 IonicContact OE1-NZ 3.13Å; E52-K598 PolarHBondContact OE1-NZ 3.28Å
53	K	40.8	Very low	61.1	Low	166 Å²	166	83 Å²	83	72%	0.722	44%	0.441	S	S	*	.	H	α-helix	trans	-71.2	-26	178.6	-72	-177	-171	141	0	112.9	D50	D50-K53 HydrophobicContact CB-CB 4.12Å; D50-K53 HydrophobicContact CB-CD 4.31Å; D50-K53 HydrophobicContact CB-CG 4.3Å; D50-K53 PolarHBondContact O-N 3.24Å; D50-K53 WeakPolarHBondContact OD2-CD 3.39Å; D50-K53 WeakPolarHBondContact OD2-CE 3.35Å; D50-K53 IonicContact OD2-NZ 3.58Å; D50-K53 PolarHBondContact OD2-NZ 3.12Å
54	Q	44.4	Very low	62.8	Low	106 Å²	106	82.7 Å²	82.7	50%	0.495	44%	0.438	S	S	.	.	H	α-helix	trans	-79.7	-25.8	177.5	-68.5	-170.2	-6.2	0	0	113.1	D50 L51 E52	D50-Q54 PolarHBondContact O-N 2.86Å; L51-Q54 PolarHBondContact O-N 2.9Å; E52-Q54 VanDerWaalsContact C-N 3.31Å; E52-Q54 PolarHBondContact O-N 3.15Å
55	Q	48.6	Very low	64.3	Low	143 Å²	143	78.3 Å²	78.3	67%	0.668	42%	0.415	S	S	*	.	H	α-helix	trans	-97.4	-26.8	-178.9	-76.6	-176.1	-21.9	0	0	114.6	L51 E52 R57 R428	L51-Q55 PolarHBondContact O-N 3.07Å; E52-Q55 PolarHBondContact O-N 3.41Å; Q55-R57 PolarHBondContact O-N 3.23Å; Q55-R428 PolarHBondContact O-NH1 3.39Å
56	A	56.5	Low	66.1	Low	78 Å²	78	75.1 Å²	75.1	65%	0.645	40%	0.395	S	S	*	.			trans	-63	101.9	-176.6	0	0	0	0	0	111.7	E52 G58	E52-A56 WeakPolarHBondContact O-CB 3.47Å; E52-A56 PolarHBondContact O-N 3.22Å; A56-G58 PolarHBondContact O-N 2.97Å
57	R	69.6	Low	68	Low	48 Å²	48	72.2 Å²	72.2	18%	0.181	38%	0.381	C	S	.	.			trans	-65	125	166.8	-168.4	173.7	-171.1	-172	-6.8	107.6	Q55 S122 L123 S323 Y324	Q55-R57 PolarHBondContact O-N 3.23Å; R57-S122 VanDerWaalsContact CD-O 3.24Å; R57-S122 WeakPolarHBondContact CD-O 3.36Å; R57-S122 PolarHBondContact NH1-O 3.45Å; R57-L123 PolarHBondContact NH1-O 3.23Å; R57-S323 PolarHBondContact NH1-OG 2.83Å; R57-S323 PolarHBondContact NH2-OG 3.47Å; R57-Y324 HydrophobicContact CG-CD1 3.87Å; R57-Y324 HydrophobicContact CG-CE1 3.55Å; R57-Y324 VanDerWaalsContact NH2-CZ 3.31Å; R57-Y324 PolarHBondContact NH2-OH 2.7Å
58	G	75.2	Confident	70.3	Confident	42 Å²	42	69.7 Å²	69.7	43%	0.433	37%	0.367	S	S	.	.			trans	-62.2	141.3	177.4	0	0	0	0	0	110.9	A56 Y324	A56-G58 PolarHBondContact O-N 2.97Å; G58-Y324 WeakPolarHBondContact O-CD1 3.38Å; G58-Y324 WeakPolarHBondContact O-CE1 3.36Å
59	G	87.3	Confident	72.9	Confident	33 Å²	33	63.6 Å²	63.6	34%	0.34	34%	0.344	S	S	.	.			trans	-104.2	-175.3	179.1	0	0	0	0	0	113.8	Y324	G59-Y324 WeakPolarHBondContact CA-O 3.48Å
60	W	92.4	Very high	75.5	Confident	30 Å²	30	60.8 Å²	60.8	11%	0.114	33%	0.329	C	S	.	.			trans	-65.8	143	170.3	-55.3	107.3	0	0	0	111.4	G62 E65 F66 T69 V248 M321 Y324 N325	W60-G62 PolarHBondContact O-N 2.76Å; W60-E65 HydrophobicContact CE3-CB 4.12Å; W60-F66 HydrophobicContact CD2-CB 3.95Å; W60-F66 AromaticContact CE2-CD2 3.79Å; W60-F66 HydrophobicContact CG-CB 3.83Å; W60-F66 HydrophobicContact CZ2-CD2 4.08Å; W60-F66 AromaticContact NE1-CD2 3.39Å; W60-F66 AromaticContact NE1-CG 3.89Å; W60-T69 HydrophobicContact CH2-CG2 3.8Å; W60-T69 HydrophobicContact CZ3-CG2 4.36Å; W60-V248 HydrophobicContact CD2-CB 4.42Å; W60-V248 HydrophobicContact CE3-CB 3.9Å; W60-V248 HydrophobicContact CE3-CG1 4.48Å; W60-V248 HydrophobicContact CH2-CB 3.91Å; W60-V248 HydrophobicContact CH2-CG1 3.63Å; W60-V248 HydrophobicContact CZ2-CB 4.44Å; W60-V248 HydrophobicContact CZ2-CG1 4.01Å; W60-V248 HydrophobicContact CZ3-CB 3.63Å; W60-V248 HydrophobicContact CZ3-CG1 3.91Å; W60-M321 HydrophobicContact CH2-SD 3.97Å; W60-M321 HydrophobicContact CZ2-CB 4.46Å; W60-M321 HydrophobicContact CZ2-SD 4.04Å; W60-M321 PolarHBondContact NE1-O 3.29Å; W60-Y324 HydrophobicContact CZ2-CD2 4.38Å; W60-N325 PolarHBondContact NE1-OD1 3.03Å; W60-N325 VanDerWaalsContact NE1-OD1 3.15Å
61	N	86.1	Confident	78.1	Confident	95 Å²	95	59.6 Å²	59.6	51%	0.508	32%	0.323	S	S	.	.	S	Bend	trans	-72.8	-24.2	174.8	-54.1	-54.8	0	0	0	111.5	E65	N61-E65 VanDerWaalsContact CB-OE2 3.28Å; N61-E65 WeakPolarHBondContact CB-OE2 3.21Å; N61-E65 PolarHBondContact N-OE2 3.04Å; N61-E65 PolarHBondContact ND2-OE1 3.35Å; N61-E65 VanDerWaalsContact ND2-OE1 3.14Å; N61-E65 PolarHBondContact ND2-OE2 2.77Å
62	G	88.2	Confident	80.3	Confident	30 Å²	30	55.3 Å²	55.3	31%	0.309	30%	0.301	S	S	.	.	S	Bend	trans	-157.4	158.7	177.1	0	0	0	0	0	112.3	W60 L64 E65	W60-G62 PolarHBondContact O-N 2.76Å; G62-L64 PolarHBondContact O-N 3.03Å; G62-E65 WeakPolarHBondContact O-CB 3.45Å; G62-E65 PolarHBondContact O-N 3.24Å
63	K	91.7	Very high	82.9	Confident	107 Å²	107	50.9 Å²	50.9	47%	0.465	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-31.7	180	-172.7	177.3	-178.7	-173.1	0	112.9	E65 F66 V67	K63-E65 VanDerWaalsContact C-N 3.35Å; K63-F66 WeakPolarHBondContact O-CB 3.33Å; K63-F66 PolarHBondContact O-N 3.34Å; K63-V67 HydrophobicContact CG-CG2 4.46Å; K63-V67 WeakPolarHBondContact O-CG2 3.34Å; K63-V67 PolarHBondContact O-N 3.45Å
64	L	94.2	Very high	85.5	Confident	84 Å²	84	43.1 Å²	43.1	44%	0.44	25%	0.247	S	C	.	.	H	α-helix	trans	-70.3	-31.8	-179.5	-169.6	56.6	0	0	0	112.2	G62 V67 M68 Y256	G62-L64 PolarHBondContact O-N 3.03Å; L64-V67 HydrophobicContact CD1-CB 4.49Å; L64-V67 HydrophobicContact CD1-CG1 4.46Å; L64-V67 PolarHBondContact O-N 2.91Å; L64-M68 HydrophobicContact CD1-CE 3.49Å; L64-M68 VanDerWaalsContact CD1-CE 3.49Å; L64-M68 HydrophobicContact CD1-CG 4.14Å; L64-M68 HydrophobicContact CG-CE 4.34Å; L64-M68 HydrophobicContact CG-CG 4.28Å; L64-M68 WeakPolarHBondContact O-CB 3.48Å; L64-M68 WeakPolarHBondContact O-CG 3.49Å; L64-M68 PolarHBondContact O-N 3.1Å; L64-Y256 HydrophobicContact CB-CE1 4.27Å; L64-Y256 HydrophobicContact CD2-CD1 4.49Å; L64-Y256 HydrophobicContact CD2-CE1 3.48Å; L64-Y256 VanDerWaalsContact CD2-CE1 3.48Å; L64-Y256 HydrophobicContact CG-CD1 4.49Å; L64-Y256 HydrophobicContact CG-CE1 3.55Å
65	E	95.5	Very high	87.9	Confident	13 Å²	13	38.3 Å²	38.3	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-44.4	172.3	-71.5	-176.9	164.6	0	0	111.2	W60 N61 G62 K63 T69 Y256	W60-E65 HydrophobicContact CE3-CB 4.12Å; N61-E65 VanDerWaalsContact CB-OE2 3.28Å; N61-E65 WeakPolarHBondContact CB-OE2 3.21Å; N61-E65 PolarHBondContact N-OE2 3.04Å; N61-E65 PolarHBondContact ND2-OE1 3.35Å; N61-E65 VanDerWaalsContact ND2-OE1 3.14Å; N61-E65 PolarHBondContact ND2-OE2 2.77Å; G62-E65 WeakPolarHBondContact O-CB 3.45Å; G62-E65 PolarHBondContact O-N 3.24Å; K63-E65 VanDerWaalsContact C-N 3.35Å; E65-T69 VanDerWaalsContact O-CB 3.32Å; E65-T69 WeakPolarHBondContact O-CB 3.39Å; E65-T69 PolarHBondContact O-N 3.45Å; E65-T69 PolarHBondContact O-OG1 3.41Å; E65-Y256 HydrophobicContact CG-CE2 3.64Å
66	F	96	Very high	90.1	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-50	174.2	167.8	-113.3	0	0	0	111.8	W60 K63 M68 T69 C70 F115 M321 N325 D334 F338	W60-F66 HydrophobicContact CD2-CB 3.95Å; W60-F66 AromaticContact CE2-CD2 3.79Å; W60-F66 HydrophobicContact CG-CB 3.83Å; W60-F66 HydrophobicContact CZ2-CD2 4.08Å; W60-F66 AromaticContact NE1-CD2 3.39Å; W60-F66 AromaticContact NE1-CG 3.89Å; K63-F66 WeakPolarHBondContact O-CB 3.33Å; K63-F66 PolarHBondContact O-N 3.34Å; F66-M68 PolarHBondContact O-N 3.11Å; F66-T69 PolarHBondContact O-N 2.87Å; F66-C70 WeakPolarHBondContact CE2-SG 3.42Å; F66-C70 PolarHBondContact O-N 2.92Å; F66-C70 PolarHBondContact O-SG 3.12Å; F66-C70 VanDerWaalsContact O-SG 3.37Å; F66-F115 HydrophobicContact CE1-CE2 4.44Å; F66-F115 HydrophobicContact CE2-CE2 4.44Å; F66-F115 HydrophobicContact CE2-CZ 4.17Å; F66-F115 HydrophobicContact CZ-CD2 4.49Å; F66-F115 AromaticContact CZ-CE2 3.59Å; F66-F115 HydrophobicContact CZ-CE2 3.59Å; F66-F115 AromaticContact CZ-CZ 3.74Å; F66-F115 HydrophobicContact CZ-CZ 3.74Å; F66-M321 HydrophobicContact CE2-CB 4.41Å; F66-N325 WeakPolarHBondContact CD2-OD1 3.41Å; F66-N325 WeakPolarHBondContact CE1-ND2 3.46Å; F66-N325 VanDerWaalsContact CE2-ND2 3.34Å; F66-N325 WeakPolarHBondContact CE2-ND2 3.38Å; F66-N325 WeakPolarHBondContact CE2-OD1 3.41Å; F66-N325 VanDerWaalsContact CG-OD1 3.23Å; F66-N325 WeakPolarHBondContact CG-OD1 3.5Å; F66-N325 WeakPolarHBondContact CZ-ND2 3.37Å; F66-D334 HydrophobicContact CE1-CB 4.22Å; F66-D334 WeakPolarHBondContact CE1-OD2 3.41Å; F66-F338 AromaticContact CE1-CE2 3.83Å; F66-F338 HydrophobicContact CE1-CE2 3.83Å; F66-F338 HydrophobicContact CE1-CZ 4.09Å; F66-F338 AromaticContact CZ-CE2 3.95Å; F66-F338 HydrophobicContact CZ-CE2 3.95Å
67	V	96.7	Very high	91.9	Very high	31 Å²	31	28 Å²	28	19%	0.188	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-49.7	179.9	165	0	0	0	0	111.2	K63 L64 T69 C70 I71 F338	K63-V67 HydrophobicContact CG-CG2 4.46Å; K63-V67 WeakPolarHBondContact O-CG2 3.34Å; K63-V67 PolarHBondContact O-N 3.45Å; L64-V67 HydrophobicContact CD1-CB 4.49Å; L64-V67 HydrophobicContact CD1-CG1 4.46Å; L64-V67 PolarHBondContact O-N 2.91Å; V67-T69 VanDerWaalsContact C-N 3.32Å; V67-T69 PolarHBondContact O-N 3.34Å; V67-C70 PolarHBondContact O-N 2.8Å; V67-I71 HydrophobicContact CG1-CD1 3.9Å; V67-I71 WeakPolarHBondContact O-CG1 3.37Å; V67-I71 PolarHBondContact O-N 3.45Å; V67-F338 HydrophobicContact CB-CE1 4.28Å; V67-F338 HydrophobicContact CB-CZ 4.19Å; V67-F338 HydrophobicContact CG1-CE1 3.95Å; V67-F338 HydrophobicContact CG1-CZ 4.36Å; V67-F338 HydrophobicContact CG2-CE1 4.23Å; V67-F338 HydrophobicContact CG2-CZ 3.92Å
68	M	96.6	Very high	92.9	Very high	27 Å²	27	25.8 Å²	25.8	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-36.1	-179.3	-68.1	-61.8	158.6	0	0	112	L64 F66 I71 G72 Y256 I260	L64-M68 HydrophobicContact CD1-CE 3.49Å; L64-M68 VanDerWaalsContact CD1-CE 3.49Å; L64-M68 HydrophobicContact CD1-CG 4.14Å; L64-M68 HydrophobicContact CG-CE 4.34Å; L64-M68 HydrophobicContact CG-CG 4.28Å; L64-M68 WeakPolarHBondContact O-CB 3.48Å; L64-M68 WeakPolarHBondContact O-CG 3.49Å; L64-M68 PolarHBondContact O-N 3.1Å; F66-M68 PolarHBondContact O-N 3.11Å; M68-I71 PolarHBondContact O-N 2.82Å; M68-G72 PolarHBondContact O-N 3.36Å; M68-Y256 HydrophobicContact CG-CD1 4.28Å; M68-I260 HydrophobicContact CE-CD1 4.11Å; M68-I260 HydrophobicContact CE-CG1 4.08Å; M68-I260 HydrophobicContact SD-CD1 4.18Å; M68-I260 HydrophobicContact SD-CG1 3.75Å
69	T	97.3	Very high	93.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.6	-40.8	176.1	-54.8	0	0	0	0	111.6	W60 E65 F66 V67 G72 Y73 L251 S255 M321 S414	W60-T69 HydrophobicContact CH2-CG2 3.8Å; W60-T69 HydrophobicContact CZ3-CG2 4.36Å; E65-T69 VanDerWaalsContact O-CB 3.32Å; E65-T69 WeakPolarHBondContact O-CB 3.39Å; E65-T69 PolarHBondContact O-N 3.45Å; E65-T69 PolarHBondContact O-OG1 3.41Å; F66-T69 PolarHBondContact O-N 2.87Å; V67-T69 VanDerWaalsContact C-N 3.32Å; V67-T69 PolarHBondContact O-N 3.34Å; T69-G72 PolarHBondContact O-N 3.47Å; T69-Y73 VanDerWaalsContact O-CB 3.3Å; T69-Y73 WeakPolarHBondContact O-CB 3.17Å; T69-Y73 PolarHBondContact O-N 3.06Å; T69-L251 HydrophobicContact CG2-CD1 4.23Å; T69-L251 HydrophobicContact CG2-CD2 3.86Å; T69-L251 HydrophobicContact CG2-CG 3.86Å; T69-S255 WeakPolarHBondContact CA-OG 3.47Å; T69-S255 WeakPolarHBondContact CB-OG 3.32Å; T69-S255 VanDerWaalsContact OG1-CB 3.27Å; T69-S255 WeakPolarHBondContact OG1-CB 3.34Å; T69-S255 PolarHBondContact OG1-OG 2.7Å; T69-M321 HydrophobicContact CG2-SD 3.85Å; T69-S414 WeakPolarHBondContact CG2-OG 3.42Å
70	C	97.1	Very high	94	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.007	12%	0.121	C	C	.	.	H	α-helix	trans	-67.3	-38.2	176.1	-71.2	0	0	0	0	112.6	F66 V67 Y73 A74 F338	F66-C70 WeakPolarHBondContact CE2-SG 3.42Å; F66-C70 PolarHBondContact O-N 2.92Å; F66-C70 PolarHBondContact O-SG 3.12Å; F66-C70 VanDerWaalsContact O-SG 3.37Å; V67-C70 PolarHBondContact O-N 2.8Å; C70-Y73 PolarHBondContact O-N 3.3Å; C70-A74 WeakPolarHBondContact O-CB 3.32Å; C70-A74 PolarHBondContact O-N 2.65Å; C70-F338 HydrophobicContact CB-CD1 4.43Å; C70-F338 HydrophobicContact CB-CD2 3.45Å; C70-F338 VanDerWaalsContact CB-CD2 3.45Å; C70-F338 HydrophobicContact CB-CE1 4.36Å; C70-F338 HydrophobicContact CB-CE2 3.31Å; C70-F338 HydrophobicContact CB-CG 4.04Å; C70-F338 HydrophobicContact CB-CZ 3.83Å
71	I	95.9	Very high	93.7	Very high	17 Å²	17	22.3 Å²	22.3	9%	0.087	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-48.9	172.5	-69	170.1	0	0	0	110	V67 M68 Y73 A74 V75 Y263 F338 I341	V67-I71 HydrophobicContact CG1-CD1 3.9Å; V67-I71 WeakPolarHBondContact O-CG1 3.37Å; V67-I71 PolarHBondContact O-N 3.45Å; M68-I71 PolarHBondContact O-N 2.82Å; I71-Y73 PolarHBondContact O-N 2.61Å; I71-A74 PolarHBondContact O-N 2.91Å; I71-V75 HydrophobicContact CG2-CG2 4.21Å; I71-V75 VanDerWaalsContact O-CB 3.25Å; I71-V75 WeakPolarHBondContact O-CB 3.49Å; I71-V75 WeakPolarHBondContact O-CG2 3.49Å; I71-V75 PolarHBondContact O-N 3Å; I71-Y263 HydrophobicContact CG2-CE2 3.97Å; I71-F338 HydrophobicContact CG1-CD1 4.16Å; I71-F338 HydrophobicContact CG1-CE1 4.39Å; I71-I341 HydrophobicContact CD1-CD1 4.04Å; I71-I341 HydrophobicContact CG1-CD1 4.31Å; I71-I341 HydrophobicContact CG1-CG2 4.41Å; I71-I341 HydrophobicContact CG2-CG2 4.46Å
72	G	95.3	Very high	93.9	Very high	3 Å²	3	20.1 Å²	20.1	3%	0.031	11%	0.105	C	C	.	.	H	α-helix	trans	-63.2	-29.1	176.7	0	0	0	0	0	113.7	M68 T69 G410 S411	M68-G72 PolarHBondContact O-N 3.36Å; T69-G72 PolarHBondContact O-N 3.47Å; G72-G410 CarbonylContact O-C 3.49Å; G72-S411 VanDerWaalsContact O-CA 3.27Å; G72-S411 WeakPolarHBondContact O-CA 3.18Å; G72-S411 PolarHBondContact O-N 3.34Å; G72-S411 PolarHBondContact O-OG 2.83Å; G72-S411 VanDerWaalsContact O-OG 3.07Å
73	Y	96.2	Very high	94.2	Very high	12 Å²	12	18.7 Å²	18.7	5%	0.047	9%	0.09	C	C	.	.	H	α-helix	trans	-71.3	-49.4	175.3	178.9	-123.8	0	0	0	112.6	T69 C70 I71 G312 N315 L318 S411 I415	T69-Y73 VanDerWaalsContact O-CB 3.3Å; T69-Y73 WeakPolarHBondContact O-CB 3.17Å; T69-Y73 PolarHBondContact O-N 3.06Å; C70-Y73 PolarHBondContact O-N 3.3Å; I71-Y73 PolarHBondContact O-N 2.61Å; Y73-G312 WeakPolarHBondContact OH-CA 3.38Å; Y73-G312 PolarHBondContact OH-O 3.43Å; Y73-N315 VanDerWaalsContact OH-CG 3.31Å; Y73-N315 PolarHBondContact OH-ND2 2.97Å; Y73-N315 PolarHBondContact OH-OD1 3.38Å; Y73-L318 HydrophobicContact CD1-CD2 3.85Å; Y73-L318 HydrophobicContact CE1-CD2 3.55Å; Y73-L318 HydrophobicContact CE1-CG 4.04Å; Y73-S411 PolarHBondContact O-OG 3.29Å; Y73-I415 HydrophobicContact CD2-CG1 4.28Å; Y73-I415 HydrophobicContact CE2-CG1 3.71Å
74	A	94.2	Very high	94.3	Very high	3 Å²	3	13.6 Å²	13.6	3%	0.025	7%	0.068	C	C	.	.	H	α-helix	trans	-78.1	-39.2	-177	0	0	0	0	0	112.4	C70 I71 G76 N79 S310 N342	C70-A74 WeakPolarHBondContact O-CB 3.32Å; C70-A74 PolarHBondContact O-N 2.65Å; I71-A74 PolarHBondContact O-N 2.91Å; A74-G76 PolarHBondContact O-N 3.45Å; A74-N79 PolarHBondContact O-OD1 3.4Å; A74-S310 CarbonylContact C-O 3.56Å; A74-S310 WeakPolarHBondContact CA-O 3.44Å; A74-N342 HydrophobicContact CB-CB 4.13Å; A74-N342 PolarHBondContact O-OD1 3.41Å
75	V	95.3	Very high	94.1	Very high	5 Å²	5	12.7 Å²	12.7	3%	0.03	6%	0.059	C	C	.	.	S	Bend	trans	-89.3	99.2	179.9	-174.6	0	0	0	0	109.2	I71 N79 I341 T345 L407	I71-V75 HydrophobicContact CG2-CG2 4.21Å; I71-V75 VanDerWaalsContact O-CB 3.25Å; I71-V75 WeakPolarHBondContact O-CB 3.49Å; I71-V75 WeakPolarHBondContact O-CG2 3.49Å; I71-V75 PolarHBondContact O-N 3Å; V75-N79 WeakPolarHBondContact CA-OD1 3.32Å; V75-I341 HydrophobicContact CG2-CG2 4.32Å; V75-T345 HydrophobicContact CG1-CG2 3.55Å; V75-L407 HydrophobicContact CG1-CD2 3.78Å; V75-L407 WeakPolarHBondContact O-CD2 3.17Å
76	G	94.4	Very high	93.9	Very high	4 Å²	4	12.5 Å²	12.5	4%	0.041	6%	0.059	C	C	.	.	S	Bend	trans	-126.4	-168.5	-179.2	0	0	0	0	0	113.3	A74 G78 N79 S411	A74-G76 PolarHBondContact O-N 3.45Å; G76-G78 PolarHBondContact O-N 2.93Å; G76-N79 PolarHBondContact N-OD1 2.72Å; G76-N79 WeakPolarHBondContact O-CB 3.44Å; G76-N79 PolarHBondContact O-N 3.47Å; G76-N79 VanDerWaalsContact O-N 3.14Å; G76-N79 PolarHBondContact O-OD1 2.65Å; G76-N79 VanDerWaalsContact O-OD1 3.09Å; G76-S411 VanDerWaalsContact CA-OG 3.26Å; G76-S411 WeakPolarHBondContact CA-OG 3.33Å
77	L	93.6	Very high	93.8	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-51.2	-42.4	177.9	-64.4	174	0	0	0	111.9	N79 V80 W81 Y153 V156 V157 M404	L77-N79 PolarHBondContact O-N 2.94Å; L77-N79 VanDerWaalsContact O-N 3.12Å; L77-V80 PolarHBondContact O-N 3.32Å; L77-W81 PolarHBondContact O-N 2.94Å; L77-W81 PolarHBondContact O-NE1 2.81Å; L77-Y153 HydrophobicContact CD1-CE1 4.21Å; L77-Y153 HydrophobicContact CD1-CE2 4.38Å; L77-Y153 WeakPolarHBondContact CG-OH 3.48Å; L77-Y153 PolarHBondContact N-OH 3.03Å; L77-V156 HydrophobicContact CD1-CB 4.04Å; L77-V156 HydrophobicContact CD1-CG1 3.6Å; L77-V157 HydrophobicContact CD1-CG2 4.41Å; L77-M404 HydrophobicContact CD2-CB 4.04Å; L77-M404 HydrophobicContact CD2-CE 3.58Å; L77-M404 WeakPolarHBondContact CD2-O 3.4Å; L77-M404 HydrophobicContact CD2-SD 3.85Å
78	G	91	Very high	93.6	Very high	2 Å²	2	12.5 Å²	12.5	2%	0.021	6%	0.057	C	C	.	.	H	α-helix	trans	-52.5	-32.5	-179.3	0	0	0	0	0	115	G76 V80 R82 F83 Q306	G76-G78 PolarHBondContact O-N 2.93Å; G78-V80 VanDerWaalsContact C-N 3.34Å; G78-R82 WeakPolarHBondContact O-CB 3.41Å; G78-R82 PolarHBondContact O-N 3.42Å; G78-F83 PolarHBondContact O-N 2.64Å; G78-Q306 PolarHBondContact O-NE2 3.08Å
79	N	94.6	Very high	93.3	Very high	1 Å²	1	15 Å²	15	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-69.1	-32.8	177.1	-57.1	86.8	0	0	0	112.4	A74 V75 G76 L77 S310 N342 S346	A74-N79 PolarHBondContact O-OD1 3.4Å; V75-N79 WeakPolarHBondContact CA-OD1 3.32Å; G76-N79 PolarHBondContact N-OD1 2.72Å; G76-N79 WeakPolarHBondContact O-CB 3.44Å; G76-N79 PolarHBondContact O-N 3.47Å; G76-N79 VanDerWaalsContact O-N 3.14Å; G76-N79 PolarHBondContact O-OD1 2.65Å; G76-N79 VanDerWaalsContact O-OD1 3.09Å; L77-N79 PolarHBondContact O-N 2.94Å; L77-N79 VanDerWaalsContact O-N 3.12Å; N79-S310 PolarHBondContact ND2-OG 2.97Å; N79-N342 PolarHBondContact ND2-O 2.89Å; N79-N342 PolarHBondContact ND2-OD1 3.41Å; N79-S346 PolarHBondContact ND2-OG 3.17Å
80	V	92.3	Very high	93.1	Very high	1 Å²	1	15 Å²	15	1%	0.006	7%	0.067	C	C	.	.	H	α-helix	trans	-87.3	-38.1	-173	-178.5	0	0	0	0	112.4	L77 G78 P84 L266 A349 I353 F400 M403 M404 L407	L77-V80 PolarHBondContact O-N 3.32Å; G78-V80 VanDerWaalsContact C-N 3.34Å; V80-P84 WeakPolarHBondContact O-CG 3.48Å; V80-L266 HydrophobicContact CG2-CD2 4.5Å; V80-A349 HydrophobicContact CG2-CB 4.24Å; V80-I353 HydrophobicContact CG1-CD1 4Å; V80-I353 WeakPolarHBondContact O-CG1 3.4Å; V80-F400 HydrophobicContact CG1-CE2 4.4Å; V80-M403 HydrophobicContact CG1-CE 4.23Å; V80-M404 HydrophobicContact CB-SD 3.92Å; V80-M404 HydrophobicContact CG1-SD 3.72Å; V80-M404 HydrophobicContact CG2-SD 4.32Å; V80-L407 HydrophobicContact CG2-CD1 3.5Å; V80-L407 VanDerWaalsContact CG2-CD1 3.5Å
81	W	85.5	Confident	92.9	Very high	29 Å²	29	15.5 Å²	15.5	11%	0.11	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-44.7	-175.1	68.4	-19.6	0	0	0	115.1	L77 Y85 V156 P376 L378 A379 F380	L77-W81 PolarHBondContact O-N 2.94Å; L77-W81 PolarHBondContact O-NE1 2.81Å; W81-Y85 VanDerWaalsContact O-CB 3.3Å; W81-Y85 WeakPolarHBondContact O-CB 3.49Å; W81-Y85 PolarHBondContact O-N 3.41Å; W81-Y85 VanDerWaalsContact O-N 3.13Å; W81-V156 HydrophobicContact CH2-CG1 3.37Å; W81-V156 HydrophobicContact CH2-CG2 4.32Å; W81-V156 HydrophobicContact CZ2-CG1 3.67Å; W81-V156 HydrophobicContact CZ2-CG2 4.5Å; W81-V156 HydrophobicContact CZ3-CG1 4.33Å; W81-P376 HydrophobicContact CH2-CB 4.17Å; W81-P376 HydrophobicContact CZ3-CB 3.88Å; W81-P376 WeakPolarHBondContact CZ3-O 3.29Å; W81-L378 VanDerWaalsContact O-CD2 3.29Å; W81-L378 WeakPolarHBondContact O-CD2 3.23Å; W81-A379 HydrophobicContact CB-CB 4.08Å; W81-A379 HydrophobicContact CD2-CB 3.91Å; W81-A379 HydrophobicContact CE3-CB 3.15Å; W81-A379 HydrophobicContact CG-CB 4.33Å; W81-A379 HydrophobicContact CZ3-CB 3.79Å; W81-F380 HydrophobicContact CE3-CE2 4.35Å; W81-F380 AromaticContact CH2-CE2 3.83Å; W81-F380 HydrophobicContact CH2-CE2 3.83Å; W81-F380 AromaticContact CZ3-CD2 3.74Å; W81-F380 HydrophobicContact CZ3-CD2 3.74Å; W81-F380 AromaticContact CZ3-CE2 3.43Å; W81-F380 HydrophobicContact CZ3-CE2 3.43Å; W81-F380 VanDerWaalsContact CZ3-CE2 3.43Å
82	R	90.8	Very high	92.7	Very high	49 Å²	49	15 Å²	15	19%	0.185	7%	0.071	C	C	.	.	H	α-helix	trans	-76	-45	-171.8	-175.5	-178.8	176.5	162.9	3.5	109.9	G78 Y85 L86 Q306 S474	G78-R82 WeakPolarHBondContact O-CB 3.41Å; G78-R82 PolarHBondContact O-N 3.42Å; R82-Y85 WeakPolarHBondContact O-CB 3.37Å; R82-Y85 PolarHBondContact O-N 3.45Å; R82-L86 HydrophobicContact CG-CD1 4.25Å; R82-L86 HydrophobicContact CG-CG 4.47Å; R82-L86 VanDerWaalsContact O-CG 3.3Å; R82-L86 WeakPolarHBondContact O-CG 3.31Å; R82-L86 PolarHBondContact O-N 3.44Å; R82-Q306 VanDerWaalsContact CD-OE1 3.24Å; R82-S474 PolarHBondContact NH1-OG 2.97Å; R82-S474 VanDerWaalsContact NH1-OG 3.07Å; R82-S474 PolarHBondContact NH2-OG 3.41Å
83	F	94.4	Very high	92.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60	-50.7	176.9	172.5	-92.2	0	0	0	112.6	G78 Y85 L86 C87 F95 L96 Y99 Y286 Q306 S346 V347	G78-F83 PolarHBondContact O-N 2.64Å; F83-Y85 VanDerWaalsContact C-N 3.31Å; F83-Y85 PolarHBondContact O-N 3.27Å; F83-L86 PolarHBondContact O-N 2.93Å; F83-L86 VanDerWaalsContact O-N 3.1Å; F83-C87 PolarHBondContact O-N 2.98Å; F83-F95 HydrophobicContact CD2-CE1 4.38Å; F83-F95 HydrophobicContact CE2-CE1 4.3Å; F83-L96 HydrophobicContact CE2-CD2 4.38Å; F83-L96 HydrophobicContact CZ-CD2 3.65Å; F83-Y99 HydrophobicContact CD2-CD2 4.19Å; F83-Y99 AromaticContact CD2-CE2 3.81Å; F83-Y99 HydrophobicContact CD2-CE2 3.81Å; F83-Y99 AromaticContact CE2-CD1 3.91Å; F83-Y99 HydrophobicContact CE2-CD1 3.91Å; F83-Y99 AromaticContact CE2-CD2 3.85Å; F83-Y99 HydrophobicContact CE2-CD2 3.85Å; F83-Y99 AromaticContact CE2-CE1 3.81Å; F83-Y99 HydrophobicContact CE2-CE1 3.81Å; F83-Y99 AromaticContact CE2-CE2 3.74Å; F83-Y99 HydrophobicContact CE2-CE2 3.74Å; F83-Y99 AromaticContact CE2-CG 3.93Å; F83-Y99 HydrophobicContact CE2-CG 3.93Å; F83-Y99 AromaticContact CE2-CZ 3.72Å; F83-Y99 HydrophobicContact CZ-CE1 4.49Å; F83-Y286 WeakPolarHBondContact CE1-OH 3.33Å; F83-Q306 HydrophobicContact CD2-CG 4.29Å; F83-S346 VanDerWaalsContact CD1-O 3.23Å; F83-S346 WeakPolarHBondContact CD1-O 3.49Å; F83-S346 VanDerWaalsContact CE1-C 3.49Å; F83-S346 WeakPolarHBondContact CE1-O 3.4Å; F83-V347 HydrophobicContact CE1-CG2 4.21Å; F83-V347 HydrophobicContact CZ-CG2 3.9Å
84	P	92.8	Very high	92.7	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.006	7%	0.073	C	C	.	.	H	α-helix	trans	-61.7	-37.4	176.4	-28.5	40	0	0	0	113.6	V80 C87 H88 I353 F354	V80-P84 WeakPolarHBondContact O-CG 3.48Å; P84-C87 WeakPolarHBondContact O-CB 3.3Å; P84-C87 PolarHBondContact O-N 2.94Å; P84-H88 PolarHBondContact O-N 3.46Å; P84-I353 HydrophobicContact CB-CB 4.13Å; P84-I353 HydrophobicContact CB-CG1 4.23Å; P84-I353 HydrophobicContact CB-CG2 3.55Å; P84-I353 HydrophobicContact CG-CB 4.2Å; P84-I353 HydrophobicContact CG-CG1 3.88Å; P84-I353 HydrophobicContact CG-CG2 4.17Å; P84-F354 HydrophobicContact CB-CD2 4.31Å; P84-F354 HydrophobicContact CB-CE2 3.83Å; P84-F354 WeakPolarHBondContact O-CE2 3.48Å; P84-F354 WeakPolarHBondContact O-CZ 3.26Å
85	Y	90.4	Very high	92.9	Very high	64 Å²	64	14.6 Å²	14.6	25%	0.251	7%	0.071	S	C	.	.	H	α-helix	trans	-59	-45	171.7	169.4	-103.5	0	0	0	112.1	W81 R82 F83 C87 H88 K89	W81-Y85 VanDerWaalsContact O-CB 3.3Å; W81-Y85 WeakPolarHBondContact O-CB 3.49Å; W81-Y85 PolarHBondContact O-N 3.41Å; W81-Y85 VanDerWaalsContact O-N 3.13Å; R82-Y85 WeakPolarHBondContact O-CB 3.37Å; R82-Y85 PolarHBondContact O-N 3.45Å; F83-Y85 VanDerWaalsContact C-N 3.31Å; F83-Y85 PolarHBondContact O-N 3.27Å; Y85-C87 VanDerWaalsContact C-N 3.34Å; Y85-C87 PolarHBondContact O-N 3.24Å; Y85-H88 WeakPolarHBondContact O-CB 3.41Å; Y85-H88 PolarHBondContact O-N 3.41Å; Y85-K89 HydrophobicContact CE1-CD 4.18Å; Y85-K89 WeakPolarHBondContact O-CB 3.34Å; Y85-K89 PolarHBondContact O-N 3.27Å
86	L	92.4	Very high	92.9	Very high	10 Å²	10	16.3 Å²	16.3	5%	0.052	8%	0.08	C	C	.	.	H	α-helix	trans	-65.6	-36.7	177.4	-70.5	177	0	0	0	112.1	R82 F83 K89 N90 F95 D302 Q306	R82-L86 HydrophobicContact CG-CD1 4.25Å; R82-L86 HydrophobicContact CG-CG 4.47Å; R82-L86 VanDerWaalsContact O-CG 3.3Å; R82-L86 WeakPolarHBondContact O-CG 3.31Å; R82-L86 PolarHBondContact O-N 3.44Å; F83-L86 PolarHBondContact O-N 2.93Å; F83-L86 VanDerWaalsContact O-N 3.1Å; L86-K89 HydrophobicContact CD2-CD 4.46Å; L86-K89 PolarHBondContact O-N 3.02Å; L86-N90 WeakPolarHBondContact O-CB 3.16Å; L86-N90 PolarHBondContact O-N 3.49Å; L86-N90 PolarHBondContact O-ND2 3.31Å; L86-F95 HydrophobicContact CB-CE1 3.83Å; L86-F95 HydrophobicContact CB-CE2 4.42Å; L86-F95 HydrophobicContact CB-CZ 3.77Å; L86-F95 HydrophobicContact CD1-CZ 4.15Å; L86-D302 HydrophobicContact CD2-CB 4.13Å; L86-Q306 HydrophobicContact CD1-CB 3.69Å; L86-Q306 HydrophobicContact CD1-CG 3.99Å
87	C	94	Very high	93	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.2	-47.2	170.4	-71.2	0	0	0	0	111.2	F83 P84 Y85 N90 G91 G92 Y286 F354	F83-C87 PolarHBondContact O-N 2.98Å; P84-C87 WeakPolarHBondContact O-CB 3.3Å; P84-C87 PolarHBondContact O-N 2.94Å; Y85-C87 VanDerWaalsContact C-N 3.34Å; Y85-C87 PolarHBondContact O-N 3.24Å; C87-N90 PolarHBondContact O-N 3.38Å; C87-G91 PolarHBondContact O-N 2.95Å; C87-G92 VanDerWaalsContact O-CA 3.24Å; C87-G92 WeakPolarHBondContact O-CA 3.44Å; C87-G92 PolarHBondContact O-N 3.48Å; C87-Y286 HydrophobicContact CB-CD2 4.12Å; C87-Y286 HydrophobicContact CB-CE2 3.78Å; C87-F354 HydrophobicContact CB-CE2 4.48Å
88	H	90.9	Very high	93.2	Very high	33 Å²	33	19.4 Å²	19.4	15%	0.153	10%	0.095	C	C	.	.	H	α-helix	trans	-58.2	-52.5	175.4	167.2	58.2	0	0	0	112	P84 Y85 N90 Y285 F354 A369 A372	P84-H88 PolarHBondContact O-N 3.46Å; Y85-H88 WeakPolarHBondContact O-CB 3.41Å; Y85-H88 PolarHBondContact O-N 3.41Å; H88-N90 PolarHBondContact O-N 3.15Å; H88-Y285 PolarHBondContact CE1-OH 3.39Å; H88-Y285 VanDerWaalsContact CE1-OH 3.24Å; H88-Y285 AromaticContact ND1-CE1 3.54Å; H88-Y285 AromaticContact ND1-CZ 3.65Å; H88-Y285 PolarHBondContact ND1-OH 3.36Å; H88-F354 HydrophobicContact CB-CE1 4.4Å; H88-F354 HydrophobicContact CB-CZ 3.93Å; H88-A369 PolarHBondContact CE1-O 2.86Å; H88-A372 HydrophobicContact CB-CB 4.3Å; H88-A372 PolarHBondContact CD2-O 3.32Å; H88-A372 VanDerWaalsContact CD2-O 3.27Å
89	K	90.2	Very high	93.5	Very high	79 Å²	79	19.5 Å²	19.5	34%	0.343	10%	0.095	S	C	.	.	H	α-helix	trans	-60.5	-32.2	-178.1	-174.6	-170.9	172.1	-156.6	0	113	Y85 L86 R293 D302	Y85-K89 HydrophobicContact CE1-CD 4.18Å; Y85-K89 WeakPolarHBondContact O-CB 3.34Å; Y85-K89 PolarHBondContact O-N 3.27Å; L86-K89 HydrophobicContact CD2-CD 4.46Å; L86-K89 PolarHBondContact O-N 3.02Å; K89-R293 PolarHBondContact O-NE 3.19Å; K89-R293 PolarHBondContact O-NH2 3.02Å; K89-D302 IonicContact NZ-OD1 2.75Å; K89-D302 IonicContact NZ-OD2 3.17Å; K89-D302 PolarHBondContact NZ-OD2 2.82Å
90	N	93.7	Very high	93.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	27.7	-167.6	-63.7	-36.8	0	0	0	114.5	L86 C87 H88 F95 R293 V299 D302	L86-N90 WeakPolarHBondContact O-CB 3.16Å; L86-N90 PolarHBondContact O-N 3.49Å; L86-N90 PolarHBondContact O-ND2 3.31Å; C87-N90 PolarHBondContact O-N 3.38Å; H88-N90 PolarHBondContact O-N 3.15Å; N90-F95 HydrophobicContact CB-CB 4.02Å; N90-F95 HydrophobicContact CB-CD2 3.4Å; N90-F95 VanDerWaalsContact CB-CD2 3.4Å; N90-F95 HydrophobicContact CB-CE2 4.13Å; N90-F95 HydrophobicContact CB-CG 3.97Å; N90-F95 WeakPolarHBondContact ND2-CE2 3.34Å; N90-R293 PolarHBondContact OD1-NH2 3.34Å; N90-V299 HydrophobicContact CB-CB 4.49Å; N90-V299 HydrophobicContact CB-CG1 4.1Å; N90-V299 HydrophobicContact CB-CG2 3.98Å; N90-D302 WeakPolarHBondContact ND2-CB 3.19Å; N90-D302 PolarHBondContact ND2-OD2 3.36Å
91	G	92.7	Very high	93.8	Very high	11 Å²	11	25.7 Å²	25.7	11%	0.113	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	31	168.5	0	0	0	0	0	115.1	C87 G93 A94 D290	C87-G91 PolarHBondContact O-N 2.95Å; G91-G93 PolarHBondContact O-N 2.7Å; G91-A94 WeakPolarHBondContact O-CB 3.42Å; G91-A94 PolarHBondContact O-N 3.25Å; G91-D290 PolarHBondContact O-N 3.01Å
92	G	92.7	Very high	94.4	Very high	6 Å²	6	25.1 Å²	25.1	6%	0.062	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	61.5	-122.5	176.8	0	0	0	0	0	111.7	C87 A94 F95 Y286	C87-G92 VanDerWaalsContact O-CA 3.24Å; C87-G92 WeakPolarHBondContact O-CA 3.44Å; C87-G92 PolarHBondContact O-N 3.48Å; G92-A94 PolarHBondContact O-N 3.41Å; G92-A94 VanDerWaalsContact O-N 3.14Å; G92-F95 WeakPolarHBondContact O-CB 3.36Å; G92-F95 PolarHBondContact O-N 3.28Å; G92-Y286 CarbonylContact C-O 3.6Å
93	G	94.4	Very high	94.7	Very high	11 Å²	11	23.8 Å²	23.8	11%	0.113	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-61.3	-21.9	-178.9	0	0	0	0	0	114.1	G91 F95 L96 Y286 T288	G91-G93 PolarHBondContact O-N 2.7Å; G93-F95 VanDerWaalsContact C-N 3.26Å; G93-F95 PolarHBondContact O-N 3.42Å; G93-L96 WeakPolarHBondContact O-CB 3.37Å; G93-L96 PolarHBondContact O-N 3.39Å; G93-Y286 PolarHBondContact N-O 2.86Å; G93-T288 PolarHBondContact N-O 3.02Å
94	A	96.9	Very high	94.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-62.8	-33.8	178.1	0	0	0	0	0	112	G91 G92 L96 I97 P98 P289 D290 L294	G91-A94 WeakPolarHBondContact O-CB 3.42Å; G91-A94 PolarHBondContact O-N 3.25Å; G92-A94 PolarHBondContact O-N 3.41Å; G92-A94 VanDerWaalsContact O-N 3.14Å; A94-L96 PolarHBondContact O-N 2.89Å; A94-I97 WeakPolarHBondContact O-CB 3.37Å; A94-I97 PolarHBondContact O-N 2.92Å; A94-P98 WeakPolarHBondContact O-CD 3.26Å; A94-P289 HydrophobicContact CB-CB 4Å; A94-D290 WeakPolarHBondContact CB-O 3.44Å; A94-L294 HydrophobicContact CB-CD2 4.39Å; A94-L294 HydrophobicContact CB-CG 4.46Å
95	F	96.9	Very high	95.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-63.7	-23.8	178.4	-176.6	-107.2	0	0	0	113.4	F83 L86 N90 G92 G93 I97 P98 Y99 V299 D302 A303	F83-F95 HydrophobicContact CD2-CE1 4.38Å; F83-F95 HydrophobicContact CE2-CE1 4.3Å; L86-F95 HydrophobicContact CB-CE1 3.83Å; L86-F95 HydrophobicContact CB-CE2 4.42Å; L86-F95 HydrophobicContact CB-CZ 3.77Å; L86-F95 HydrophobicContact CD1-CZ 4.15Å; N90-F95 HydrophobicContact CB-CB 4.02Å; N90-F95 HydrophobicContact CB-CD2 3.4Å; N90-F95 VanDerWaalsContact CB-CD2 3.4Å; N90-F95 HydrophobicContact CB-CE2 4.13Å; N90-F95 HydrophobicContact CB-CG 3.97Å; N90-F95 WeakPolarHBondContact ND2-CE2 3.34Å; G92-F95 WeakPolarHBondContact O-CB 3.36Å; G92-F95 PolarHBondContact O-N 3.28Å; G93-F95 VanDerWaalsContact C-N 3.26Å; G93-F95 PolarHBondContact O-N 3.42Å; F95-I97 PolarHBondContact O-N 3.43Å; F95-P98 HydrophobicContact CD2-CG 4.4Å; F95-P98 WeakPolarHBondContact O-CD 3.02Å; F95-P98 VanDerWaalsContact O-CG 3.29Å; F95-P98 WeakPolarHBondContact O-CG 3.47Å; F95-Y99 HydrophobicContact CE1-CD2 4.22Å; F95-Y99 WeakPolarHBondContact O-CB 3.3Å; F95-Y99 PolarHBondContact O-N 3.19Å; F95-Y99 VanDerWaalsContact O-N 3.08Å; F95-V299 HydrophobicContact CD2-CG1 4.19Å; F95-D302 HydrophobicContact CE2-CB 4.14Å; F95-A303 HydrophobicContact CD2-CB 4.5Å; F95-A303 HydrophobicContact CE2-CB 3.72Å; F95-A303 HydrophobicContact CZ-CB 3.94Å
96	L	96.1	Very high	95.3	Very high	41 Å²	41	26.8 Å²	26.8	22%	0.215	15%	0.146	C	C	.	.	H	α-helix	trans	-64.6	-26	177.7	-59.8	179.3	0	0	0	112.3	F83 G93 A94 C100 V347	F83-L96 HydrophobicContact CE2-CD2 4.38Å; F83-L96 HydrophobicContact CZ-CD2 3.65Å; G93-L96 WeakPolarHBondContact O-CB 3.37Å; G93-L96 PolarHBondContact O-N 3.39Å; A94-L96 PolarHBondContact O-N 2.89Å; L96-C100 VanDerWaalsContact O-CB 3.26Å; L96-C100 WeakPolarHBondContact O-CB 3.43Å; L96-C100 PolarHBondContact O-N 2.91Å; L96-C100 PolarHBondContact O-SG 3.43Å; L96-V347 HydrophobicContact CD2-CG2 4.21Å
97	I	97	Very high	95.6	Very high	70 Å²	70	26.3 Å²	26.3	36%	0.359	14%	0.144	S	C	.	.	H	α-helix	trans	-66	-61.7	177.5	-63	166.5	0	0	0	111.3	A94 F95 Y99 C100 L101 F291 L294	A94-I97 WeakPolarHBondContact O-CB 3.37Å; A94-I97 PolarHBondContact O-N 2.92Å; F95-I97 PolarHBondContact O-N 3.43Å; I97-Y99 VanDerWaalsContact C-N 3.25Å; I97-Y99 PolarHBondContact O-N 3.05Å; I97-C100 PolarHBondContact O-N 3.37Å; I97-L101 HydrophobicContact CG2-CD1 4.11Å; I97-L101 WeakPolarHBondContact O-CG 3.37Å; I97-L101 PolarHBondContact O-N 3.5Å; I97-F291 HydrophobicContact CD1-CD1 4.41Å; I97-F291 HydrophobicContact CD1-CE1 3.83Å; I97-L294 HydrophobicContact CD1-CD1 4.16Å
98	P	96.7	Very high	95.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.4	-34	176.9	25.6	-34.3	0	0	0	111.6	A94 F95 L101 M102 L294 V299 W300 A303	A94-P98 WeakPolarHBondContact O-CD 3.26Å; F95-P98 HydrophobicContact CD2-CG 4.4Å; F95-P98 WeakPolarHBondContact O-CD 3.02Å; F95-P98 VanDerWaalsContact O-CG 3.29Å; F95-P98 WeakPolarHBondContact O-CG 3.47Å; P98-L101 PolarHBondContact O-N 2.8Å; P98-M102 WeakPolarHBondContact O-CB 3.49Å; P98-M102 WeakPolarHBondContact O-CG 3.19Å; P98-M102 PolarHBondContact O-N 3.32Å; P98-L294 HydrophobicContact CG-CD2 4.21Å; P98-V299 HydrophobicContact CG-CG1 3.91Å; P98-W300 HydrophobicContact CB-CD2 3.8Å; P98-W300 HydrophobicContact CB-CE3 3.48Å; P98-W300 VanDerWaalsContact CB-CE3 3.48Å; P98-W300 HydrophobicContact CB-CG 4.43Å; P98-W300 HydrophobicContact CB-CH2 4.25Å; P98-W300 HydrophobicContact CB-CZ3 3.74Å; P98-A303 HydrophobicContact CB-CB 3.85Å; P98-A303 HydrophobicContact CG-CB 4.24Å
99	Y	97.2	Very high	96.1	Very high	3 Å²	3	26 Å²	26	1%	0.012	14%	0.143	C	C	.	.	H	α-helix	trans	-59.5	-50.6	175.1	-177	-100.1	0	0	0	112.7	F83 F95 I97 M102 L103 Q306 I307 C343	F83-Y99 HydrophobicContact CD2-CD2 4.19Å; F83-Y99 AromaticContact CD2-CE2 3.81Å; F83-Y99 HydrophobicContact CD2-CE2 3.81Å; F83-Y99 AromaticContact CE2-CD1 3.91Å; F83-Y99 HydrophobicContact CE2-CD1 3.91Å; F83-Y99 AromaticContact CE2-CD2 3.85Å; F83-Y99 HydrophobicContact CE2-CD2 3.85Å; F83-Y99 AromaticContact CE2-CE1 3.81Å; F83-Y99 HydrophobicContact CE2-CE1 3.81Å; F83-Y99 AromaticContact CE2-CE2 3.74Å; F83-Y99 HydrophobicContact CE2-CE2 3.74Å; F83-Y99 AromaticContact CE2-CG 3.93Å; F83-Y99 HydrophobicContact CE2-CG 3.93Å; F83-Y99 AromaticContact CE2-CZ 3.72Å; F83-Y99 HydrophobicContact CZ-CE1 4.49Å; F95-Y99 HydrophobicContact CE1-CD2 4.22Å; F95-Y99 WeakPolarHBondContact O-CB 3.3Å; F95-Y99 PolarHBondContact O-N 3.19Å; F95-Y99 VanDerWaalsContact O-N 3.08Å; I97-Y99 VanDerWaalsContact C-N 3.25Å; I97-Y99 PolarHBondContact O-N 3.05Å; Y99-M102 PolarHBondContact O-N 3Å; Y99-L103 PolarHBondContact O-N 2.83Å; Y99-Q306 HydrophobicContact CD2-CG 4.39Å; Y99-Q306 HydrophobicContact CE2-CB 4.46Å; Y99-Q306 HydrophobicContact CE2-CG 3.85Å; Y99-I307 HydrophobicContact CD2-CD1 3.83Å; Y99-I307 HydrophobicContact CD2-CG1 4Å; Y99-I307 HydrophobicContact CE1-CD1 4.15Å; Y99-I307 HydrophobicContact CE2-CD1 3.37Å; Y99-I307 HydrophobicContact CE2-CG1 3.89Å; Y99-I307 HydrophobicContact CG-CD1 4.39Å; Y99-C343 HydrophobicContact CE1-CB 3.9Å; Y99-C343 PolarHBondContact OH-SG 3.35Å
100	C	97.3	Very high	96.4	Very high	62 Å²	62	22.2 Å²	22.2	42%	0.419	13%	0.127	S	C	.	.	H	α-helix	trans	-66	-37.1	177.2	-73.2	0	0	0	0	112.6	L96 I97 L103 I104	L96-C100 VanDerWaalsContact O-CB 3.26Å; L96-C100 WeakPolarHBondContact O-CB 3.43Å; L96-C100 PolarHBondContact O-N 2.91Å; L96-C100 PolarHBondContact O-SG 3.43Å; I97-C100 PolarHBondContact O-N 3.37Å; C100-L103 WeakPolarHBondContact O-CB 3.43Å; C100-L103 PolarHBondContact O-N 3.3Å; C100-I104 WeakPolarHBondContact O-CG1 3.21Å; C100-I104 PolarHBondContact O-N 3.19Å
101	L	97.3	Very high	96.6	Very high	70 Å²	70	22.3 Å²	22.3	37%	0.366	13%	0.127	S	C	.	.	H	α-helix	trans	-66.8	-42.1	176	-71.6	174.3	0	0	0	111.8	I97 P98 L103 I104 L105 W300	I97-L101 HydrophobicContact CG2-CD1 4.11Å; I97-L101 WeakPolarHBondContact O-CG 3.37Å; I97-L101 PolarHBondContact O-N 3.5Å; P98-L101 PolarHBondContact O-N 2.8Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-I104 PolarHBondContact O-N 2.81Å; L101-L105 WeakPolarHBondContact O-CB 3.48Å; L101-L105 WeakPolarHBondContact O-CG 3.45Å; L101-L105 PolarHBondContact O-N 3.24Å; L101-W300 HydrophobicContact CD1-CH2 3.85Å; L101-W300 HydrophobicContact CD1-CZ3 3.79Å
102	M	96.7	Very high	96.9	Very high	17 Å²	17	21.8 Å²	21.8	8%	0.084	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-36.1	174.7	-69.4	-61.7	169.5	0	0	111.4	P98 Y99 I104 L106 G107 W300 A303 A304 I307 I525	P98-M102 WeakPolarHBondContact O-CB 3.49Å; P98-M102 WeakPolarHBondContact O-CG 3.19Å; P98-M102 PolarHBondContact O-N 3.32Å; Y99-M102 PolarHBondContact O-N 3Å; M102-I104 PolarHBondContact O-N 3.24Å; M102-L106 CarbonylContact O-C 3.58Å; M102-L106 WeakPolarHBondContact O-CA 3.22Å; M102-L106 VanDerWaalsContact O-CB 3.23Å; M102-L106 WeakPolarHBondContact O-CB 3.48Å; M102-L106 PolarHBondContact O-N 2.76Å; M102-L106 HydrophobicContact SD-CD2 3.98Å; M102-G107 PolarHBondContact O-N 3.35Å; M102-W300 HydrophobicContact CE-CB 4.47Å; M102-W300 HydrophobicContact CE-CE3 4.04Å; M102-A303 HydrophobicContact CG-CB 4.28Å; M102-A304 HydrophobicContact CE-CB 4.37Å; M102-A304 HydrophobicContact CG-CB 3.99Å; M102-A304 HydrophobicContact SD-CB 3.82Å; M102-I307 HydrophobicContact CB-CG1 4Å; M102-I525 HydrophobicContact CE-CG2 4.31Å; M102-I525 HydrophobicContact SD-CG2 3.97Å
103	L	97.6	Very high	97.1	Very high	22 Å²	22	21.5 Å²	21.5	12%	0.115	12%	0.119	C	C	.	.	I	π-helix	trans	-57.3	-49.3	170.2	178	64.1	0	0	0	111.6	Y99 C100 L101 G107 L108 I307 L311 A339 C343	Y99-L103 PolarHBondContact O-N 2.83Å; C100-L103 WeakPolarHBondContact O-CB 3.43Å; C100-L103 PolarHBondContact O-N 3.3Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L103-G107 PolarHBondContact O-N 3.23Å; L103-L108 VanDerWaalsContact O-CB 3.25Å; L103-L108 WeakPolarHBondContact O-CB 3.27Å; L103-L108 PolarHBondContact O-N 3.08Å; L103-I307 HydrophobicContact CB-CD1 3.89Å; L103-I307 HydrophobicContact CD1-CD1 4.26Å; L103-L311 HydrophobicContact CD1-CD1 4.06Å; L103-A339 HydrophobicContact CD1-CB 4.11Å; L103-C343 VanDerWaalsContact CD1-SG 3.56Å; L103-C343 HydrophobicContact CD2-CB 3.99Å; L103-C343 VanDerWaalsContact CD2-SG 3.54Å
104	I	98	Very high	97.3	Very high	82 Å²	82	21 Å²	21	42%	0.421	11%	0.113	S	C	.	.	I	π-helix	trans	-73.2	-38.7	-174.9	-66.8	166.9	0	0	0	112.2	C100 L101 M102 P109 Y513	C100-I104 WeakPolarHBondContact O-CG1 3.21Å; C100-I104 PolarHBondContact O-N 3.19Å; L101-I104 PolarHBondContact O-N 2.81Å; M102-I104 PolarHBondContact O-N 3.24Å; I104-P109 WeakPolarHBondContact O-CD 3.32Å; I104-P109 WeakPolarHBondContact O-CG 3.31Å; I104-Y513 HydrophobicContact CG2-CE2 3.9Å; I104-Y513 PolarHBondContact O-OH 3.19Å
105	L	97.3	Very high	97.3	Very high	45 Å²	45	21 Å²	21	24%	0.236	11%	0.113	C	C	.	.	I	π-helix	trans	-95.5	-21.1	-171.2	-61.6	176	0	0	0	114	L101 F521 T522 I525	L101-L105 WeakPolarHBondContact O-CB 3.48Å; L101-L105 WeakPolarHBondContact O-CG 3.45Å; L101-L105 PolarHBondContact O-N 3.24Å; L105-F521 HydrophobicContact CB-CB 4.5Å; L105-F521 HydrophobicContact CD2-CD2 4.08Å; L105-F521 HydrophobicContact CD2-CE2 4.43Å; L105-F521 HydrophobicContact CD2-CG 4.16Å; L105-T522 PolarHBondContact O-OG1 3.38Å; L105-T522 VanDerWaalsContact O-OG1 3.11Å; L105-I525 HydrophobicContact CB-CD1 3.73Å; L105-I525 HydrophobicContact CD1-CD1 4.28Å
106	L	96.1	Very high	97.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	I	π-helix	trans	-127	-60.4	-170.6	-177.4	65.7	0	0	0	111.2	M102 L110 A304 F308 T522 I525 L529	M102-L106 CarbonylContact O-C 3.58Å; M102-L106 WeakPolarHBondContact O-CA 3.22Å; M102-L106 VanDerWaalsContact O-CB 3.23Å; M102-L106 WeakPolarHBondContact O-CB 3.48Å; M102-L106 PolarHBondContact O-N 2.76Å; M102-L106 HydrophobicContact SD-CD2 3.98Å; L106-L110 HydrophobicContact CD1-CD1 3.83Å; L106-L110 HydrophobicContact CG-CD1 4.26Å; L106-L110 WeakPolarHBondContact O-CB 3.26Å; L106-L110 VanDerWaalsContact O-CG 3.3Å; L106-L110 WeakPolarHBondContact O-CG 3.4Å; L106-L110 PolarHBondContact O-N 2.84Å; L106-L110 VanDerWaalsContact O-N 3.12Å; L106-A304 HydrophobicContact CD2-CB 3.91Å; L106-F308 HydrophobicContact CD1-CE2 3.78Å; L106-F308 HydrophobicContact CD1-CZ 4.02Å; L106-F308 HydrophobicContact CD2-CD2 3.88Å; L106-F308 HydrophobicContact CD2-CE2 3.38Å; L106-F308 HydrophobicContact CD2-CZ 4.41Å; L106-F308 HydrophobicContact CG-CD2 4.35Å; L106-F308 HydrophobicContact CG-CE2 3.62Å; L106-F308 HydrophobicContact CG-CZ 4.24Å; L106-T522 HydrophobicContact CD1-CG2 3.98Å; L106-I525 HydrophobicContact CD1-CG2 4.2Å; L106-I525 HydrophobicContact CD2-CG2 3.89Å; L106-I525 HydrophobicContact CG-CG2 4.48Å; L106-L529 HydrophobicContact CD2-CD1 4.11Å
107	G	96.9	Very high	97.4	Very high	1 Å²	1	19 Å²	19	1%	0.01	10%	0.103	C	C	.	.	I	π-helix	trans	-62.4	-60.2	-174.1	0	0	0	0	0	113.6	M102 L103 L110 F111 I307	M102-G107 PolarHBondContact O-N 3.35Å; L103-G107 PolarHBondContact O-N 3.23Å; G107-L110 PolarHBondContact O-N 3.24Å; G107-F111 WeakPolarHBondContact O-CB 3.16Å; G107-F111 PolarHBondContact O-N 2.88Å; G107-I307 VanDerWaalsContact CA-CG2 3.47Å
108	L	97.7	Very high	97.4	Very high	25 Å²	25	15.7 Å²	15.7	13%	0.131	9%	0.086	C	C	.	.	H	α-helix	trans	-61.9	-43.9	-176.7	178.4	62.8	0	0	0	112.8	L103 F111 F112 V336 A339 W514	L103-L108 VanDerWaalsContact O-CB 3.25Å; L103-L108 WeakPolarHBondContact O-CB 3.27Å; L103-L108 PolarHBondContact O-N 3.08Å; L108-F111 PolarHBondContact O-N 3.06Å; L108-F112 PolarHBondContact O-N 2.84Å; L108-V336 HydrophobicContact CD1-CB 4.37Å; L108-V336 HydrophobicContact CD1-CG2 3.92Å; L108-V336 HydrophobicContact CD2-CG2 4.28Å; L108-A339 HydrophobicContact CD1-CB 3.95Å; L108-W514 HydrophobicContact CD1-CH2 3.93Å; L108-W514 HydrophobicContact CD1-CZ3 4.45Å; L108-W514 HydrophobicContact CD2-CH2 4Å; L108-W514 HydrophobicContact CD2-CZ3 4.5Å; L108-W514 HydrophobicContact CG-CH2 3.62Å; L108-W514 HydrophobicContact CG-CZ3 3.85Å
109	P	98	Very high	97.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.1	-48.7	172.1	-27.8	37	0	0	0	113.4	I104 L113 C517 W518	I104-P109 WeakPolarHBondContact O-CD 3.32Å; I104-P109 WeakPolarHBondContact O-CG 3.31Å; P109-L113 VanDerWaalsContact O-CB 3.28Å; P109-L113 WeakPolarHBondContact O-CB 3.36Å; P109-L113 PolarHBondContact O-N 3.07Å; P109-C517 HydrophobicContact CB-CB 3.71Å; P109-C517 HydrophobicContact CG-CB 3.46Å; P109-C517 VanDerWaalsContact CG-CB 3.46Å; P109-W518 PolarHBondContact O-NE1 3.27Å
110	L	97.6	Very high	97.2	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-64	-42.5	178.8	-73.4	171.6	0	0	0	111.7	L106 G107 F112 L113 E114 F308 C313 A482 T486 T522	L106-L110 HydrophobicContact CD1-CD1 3.83Å; L106-L110 HydrophobicContact CG-CD1 4.26Å; L106-L110 WeakPolarHBondContact O-CB 3.26Å; L106-L110 VanDerWaalsContact O-CG 3.3Å; L106-L110 WeakPolarHBondContact O-CG 3.4Å; L106-L110 PolarHBondContact O-N 2.84Å; L106-L110 VanDerWaalsContact O-N 3.12Å; G107-L110 PolarHBondContact O-N 3.24Å; L110-F112 PolarHBondContact O-N 3.3Å; L110-L113 PolarHBondContact O-N 3.43Å; L110-E114 PolarHBondContact O-N 2.93Å; L110-F308 HydrophobicContact CD1-CE1 3.67Å; L110-F308 HydrophobicContact CD1-CE2 4.24Å; L110-F308 HydrophobicContact CD1-CZ 3.4Å; L110-C313 HydrophobicContact CB-CB 4.4Å; L110-A482 HydrophobicContact CD1-CB 4.17Å; L110-A482 HydrophobicContact CD2-CB 4.42Å; L110-T486 HydrophobicContact CD2-CG2 3.6Å; L110-T522 HydrophobicContact CD1-CG2 4.06Å; L110-T522 HydrophobicContact CD2-CG2 3.6Å; L110-T522 HydrophobicContact CG-CG2 3.64Å
111	F	97.5	Very high	96.8	Very high	1 Å²	1	12.9 Å²	12.9	0%	0.004	7%	0.067	C	C	.	.	H	α-helix	trans	-57.1	-50.8	178.6	-158.4	-63.1	0	0	0	111.7	G107 L108 F115 L311 L318 A335 F338	G107-F111 WeakPolarHBondContact O-CB 3.16Å; G107-F111 PolarHBondContact O-N 2.88Å; L108-F111 PolarHBondContact O-N 3.06Å; F111-F115 HydrophobicContact CD1-CD1 4.12Å; F111-F115 HydrophobicContact CD1-CD2 4.41Å; F111-F115 HydrophobicContact CD1-CE1 4.23Å; F111-F115 HydrophobicContact CD1-CE2 4.48Å; F111-F115 HydrophobicContact CD1-CG 4.24Å; F111-F115 HydrophobicContact CD1-CZ 4.41Å; F111-F115 AromaticContact CE1-CD1 3.87Å; F111-F115 HydrophobicContact CE1-CD1 3.87Å; F111-F115 HydrophobicContact CE1-CD2 4.1Å; F111-F115 AromaticContact CE1-CE1 3.52Å; F111-F115 HydrophobicContact CE1-CE1 3.52Å; F111-F115 AromaticContact CE1-CE2 3.74Å; F111-F115 HydrophobicContact CE1-CE2 3.74Å; F111-F115 HydrophobicContact CE1-CG 4.18Å; F111-F115 AromaticContact CE1-CZ 3.45Å; F111-F115 HydrophobicContact CE1-CZ 3.45Å; F111-F115 VanDerWaalsContact CE1-CZ 3.45Å; F111-F115 HydrophobicContact CZ-CE1 4.2Å; F111-F115 HydrophobicContact CZ-CZ 4.12Å; F111-F115 WeakPolarHBondContact O-CB 3.1Å; F111-F115 PolarHBondContact O-N 3.3Å; F111-L311 HydrophobicContact CD2-CB 3.9Å; F111-L311 HydrophobicContact CD2-CD1 4.19Å; F111-L311 HydrophobicContact CD2-CD2 3.95Å; F111-L311 HydrophobicContact CD2-CG 4.23Å; F111-L311 HydrophobicContact CE2-CB 4.19Å; F111-L311 HydrophobicContact CE2-CD2 3.98Å; F111-L318 HydrophobicContact CB-CD1 4.18Å; F111-L318 HydrophobicContact CD1-CD1 4.02Å; F111-L318 HydrophobicContact CD1-CD2 4.39Å; F111-L318 HydrophobicContact CD2-CD1 3.59Å; F111-L318 HydrophobicContact CD2-CD2 4.22Å; F111-L318 HydrophobicContact CE1-CD1 4.29Å; F111-L318 HydrophobicContact CE1-CD2 3.84Å; F111-L318 HydrophobicContact CE2-CD1 3.87Å; F111-L318 HydrophobicContact CE2-CD2 3.63Å; F111-L318 HydrophobicContact CE2-CG 4.45Å; F111-L318 HydrophobicContact CG-CD1 3.66Å; F111-L318 HydrophobicContact CZ-CD1 4.22Å; F111-L318 HydrophobicContact CZ-CD2 3.42Å; F111-L318 VanDerWaalsContact CZ-CD2 3.42Å; F111-L318 HydrophobicContact CZ-CG 4.49Å; F111-A335 HydrophobicContact CD1-CB 3.59Å; F111-A335 HydrophobicContact CE1-CB 4.18Å; F111-A335 HydrophobicContact CG-CB 4.46Å; F111-F338 HydrophobicContact CE1-CB 4.41Å; F111-F338 HydrophobicContact CE1-CD2 4.34Å; F111-F338 HydrophobicContact CZ-CB 3.94Å; F111-F338 HydrophobicContact CZ-CD2 4.34Å
112	F	98.3	Very high	96.6	Very high	1 Å²	1	10.5 Å²	10.5	0%	0.004	6%	0.057	C	C	.	.	H	α-helix	trans	-66.7	-38.2	179	177.4	-143.1	0	0	0	112	L108 L110 F115 A116 C332 A335 I502 I506 P510 W514 W518	L108-F112 PolarHBondContact O-N 2.84Å; L110-F112 PolarHBondContact O-N 3.3Å; F112-F115 PolarHBondContact O-N 3.44Å; F112-A116 HydrophobicContact CE2-CB 4.26Å; F112-A116 WeakPolarHBondContact O-CB 3.38Å; F112-A116 PolarHBondContact O-N 3.35Å; F112-C332 HydrophobicContact CD2-CB 4.04Å; F112-C332 HydrophobicContact CE1-CB 4.16Å; F112-C332 VanDerWaalsContact CE2-CA 3.41Å; F112-C332 HydrophobicContact CE2-CB 3.47Å; F112-C332 VanDerWaalsContact CE2-CB 3.47Å; F112-C332 HydrophobicContact CZ-CB 3.52Å; F112-A335 HydrophobicContact CB-CB 3.94Å; F112-A335 HydrophobicContact CD2-CB 4.45Å; F112-I502 HydrophobicContact CE1-CD1 4.47Å; F112-I502 HydrophobicContact CZ-CD1 4.18Å; F112-I502 HydrophobicContact CZ-CG2 3.85Å; F112-I506 HydrophobicContact CZ-CD1 4.28Å; F112-P510 HydrophobicContact CE1-CB 4.35Å; F112-P510 HydrophobicContact CE1-CG 4.12Å; F112-P510 HydrophobicContact CZ-CG 4.35Å; F112-W514 HydrophobicContact CB-CE3 4.32Å; F112-W514 HydrophobicContact CB-CH2 3.91Å; F112-W514 HydrophobicContact CB-CZ3 3.7Å; F112-W514 AromaticContact CD1-CD2 3.64Å; F112-W514 HydrophobicContact CD1-CD2 3.64Å; F112-W514 AromaticContact CD1-CE2 3.79Å; F112-W514 AromaticContact CD1-CE3 3.62Å; F112-W514 HydrophobicContact CD1-CE3 3.62Å; F112-W514 HydrophobicContact CD1-CG 4.27Å; F112-W514 AromaticContact CD1-CH2 3.88Å; F112-W514 HydrophobicContact CD1-CH2 3.88Å; F112-W514 AromaticContact CD1-CZ2 3.94Å; F112-W514 HydrophobicContact CD1-CZ2 3.94Å; F112-W514 AromaticContact CD1-CZ3 3.74Å; F112-W514 HydrophobicContact CD1-CZ3 3.74Å; F112-W514 HydrophobicContact CE1-CD2 4.07Å; F112-W514 HydrophobicContact CE1-CE3 4.48Å; F112-W514 HydrophobicContact CE1-CG 4.29Å; F112-W514 HydrophobicContact CE1-CZ2 4.48Å; F112-W514 HydrophobicContact CG-CE3 4.45Å; F112-W514 HydrophobicContact CG-CH2 4.2Å; F112-W514 HydrophobicContact CG-CZ3 4.16Å; F112-W518 HydrophobicContact CB-CZ2 4.44Å; F112-W518 AromaticContact CD1-CH2 3.67Å; F112-W518 HydrophobicContact CD1-CH2 3.67Å; F112-W518 AromaticContact CD1-CZ2 3.44Å; F112-W518 HydrophobicContact CD1-CZ2 3.44Å; F112-W518 VanDerWaalsContact CD1-CZ2 3.44Å; F112-W518 AromaticContact CE1-CH2 3.65Å; F112-W518 HydrophobicContact CE1-CH2 3.65Å; F112-W518 AromaticContact CE1-CZ2 3.95Å; F112-W518 HydrophobicContact CE1-CZ2 3.95Å; F112-W518 HydrophobicContact CG-CZ2 4.14Å
113	L	98.2	Very high	96.2	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.1	-48.7	177.1	-179.7	145.3	0	0	0	111.5	P109 L110 F115 A116 F117 E485 T486 I489 F498 W518	P109-L113 VanDerWaalsContact O-CB 3.28Å; P109-L113 WeakPolarHBondContact O-CB 3.36Å; P109-L113 PolarHBondContact O-N 3.07Å; L110-L113 PolarHBondContact O-N 3.43Å; L113-F115 PolarHBondContact O-N 2.83Å; L113-A116 PolarHBondContact O-N 2.91Å; L113-F117 WeakPolarHBondContact O-CB 3.41Å; L113-F117 PolarHBondContact O-N 3.5Å; L113-E485 HydrophobicContact CD2-CG 3.8Å; L113-E485 WeakPolarHBondContact CD2-OE1 3.25Å; L113-T486 HydrophobicContact CD1-CG2 4.47Å; L113-I489 HydrophobicContact CD1-CG2 4.38Å; L113-I489 HydrophobicContact CD2-CD1 3.7Å; L113-I489 HydrophobicContact CG-CD1 4.3Å; L113-F498 HydrophobicContact CG-CE1 4.28Å; L113-F498 HydrophobicContact CG-CZ 4.5Å; L113-W518 HydrophobicContact CB-CZ2 4.07Å; L113-W518 HydrophobicContact CD1-CD2 4.27Å; L113-W518 HydrophobicContact CD1-CG 4.04Å
114	E	97.9	Very high	95.9	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.5	-37.9	177.6	-78.5	-170.5	110.7	0	0	112.2	L110 F117 G118 C313 C314 L318 I319 E485	L110-E114 PolarHBondContact O-N 2.93Å; E114-F117 PolarHBondContact O-N 2.88Å; E114-G118 PolarHBondContact O-N 3.4Å; E114-C313 WeakPolarHBondContact OE2-CA 3.13Å; E114-C314 VanDerWaalsContact CD-N 3.34Å; E114-C314 WeakPolarHBondContact OE1-CA 3.23Å; E114-C314 PolarHBondContact OE1-N 3.07Å; E114-C314 PolarHBondContact OE2-N 3.39Å; E114-L318 HydrophobicContact CB-CB 3.8Å; E114-L318 HydrophobicContact CB-CD1 4.5Å; E114-L318 WeakPolarHBondContact OE2-CD1 3.47Å; E114-I319 HydrophobicContact CB-CG1 3.82Å; E114-I319 HydrophobicContact CG-CD1 4.25Å; E114-I319 HydrophobicContact CG-CG1 3.92Å; E114-E485 WeakPolarHBondContact CG-OE1 3.5Å
115	F	97.7	Very high	95.8	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-63.2	-47	175.3	-100.6	31.9	0	0	0	112.7	F66 F111 F112 L113 F117 Q119 L318 S322 C331 D334 A335 F338	F66-F115 HydrophobicContact CE1-CE2 4.44Å; F66-F115 HydrophobicContact CE2-CE2 4.44Å; F66-F115 HydrophobicContact CE2-CZ 4.17Å; F66-F115 HydrophobicContact CZ-CD2 4.49Å; F66-F115 AromaticContact CZ-CE2 3.59Å; F66-F115 HydrophobicContact CZ-CE2 3.59Å; F66-F115 AromaticContact CZ-CZ 3.74Å; F66-F115 HydrophobicContact CZ-CZ 3.74Å; F111-F115 HydrophobicContact CD1-CD1 4.12Å; F111-F115 HydrophobicContact CD1-CD2 4.41Å; F111-F115 HydrophobicContact CD1-CE1 4.23Å; F111-F115 HydrophobicContact CD1-CE2 4.48Å; F111-F115 HydrophobicContact CD1-CG 4.24Å; F111-F115 HydrophobicContact CD1-CZ 4.41Å; F111-F115 AromaticContact CE1-CD1 3.87Å; F111-F115 HydrophobicContact CE1-CD1 3.87Å; F111-F115 HydrophobicContact CE1-CD2 4.1Å; F111-F115 AromaticContact CE1-CE1 3.52Å; F111-F115 HydrophobicContact CE1-CE1 3.52Å; F111-F115 AromaticContact CE1-CE2 3.74Å; F111-F115 HydrophobicContact CE1-CE2 3.74Å; F111-F115 HydrophobicContact CE1-CG 4.18Å; F111-F115 AromaticContact CE1-CZ 3.45Å; F111-F115 HydrophobicContact CE1-CZ 3.45Å; F111-F115 VanDerWaalsContact CE1-CZ 3.45Å; F111-F115 HydrophobicContact CZ-CE1 4.2Å; F111-F115 HydrophobicContact CZ-CZ 4.12Å; F111-F115 WeakPolarHBondContact O-CB 3.1Å; F111-F115 PolarHBondContact O-N 3.3Å; F112-F115 PolarHBondContact O-N 3.44Å; L113-F115 PolarHBondContact O-N 2.83Å; F115-F117 VanDerWaalsContact C-N 3.31Å; F115-Q119 WeakPolarHBondContact O-CB 3.48Å; F115-Q119 PolarHBondContact O-N 3.02Å; F115-L318 HydrophobicContact CD1-CB 3.93Å; F115-L318 HydrophobicContact CD1-CD2 4.39Å; F115-L318 HydrophobicContact CE1-CB 4.01Å; F115-L318 HydrophobicContact CE1-CD2 3.77Å; F115-L318 HydrophobicContact CE1-CG 4.45Å; F115-S322 WeakPolarHBondContact O-CB 3.47Å; F115-S322 PolarHBondContact O-OG 2.82Å; F115-C331 HydrophobicContact CB-CB 4.23Å; F115-C331 HydrophobicContact CD2-CB 4.27Å; F115-D334 HydrophobicContact CE2-CB 4.26Å; F115-A335 HydrophobicContact CD2-CB 4.2Å; F115-F338 AromaticContact CE2-CD2 3.9Å; F115-F338 HydrophobicContact CE2-CD2 3.9Å; F115-F338 AromaticContact CE2-CE2 3.9Å; F115-F338 HydrophobicContact CE2-CE2 3.9Å; F115-F338 AromaticContact CZ-CD2 3.96Å; F115-F338 HydrophobicContact CZ-CD2 3.96Å; F115-F338 HydrophobicContact CZ-CE2 4.09Å
116	A	97.8	Very high	95.7	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-62.6	-42.3	174.8	0	0	0	0	0	111	F112 L113 F120 F498 I502 M505	F112-A116 HydrophobicContact CE2-CB 4.26Å; F112-A116 WeakPolarHBondContact O-CB 3.38Å; F112-A116 PolarHBondContact O-N 3.35Å; L113-A116 PolarHBondContact O-N 2.91Å; A116-F120 VanDerWaalsContact O-CB 3.24Å; A116-F120 WeakPolarHBondContact O-CB 3.28Å; A116-F120 PolarHBondContact O-N 3.3Å; A116-F498 HydrophobicContact CB-CE1 4.43Å; A116-F498 HydrophobicContact CB-CZ 3.92Å; A116-I502 HydrophobicContact CB-CD1 3.79Å; A116-I502 HydrophobicContact CB-CG1 3.71Å; A116-M505 HydrophobicContact CB-CE 3.95Å; A116-M505 WeakPolarHBondContact O-CE 3.35Å
117	F	96.8	Very high	95.4	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-65.6	-45.8	-176.8	-171.2	-147.6	0	0	0	112.4	L113 E114 F115 V128 W129 I131 I319 I489 F498 W593	L113-F117 WeakPolarHBondContact O-CB 3.41Å; L113-F117 PolarHBondContact O-N 3.5Å; E114-F117 PolarHBondContact O-N 2.88Å; F115-F117 VanDerWaalsContact C-N 3.31Å; F117-V128 HydrophobicContact CD1-CG1 4.02Å; F117-V128 HydrophobicContact CD1-CG2 4.02Å; F117-V128 HydrophobicContact CD2-CG2 3.56Å; F117-V128 HydrophobicContact CE1-CB 4.26Å; F117-V128 HydrophobicContact CE1-CG1 3.44Å; F117-V128 VanDerWaalsContact CE1-CG1 3.44Å; F117-V128 HydrophobicContact CE1-CG2 3.91Å; F117-V128 HydrophobicContact CE2-CB 4.37Å; F117-V128 HydrophobicContact CE2-CG1 4.37Å; F117-V128 HydrophobicContact CE2-CG2 3.43Å; F117-V128 VanDerWaalsContact CE2-CG2 3.43Å; F117-V128 HydrophobicContact CG-CG2 3.85Å; F117-V128 HydrophobicContact CZ-CB 4.08Å; F117-V128 HydrophobicContact CZ-CG1 3.64Å; F117-V128 HydrophobicContact CZ-CG2 3.6Å; F117-V128 VanDerWaalsContact O-CG2 3.31Å; F117-V128 WeakPolarHBondContact O-CG2 3.28Å; F117-W129 HydrophobicContact CE1-CD2 4.31Å; F117-W129 AromaticContact CE1-CE2 3.91Å; F117-W129 HydrophobicContact CE1-CH2 4.04Å; F117-W129 AromaticContact CE1-CZ2 3.78Å; F117-W129 HydrophobicContact CE1-CZ2 3.78Å; F117-W129 HydrophobicContact CE1-CZ3 4.45Å; F117-W129 HydrophobicContact CZ-CD2 4.27Å; F117-W129 HydrophobicContact CZ-CE3 4.33Å; F117-W129 HydrophobicContact CZ-CH2 4.45Å; F117-W129 HydrophobicContact CZ-CZ2 4.44Å; F117-W129 HydrophobicContact CZ-CZ3 4.41Å; F117-I131 HydrophobicContact CD2-CD1 4.49Å; F117-I131 HydrophobicContact CE2-CB 4.1Å; F117-I131 HydrophobicContact CE2-CD1 3.87Å; F117-I131 HydrophobicContact CE2-CG2 3.74Å; F117-I131 HydrophobicContact CZ-CG2 3.71Å; F117-I319 HydrophobicContact CD1-CD1 3.9Å; F117-I319 HydrophobicContact CE1-CD1 4.37Å; F117-I489 HydrophobicContact CD1-CD1 3.89Å; F117-I489 HydrophobicContact CD2-CD1 4.36Å; F117-I489 HydrophobicContact CE1-CD1 4.04Å; F117-I489 HydrophobicContact CE2-CD1 4.49Å; F117-I489 HydrophobicContact CG-CD1 4.07Å; F117-I489 HydrophobicContact CZ-CD1 4.35Å; F117-F498 HydrophobicContact CB-CE2 4.5Å; F117-F498 HydrophobicContact CB-CZ 4.37Å; F117-W593 AromaticContact CD2-CH2 3.85Å; F117-W593 HydrophobicContact CD2-CH2 3.85Å; F117-W593 HydrophobicContact CD2-CZ2 4.46Å; F117-W593 AromaticContact CE2-CH2 3.52Å; F117-W593 HydrophobicContact CE2-CH2 3.52Å; F117-W593 HydrophobicContact CE2-CZ2 4.19Å; F117-W593 HydrophobicContact CE2-CZ3 4.23Å
118	G	95.7	Very high	95.1	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-67.8	-45.9	176	0	0	0	0	0	113.3	E114 F120 S122 S323	E114-G118 PolarHBondContact O-N 3.4Å; G118-F120 PolarHBondContact O-N 3.26Å; G118-S122 WeakPolarHBondContact O-CA 3.42Å; G118-S122 PolarHBondContact O-N 3.46Å; G118-S122 VanDerWaalsContact O-N 3.09Å; G118-S323 VanDerWaalsContact O-CA 3.3Å; G118-S323 WeakPolarHBondContact O-CA 3.38Å; G118-S323 VanDerWaalsContact O-CB 3.28Å; G118-S323 WeakPolarHBondContact O-CB 3.21Å
119	Q	96.1	Very high	94.9	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-66.4	-37.4	-177.4	-171.2	175.5	-70.8	0	0	112.8	F115 A121 S122 N325 F327 N329 M505	F115-Q119 WeakPolarHBondContact O-CB 3.48Å; F115-Q119 PolarHBondContact O-N 3.02Å; Q119-A121 PolarHBondContact O-N 3.47Å; Q119-S122 PolarHBondContact O-N 3.29Å; Q119-N325 HydrophobicContact CG-CB 4.09Å; Q119-N325 PolarHBondContact OE1-ND2 3.13Å; Q119-F327 PolarHBondContact NE2-O 2.83Å; Q119-N329 PolarHBondContact NE2-O 3.4Å; Q119-M505 HydrophobicContact CB-SD 4.14Å; Q119-M505 HydrophobicContact CG-SD 4.21Å
120	F	94.7	Very high	94.4	Very high	1 Å²	1	6.2 Å²	6.2	0%	0.004	4%	0.036	C	C	.	.	H	α-helix	trans	-59.7	-47.3	-175.4	-178.9	-106.9	0	0	0	113	A116 G118 F327 D501 L504 M505 W593 P595 F604	A116-F120 VanDerWaalsContact O-CB 3.24Å; A116-F120 WeakPolarHBondContact O-CB 3.28Å; A116-F120 PolarHBondContact O-N 3.3Å; G118-F120 PolarHBondContact O-N 3.26Å; F120-F327 AromaticContact CD2-CE2 3.86Å; F120-F327 HydrophobicContact CD2-CE2 3.86Å; F120-F327 HydrophobicContact CD2-CZ 4.1Å; F120-F327 HydrophobicContact CE2-CE2 4.25Å; F120-F327 HydrophobicContact CE2-CZ 4.19Å; F120-F327 WeakPolarHBondContact O-CE2 3.39Å; F120-D501 HydrophobicContact CD2-CB 3.84Å; F120-D501 HydrophobicContact CE1-CB 4.35Å; F120-D501 HydrophobicContact CE2-CB 3.52Å; F120-D501 HydrophobicContact CG-CB 4.4Å; F120-D501 HydrophobicContact CZ-CB 3.79Å; F120-L504 HydrophobicContact CE2-CD2 4.38Å; F120-M505 WeakPolarHBondContact CA-SD 3.48Å; F120-M505 HydrophobicContact CB-CE 3.9Å; F120-M505 HydrophobicContact CB-SD 3.56Å; F120-M505 VanDerWaalsContact CB-SD 3.56Å; F120-M505 HydrophobicContact CD2-CE 4.22Å; F120-M505 HydrophobicContact CD2-CG 3.93Å; F120-M505 HydrophobicContact CD2-SD 3.98Å; F120-M505 HydrophobicContact CG-SD 4.29Å; F120-M505 PolarHBondContact N-SD 3.25Å; F120-M505 VanDerWaalsContact N-SD 3.39Å; F120-W593 HydrophobicContact CD1-CH2 4.1Å; F120-W593 AromaticContact CD1-CZ2 3.59Å; F120-W593 HydrophobicContact CD1-CZ2 3.59Å; F120-W593 AromaticContact CE1-CE2 3.93Å; F120-W593 AromaticContact CE1-CZ2 3.88Å; F120-W593 HydrophobicContact CE1-CZ2 3.88Å; F120-W593 AromaticContact CE1-NE1 3.89Å; F120-P595 HydrophobicContact CE2-CG 3.96Å; F120-P595 HydrophobicContact CZ-CG 4.07Å; F120-P595 WeakPolarHBondContact O-CA 3.46Å; F120-F604 HydrophobicContact CE1-CE2 4.4Å; F120-F604 AromaticContact CZ-CD2 3.81Å; F120-F604 HydrophobicContact CZ-CD2 3.81Å; F120-F604 AromaticContact CZ-CE2 3.72Å; F120-F604 HydrophobicContact CZ-CE2 3.72Å; F120-F604 HydrophobicContact CZ-CG 4.39Å; F120-F604 HydrophobicContact CZ-CZ 4.21Å
121	A	89.6	Confident	93.9	Very high	4 Å²	4	6.1 Å²	6.1	3%	0.033	4%	0.036	C	C	.	.	H	α-helix	trans	-95.7	-10.9	-177.9	0	0	0	0	0	113.4	Q119 L123 V128 W593	Q119-A121 PolarHBondContact O-N 3.47Å; A121-L123 HydrophobicContact CB-CB 4.11Å; A121-L123 HydrophobicContact CB-CD1 3.91Å; A121-L123 HydrophobicContact CB-CG 3.87Å; A121-L123 WeakPolarHBondContact O-CG 3.42Å; A121-L123 PolarHBondContact O-N 3.26Å; A121-V128 HydrophobicContact CB-CG2 4.5Å; A121-W593 HydrophobicContact CB-CE3 4.13Å; A121-W593 HydrophobicContact CB-CH2 3.83Å; A121-W593 HydrophobicContact CB-CZ3 3.46Å; A121-W593 VanDerWaalsContact CB-CZ3 3.46Å
122	S	91.8	Very high	93.5	Very high	20 Å²	20	6.1 Å²	6.1	14%	0.14	4%	0.035	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	31.1	-169.9	-48.6	0	0	0	0	113.1	R57 G118 Q119 S323	R57-S122 VanDerWaalsContact CD-O 3.24Å; R57-S122 WeakPolarHBondContact CD-O 3.36Å; R57-S122 PolarHBondContact NH1-O 3.45Å; G118-S122 WeakPolarHBondContact O-CA 3.42Å; G118-S122 PolarHBondContact O-N 3.46Å; G118-S122 VanDerWaalsContact O-N 3.09Å; Q119-S122 PolarHBondContact O-N 3.29Å; S122-S323 WeakPolarHBondContact CA-O 3.47Å; S122-S323 WeakPolarHBondContact CB-O 3.47Å
123	L	89.7	Confident	93	Very high	41 Å²	41	6.8 Å²	6.8	22%	0.215	4%	0.04	C	C	.	.			trans	-109.6	151.2	-175.5	-69.8	-179.2	0	0	0	112.4	R57 A121 S127 V128 S323	R57-L123 PolarHBondContact NH1-O 3.23Å; A121-L123 HydrophobicContact CB-CB 4.11Å; A121-L123 HydrophobicContact CB-CD1 3.91Å; A121-L123 HydrophobicContact CB-CG 3.87Å; A121-L123 WeakPolarHBondContact O-CG 3.42Å; A121-L123 PolarHBondContact O-N 3.26Å; L123-S127 WeakPolarHBondContact CD1-O 3.48Å; L123-V128 HydrophobicContact CB-CB 4.15Å; L123-S323 WeakPolarHBondContact O-CB 3.34Å
124	G	91	Very high	92.6	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.04	C	C	.	.			trans	-72.7	173.2	176.8	0	0	0	0	0	112.4	I126 S127 V128 D425	G124-I126 PolarHBondContact O-N 2.81Å; G124-I126 VanDerWaalsContact O-N 3.09Å; G124-S127 PolarHBondContact O-N 2.92Å; G124-S127 VanDerWaalsContact O-N 3.12Å; G124-V128 WeakPolarHBondContact O-CB 3.43Å; G124-V128 PolarHBondContact O-N 3.27Å; G124-D425 WeakPolarHBondContact CA-OD2 3.35Å; G124-D425 PolarHBondContact N-OD2 2.67Å
125	P	95.4	Very high	92.4	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.9	-171.1	23.8	-35.1	0	0	0	114.1	W129 G139 M142 V143 T320 T418	P125-W129 PolarHBondContact O-NE1 2.93Å; P125-G139 WeakPolarHBondContact O-CA 3.24Å; P125-M142 HydrophobicContact CB-SD 4.44Å; P125-V143 HydrophobicContact CB-CG2 4.28Å; P125-V143 HydrophobicContact CG-CG2 3.64Å; P125-T320 WeakPolarHBondContact CD-OG1 3.4Å; P125-T418 HydrophobicContact CG-CG2 4.22Å
126	I	94.6	Very high	92.1	Very high	4 Å²	4	8.9 Å²	8.9	2%	0.021	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-47.1	174.3	-65.4	167.5	0	0	0	111.3	G124 V128 W129 K136 G139 Y140 V143 E426	G124-I126 PolarHBondContact O-N 2.81Å; G124-I126 VanDerWaalsContact O-N 3.09Å; I126-V128 PolarHBondContact O-N 3.47Å; I126-W129 PolarHBondContact O-N 3.32Å; I126-K136 HydrophobicContact CG2-CG 4.39Å; I126-K136 WeakPolarHBondContact O-CE 3.23Å; I126-G139 WeakPolarHBondContact CG1-O 3.43Å; I126-Y140 HydrophobicContact CD1-CD1 3.7Å; I126-Y140 HydrophobicContact CD1-CE1 3.89Å; I126-Y140 HydrophobicContact CD1-CG 4.48Å; I126-Y140 HydrophobicContact CG1-CD1 4.11Å; I126-Y140 HydrophobicContact CG1-CE1 4.42Å; I126-Y140 HydrophobicContact CG1-CG 4.43Å; I126-Y140 HydrophobicContact CG2-CD1 4.25Å; I126-Y140 HydrophobicContact CG2-CD2 4.38Å; I126-Y140 HydrophobicContact CG2-CE1 3.88Å; I126-Y140 HydrophobicContact CG2-CE2 4.04Å; I126-Y140 HydrophobicContact CG2-CG 4.49Å; I126-V143 HydrophobicContact CD1-CB 4.09Å; I126-V143 HydrophobicContact CD1-CG1 4.37Å; I126-V143 HydrophobicContact CD1-CG2 3.71Å; I126-V143 HydrophobicContact CG1-CB 4.38Å; I126-V143 HydrophobicContact CG1-CG2 3.7Å; I126-E426 HydrophobicContact CB-CG 4.4Å; I126-E426 HydrophobicContact CD1-CG 4.08Å; I126-E426 HydrophobicContact CG2-CG 3.75Å; I126-E426 VanDerWaalsContact CG2-OE1 3.27Å; I126-E426 WeakPolarHBondContact CG2-OE1 3.39Å
127	S	90	Very high	92.1	Very high	13 Å²	13	8.9 Å²	8.9	9%	0.091	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-71.4	-29.9	-173.6	-62.2	0	0	0	0	113.4	L123 G124 W129 N130 D425	L123-S127 WeakPolarHBondContact CD1-O 3.48Å; G124-S127 PolarHBondContact O-N 2.92Å; G124-S127 VanDerWaalsContact O-N 3.12Å; S127-W129 PolarHBondContact O-N 2.9Å; S127-W129 VanDerWaalsContact O-N 3.14Å; S127-N130 WeakPolarHBondContact O-CB 3.28Å; S127-N130 PolarHBondContact O-N 3.16Å; S127-N130 VanDerWaalsContact O-N 3.1Å; S127-N130 PolarHBondContact O-ND2 3.4Å; S127-D425 PolarHBondContact OG-OD2 3.33Å
128	V	91.9	Very high	92.1	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-60.8	-23.8	-179.8	75.6	0	0	0	0	112.5	F117 A121 L123 G124 I126 N130 I131 I319 W593	F117-V128 HydrophobicContact CD1-CG1 4.02Å; F117-V128 HydrophobicContact CD1-CG2 4.02Å; F117-V128 HydrophobicContact CD2-CG2 3.56Å; F117-V128 HydrophobicContact CE1-CB 4.26Å; F117-V128 HydrophobicContact CE1-CG1 3.44Å; F117-V128 VanDerWaalsContact CE1-CG1 3.44Å; F117-V128 HydrophobicContact CE1-CG2 3.91Å; F117-V128 HydrophobicContact CE2-CB 4.37Å; F117-V128 HydrophobicContact CE2-CG1 4.37Å; F117-V128 HydrophobicContact CE2-CG2 3.43Å; F117-V128 VanDerWaalsContact CE2-CG2 3.43Å; F117-V128 HydrophobicContact CG-CG2 3.85Å; F117-V128 HydrophobicContact CZ-CB 4.08Å; F117-V128 HydrophobicContact CZ-CG1 3.64Å; F117-V128 HydrophobicContact CZ-CG2 3.6Å; F117-V128 VanDerWaalsContact O-CG2 3.31Å; F117-V128 WeakPolarHBondContact O-CG2 3.28Å; A121-V128 HydrophobicContact CB-CG2 4.5Å; L123-V128 HydrophobicContact CB-CB 4.15Å; G124-V128 WeakPolarHBondContact O-CB 3.43Å; G124-V128 PolarHBondContact O-N 3.27Å; I126-V128 PolarHBondContact O-N 3.47Å; V128-N130 PolarHBondContact O-N 2.85Å; V128-I131 PolarHBondContact O-N 2.83Å; V128-I319 HydrophobicContact CB-CG2 4.41Å; V128-I319 HydrophobicContact CG1-CD1 4.39Å; V128-I319 HydrophobicContact CG1-CG2 4.07Å; V128-W593 HydrophobicContact CG2-CH2 3.99Å; V128-W593 HydrophobicContact CG2-CZ3 3.94Å; V128-W593 WeakPolarHBondContact O-CZ3 3.39Å
129	W	93.2	Very high	92.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-72.8	7.5	175.9	-66.3	94.7	0	0	0	115	F117 P125 I126 S127 I131 S132 F135 K136 I138 G139 M142 E485 V488	F117-W129 HydrophobicContact CE1-CD2 4.31Å; F117-W129 AromaticContact CE1-CE2 3.91Å; F117-W129 HydrophobicContact CE1-CH2 4.04Å; F117-W129 AromaticContact CE1-CZ2 3.78Å; F117-W129 HydrophobicContact CE1-CZ2 3.78Å; F117-W129 HydrophobicContact CE1-CZ3 4.45Å; F117-W129 HydrophobicContact CZ-CD2 4.27Å; F117-W129 HydrophobicContact CZ-CE3 4.33Å; F117-W129 HydrophobicContact CZ-CH2 4.45Å; F117-W129 HydrophobicContact CZ-CZ2 4.44Å; F117-W129 HydrophobicContact CZ-CZ3 4.41Å; P125-W129 PolarHBondContact O-NE1 2.93Å; I126-W129 PolarHBondContact O-N 3.32Å; S127-W129 PolarHBondContact O-N 2.9Å; S127-W129 VanDerWaalsContact O-N 3.14Å; W129-I131 HydrophobicContact CE3-CG2 4.3Å; W129-I131 PolarHBondContact O-N 3.36Å; W129-S132 CarbonylContact O-C 3.57Å; W129-S132 PolarHBondContact O-N 3.37Å; W129-S132 VanDerWaalsContact O-O 3.08Å; W129-F135 HydrophobicContact CE3-CB 4.22Å; W129-K136 VanDerWaalsContact CB-CA 3.49Å; W129-K136 HydrophobicContact CB-CB 3.83Å; W129-K136 HydrophobicContact CB-CG 4.12Å; W129-I138 HydrophobicContact CD2-CB 4.05Å; W129-I138 HydrophobicContact CE3-CB 4.39Å; W129-I138 HydrophobicContact CE3-CD1 4.13Å; W129-I138 HydrophobicContact CH2-CB 4.09Å; W129-I138 HydrophobicContact CH2-CD1 3.67Å; W129-I138 HydrophobicContact CH2-CG1 4.5Å; W129-I138 HydrophobicContact CH2-CG2 3.79Å; W129-I138 HydrophobicContact CZ2-CB 3.67Å; W129-I138 HydrophobicContact CZ2-CD1 4.18Å; W129-I138 HydrophobicContact CZ2-CG2 3.23Å; W129-I138 HydrophobicContact CZ3-CB 4.42Å; W129-I138 HydrophobicContact CZ3-CD1 3.63Å; W129-G139 VanDerWaalsContact CD1-N 3.3Å; W129-G139 VanDerWaalsContact NE1-CA 3.3Å; W129-G139 VanDerWaalsContact NE1-N 3.17Å; W129-M142 HydrophobicContact CZ2-CE 4.04Å; W129-E485 HydrophobicContact CH2-CB 3.92Å; W129-E485 HydrophobicContact CH2-CG 3.92Å; W129-E485 HydrophobicContact CZ2-CB 4.28Å; W129-E485 HydrophobicContact CZ2-CG 4.23Å; W129-V488 HydrophobicContact CE3-CG1 4.44Å; W129-V488 HydrophobicContact CZ3-CB 4.06Å; W129-V488 HydrophobicContact CZ3-CG1 3.83Å
130	N	86.2	Confident	92.2	Very high	44 Å²	44	11.2 Å²	11.2	24%	0.235	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-59	-16.7	162.3	-77.5	-6.6	0	0	0	112.7	S127 V128 S132 V590 W593	S127-N130 WeakPolarHBondContact O-CB 3.28Å; S127-N130 PolarHBondContact O-N 3.16Å; S127-N130 VanDerWaalsContact O-N 3.1Å; S127-N130 PolarHBondContact O-ND2 3.4Å; V128-N130 PolarHBondContact O-N 2.85Å; N130-S132 PolarHBondContact O-N 2.82Å; N130-V590 HydrophobicContact CB-CG2 3.72Å; N130-V590 PolarHBondContact O-N 2.99Å; N130-W593 HydrophobicContact CB-CE3 4.26Å
131	I	88.1	Confident	92.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-56.8	-31.5	167.3	-161.1	173.3	0	0	0	112.9	F117 V128 W129 Y493 K588 P589 W593	F117-I131 HydrophobicContact CD2-CD1 4.49Å; F117-I131 HydrophobicContact CE2-CB 4.1Å; F117-I131 HydrophobicContact CE2-CD1 3.87Å; F117-I131 HydrophobicContact CE2-CG2 3.74Å; F117-I131 HydrophobicContact CZ-CG2 3.71Å; V128-I131 PolarHBondContact O-N 2.83Å; W129-I131 HydrophobicContact CE3-CG2 4.3Å; W129-I131 PolarHBondContact O-N 3.36Å; I131-Y493 HydrophobicContact CD1-CD1 3.6Å; I131-Y493 HydrophobicContact CD1-CD2 3.68Å; I131-Y493 HydrophobicContact CD1-CE1 3.84Å; I131-Y493 HydrophobicContact CD1-CE2 3.91Å; I131-Y493 HydrophobicContact CD1-CG 3.49Å; I131-Y493 VanDerWaalsContact CD1-CG 3.49Å; I131-Y493 HydrophobicContact CG1-CD1 4.24Å; I131-Y493 HydrophobicContact CG1-CD2 3.32Å; I131-Y493 HydrophobicContact CG1-CE1 4.44Å; I131-Y493 HydrophobicContact CG1-CE2 3.58Å; I131-Y493 HydrophobicContact CG1-CG 3.66Å; I131-K588 CarbonylContact O-C 3.57Å; I131-P589 WeakPolarHBondContact O-CA 3.39Å; I131-W593 HydrophobicContact CB-CD2 3.88Å; I131-W593 HydrophobicContact CB-CE3 4.02Å; I131-W593 HydrophobicContact CB-CH2 3.95Å; I131-W593 HydrophobicContact CB-CZ2 3.79Å; I131-W593 HydrophobicContact CB-CZ3 4.05Å; I131-W593 HydrophobicContact CD1-CH2 4.19Å; I131-W593 HydrophobicContact CD1-CZ2 3.53Å; I131-W593 HydrophobicContact CG1-CD2 4.18Å; I131-W593 HydrophobicContact CG1-CH2 4.34Å; I131-W593 HydrophobicContact CG1-CZ2 3.7Å
132	S	89.4	Confident	92.7	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.056	C	C	.	.	S	Bend	trans	-155.3	95.4	173.3	-171.9	0	0	0	0	110.6	W129 N130 L134 F135 F586	W129-S132 CarbonylContact O-C 3.57Å; W129-S132 PolarHBondContact O-N 3.37Å; W129-S132 VanDerWaalsContact O-O 3.08Å; N130-S132 PolarHBondContact O-N 2.82Å; S132-L134 PolarHBondContact O-N 2.94Å; S132-L134 VanDerWaalsContact O-N 3.07Å; S132-F135 PolarHBondContact O-N 3.21Å; S132-F135 WeakPolarHBondContact OG-CD2 3.47Å; S132-F586 PolarHBondContact OG-O 3.32Å; S132-F586 VanDerWaalsContact OG-O 3.08Å
133	P	86.6	Confident	93	Very high	16 Å²	16	10.4 Å²	10.4	10%	0.104	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-57	-26.8	-172.3	-31.1	37.4	0	0	0	116.4	F135 K136 W569 F586 V590	P133-F135 PolarHBondContact O-N 3.35Å; P133-K136 PolarHBondContact O-N 3.43Å; P133-W569 PolarHBondContact O-NE1 2.68Å; P133-F586 WeakPolarHBondContact CD-O 3.39Å; P133-V590 HydrophobicContact CG-CG1 3.3Å
134	L	89.4	Confident	93.3	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-63.2	-29.4	174.6	-89.2	168.4	0	0	0	112.5	S132 F570 K573 M583 F586 L587	S132-L134 PolarHBondContact O-N 2.94Å; S132-L134 VanDerWaalsContact O-N 3.07Å; L134-F570 HydrophobicContact CB-CD2 4.05Å; L134-F570 HydrophobicContact CB-CE2 4.19Å; L134-F570 HydrophobicContact CD1-CE2 4.15Å; L134-F570 HydrophobicContact CD2-CD2 4.06Å; L134-F570 HydrophobicContact CD2-CE2 4.09Å; L134-F570 HydrophobicContact CG-CD2 4.49Å; L134-F570 HydrophobicContact CG-CE2 4.36Å; L134-F570 WeakPolarHBondContact O-CA 3.5Å; L134-K573 HydrophobicContact CD2-CB 3.96Å; L134-M583 HydrophobicContact CD1-CG 4.39Å; L134-F586 HydrophobicContact CB-CB 4.35Å; L134-F586 HydrophobicContact CD1-CB 3.44Å; L134-F586 VanDerWaalsContact CD1-CB 3.44Å; L134-F586 HydrophobicContact CD1-CD2 4.25Å; L134-F586 HydrophobicContact CD1-CG 4.35Å; L134-F586 HydrophobicContact CD2-CB 4.5Å; L134-F586 HydrophobicContact CD2-CD2 4.21Å; L134-F586 HydrophobicContact CG-CB 3.45Å; L134-F586 VanDerWaalsContact CG-CB 3.45Å; L134-F586 HydrophobicContact CG-CD2 4.03Å; L134-F586 HydrophobicContact CG-CG 4.13Å; L134-L587 HydrophobicContact CD1-CD2 4.42Å
135	F	93.8	Very high	93.6	Very high	39 Å²	39	10.8 Å²	10.8	17%	0.171	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-103.8	12.5	-174.7	-66.3	-75.2	0	0	0	113.4	W129 S132 P133 G137 I138 V488 V492 F570 L587	W129-F135 HydrophobicContact CE3-CB 4.22Å; S132-F135 PolarHBondContact O-N 3.21Å; S132-F135 WeakPolarHBondContact OG-CD2 3.47Å; P133-F135 PolarHBondContact O-N 3.35Å; F135-G137 PolarHBondContact O-N 3.49Å; F135-I138 HydrophobicContact CB-CD1 3.86Å; F135-I138 HydrophobicContact CB-CG1 4.41Å; F135-I138 HydrophobicContact CD1-CD1 4.31Å; F135-I138 HydrophobicContact CG-CD1 4.45Å; F135-I138 WeakPolarHBondContact O-CB 3.41Å; F135-I138 VanDerWaalsContact O-CG1 3.29Å; F135-I138 WeakPolarHBondContact O-CG1 3.24Å; F135-I138 PolarHBondContact O-N 3.44Å; F135-V488 HydrophobicContact CB-CG1 4.22Å; F135-V488 HydrophobicContact CB-CG2 3.99Å; F135-V488 HydrophobicContact CD1-CG2 3.63Å; F135-V488 HydrophobicContact CD2-CB 4.49Å; F135-V488 HydrophobicContact CD2-CG1 3.94Å; F135-V488 HydrophobicContact CD2-CG2 3.64Å; F135-V488 HydrophobicContact CE1-CG2 3.95Å; F135-V488 HydrophobicContact CE2-CG2 3.96Å; F135-V488 HydrophobicContact CG-CG1 4.2Å; F135-V488 HydrophobicContact CG-CG2 3.47Å; F135-V488 VanDerWaalsContact CG-CG2 3.47Å; F135-V488 HydrophobicContact CZ-CG2 4.1Å; F135-V492 HydrophobicContact CE2-CG1 4.47Å; F135-V492 HydrophobicContact CE2-CG2 4.28Å; F135-F570 HydrophobicContact CD1-CD2 4.37Å; F135-F570 AromaticContact CE1-CD2 3.96Å; F135-F570 HydrophobicContact CE1-CD2 3.96Å; F135-F570 HydrophobicContact CE1-CE2 4.14Å; F135-F570 HydrophobicContact CZ-CD2 4.18Å; F135-F570 AromaticContact CZ-CE2 3.93Å; F135-F570 HydrophobicContact CZ-CE2 3.93Å; F135-L587 HydrophobicContact CE2-CD2 3.84Å
136	K	92.8	Very high	93.6	Very high	5 Å²	5	10.8 Å²	10.8	2%	0.022	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19	175.7	179.7	171.6	-175.8	171.9	0	114.2	I126 W129 P133 I138 G139 Y140 E426 W569	I126-K136 HydrophobicContact CG2-CG 4.39Å; I126-K136 WeakPolarHBondContact O-CE 3.23Å; W129-K136 VanDerWaalsContact CB-CA 3.49Å; W129-K136 HydrophobicContact CB-CB 3.83Å; W129-K136 HydrophobicContact CB-CG 4.12Å; P133-K136 PolarHBondContact O-N 3.43Å; K136-I138 PolarHBondContact O-N 2.82Å; K136-G139 PolarHBondContact O-N 2.85Å; K136-G139 VanDerWaalsContact O-N 3.13Å; K136-Y140 HydrophobicContact CD-CE2 4.47Å; K136-Y140 HydrophobicContact CG-CD2 4.43Å; K136-Y140 HydrophobicContact CG-CE2 4.02Å; K136-Y140 WeakPolarHBondContact O-CD2 3.11Å; K136-Y140 PolarHBondContact O-N 2.86Å; K136-E426 WeakPolarHBondContact CE-OE1 3.23Å; K136-E426 IonicContact NZ-OE1 2.65Å; K136-E426 PolarHBondContact NZ-OE1 2.92Å; K136-E426 IonicContact NZ-OE2 2.66Å; K136-W569 HydrophobicContact CB-CZ2 4.16Å; K136-W569 HydrophobicContact CD-CZ2 3.92Å; K136-W569 HydrophobicContact CG-CZ2 4.14Å
137	G	96.5	Very high	93.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-55.6	-27.1	167.4	0	0	0	0	0	114.4	F135 Y140 A141 W569	F135-G137 PolarHBondContact O-N 3.49Å; G137-Y140 PolarHBondContact O-N 3.44Å; G137-A141 WeakPolarHBondContact O-CB 3.49Å; G137-A141 PolarHBondContact O-N 2.76Å; G137-W569 VanDerWaalsContact N-CD1 3.32Å
138	I	97.8	Very high	94	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.4	-43.5	175.5	-58.7	172.7	0	0	0	110.6	W129 F135 K136 Y140 A141 M142 I481 C484 V488 I566	W129-I138 HydrophobicContact CD2-CB 4.05Å; W129-I138 HydrophobicContact CE3-CB 4.39Å; W129-I138 HydrophobicContact CE3-CD1 4.13Å; W129-I138 HydrophobicContact CH2-CB 4.09Å; W129-I138 HydrophobicContact CH2-CD1 3.67Å; W129-I138 HydrophobicContact CH2-CG1 4.5Å; W129-I138 HydrophobicContact CH2-CG2 3.79Å; W129-I138 HydrophobicContact CZ2-CB 3.67Å; W129-I138 HydrophobicContact CZ2-CD1 4.18Å; W129-I138 HydrophobicContact CZ2-CG2 3.23Å; W129-I138 HydrophobicContact CZ3-CB 4.42Å; W129-I138 HydrophobicContact CZ3-CD1 3.63Å; F135-I138 HydrophobicContact CB-CD1 3.86Å; F135-I138 HydrophobicContact CB-CG1 4.41Å; F135-I138 HydrophobicContact CD1-CD1 4.31Å; F135-I138 HydrophobicContact CG-CD1 4.45Å; F135-I138 WeakPolarHBondContact O-CB 3.41Å; F135-I138 VanDerWaalsContact O-CG1 3.29Å; F135-I138 WeakPolarHBondContact O-CG1 3.24Å; F135-I138 PolarHBondContact O-N 3.44Å; K136-I138 PolarHBondContact O-N 2.82Å; I138-Y140 PolarHBondContact O-N 2.86Å; I138-A141 WeakPolarHBondContact O-CB 3.23Å; I138-A141 PolarHBondContact O-N 2.85Å; I138-A141 VanDerWaalsContact O-N 3.17Å; I138-M142 HydrophobicContact CG2-CE 4.12Å; I138-M142 WeakPolarHBondContact O-CG 3.29Å; I138-M142 PolarHBondContact O-N 3.09Å; I138-I481 HydrophobicContact CG2-CG2 3.99Å; I138-C484 HydrophobicContact CD1-CB 3.68Å; I138-C484 HydrophobicContact CG1-CB 4.09Å; I138-V488 HydrophobicContact CD1-CG2 4.02Å; I138-I566 HydrophobicContact CG1-CD1 4.24Å; I138-I566 HydrophobicContact CG1-CG1 4.27Å; I138-I566 HydrophobicContact CG1-CG2 3.92Å
139	G	97.1	Very high	94.2	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.2	-38.3	177.5	0	0	0	0	0	113.5	P125 I126 W129 K136 M142 V143	P125-G139 WeakPolarHBondContact O-CA 3.24Å; I126-G139 WeakPolarHBondContact CG1-O 3.43Å; W129-G139 VanDerWaalsContact CD1-N 3.3Å; W129-G139 VanDerWaalsContact NE1-CA 3.3Å; W129-G139 VanDerWaalsContact NE1-N 3.17Å; K136-G139 PolarHBondContact O-N 2.85Å; K136-G139 VanDerWaalsContact O-N 3.13Å; G139-M142 WeakPolarHBondContact O-CB 3.36Å; G139-M142 PolarHBondContact O-N 3.41Å; G139-V143 PolarHBondContact O-N 2.92Å; G139-V143 VanDerWaalsContact O-N 3.1Å
140	Y	96.7	Very high	94.4	Very high	48 Å²	48	15.7 Å²	15.7	19%	0.188	7%	0.072	C	C	.	.	H	α-helix	trans	-65.5	-40.1	171.9	-69.8	-74.2	0	0	0	111.4	I126 K136 G137 I138 M142 V143 I144 E426 T565 W569	I126-Y140 HydrophobicContact CD1-CD1 3.7Å; I126-Y140 HydrophobicContact CD1-CE1 3.89Å; I126-Y140 HydrophobicContact CD1-CG 4.48Å; I126-Y140 HydrophobicContact CG1-CD1 4.11Å; I126-Y140 HydrophobicContact CG1-CE1 4.42Å; I126-Y140 HydrophobicContact CG1-CG 4.43Å; I126-Y140 HydrophobicContact CG2-CD1 4.25Å; I126-Y140 HydrophobicContact CG2-CD2 4.38Å; I126-Y140 HydrophobicContact CG2-CE1 3.88Å; I126-Y140 HydrophobicContact CG2-CE2 4.04Å; I126-Y140 HydrophobicContact CG2-CG 4.49Å; K136-Y140 HydrophobicContact CD-CE2 4.47Å; K136-Y140 HydrophobicContact CG-CD2 4.43Å; K136-Y140 HydrophobicContact CG-CE2 4.02Å; K136-Y140 WeakPolarHBondContact O-CD2 3.11Å; K136-Y140 PolarHBondContact O-N 2.86Å; G137-Y140 PolarHBondContact O-N 3.44Å; I138-Y140 PolarHBondContact O-N 2.86Å; Y140-M142 VanDerWaalsContact C-N 3.33Å; Y140-M142 PolarHBondContact O-N 2.92Å; Y140-V143 PolarHBondContact O-N 2.8Å; Y140-I144 VanDerWaalsContact O-CG1 3.24Å; Y140-I144 WeakPolarHBondContact O-CG1 3.29Å; Y140-I144 PolarHBondContact O-N 2.72Å; Y140-E426 HydrophobicContact CE1-CG 4.1Å; Y140-E426 VanDerWaalsContact OH-CD 3.24Å; Y140-E426 PolarHBondContact OH-OE2 3.29Å; Y140-T565 HydrophobicContact CG-CG2 4.45Å; Y140-W569 HydrophobicContact CD2-CD2 4.49Å; Y140-W569 HydrophobicContact CD2-CE3 4.12Å; Y140-W569 HydrophobicContact CD2-CZ3 4.34Å; Y140-W569 HydrophobicContact CE2-CD2 4.2Å; Y140-W569 AromaticContact CE2-CE3 3.69Å; Y140-W569 HydrophobicContact CE2-CE3 3.69Å; Y140-W569 AromaticContact CE2-CH2 3.8Å; Y140-W569 HydrophobicContact CE2-CH2 3.8Å; Y140-W569 HydrophobicContact CE2-CZ2 4.31Å; Y140-W569 AromaticContact CE2-CZ3 3.47Å; Y140-W569 HydrophobicContact CE2-CZ3 3.47Å; Y140-W569 VanDerWaalsContact CE2-CZ3 3.47Å; Y140-W569 AromaticContact CZ-CZ3 3.99Å
141	A	97.8	Very high	95	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60	-42.8	175.4	0	0	0	0	0	111.9	G137 I138 I144 L145 I481 P562 I566	G137-A141 WeakPolarHBondContact O-CB 3.49Å; G137-A141 PolarHBondContact O-N 2.76Å; I138-A141 WeakPolarHBondContact O-CB 3.23Å; I138-A141 PolarHBondContact O-N 2.85Å; I138-A141 VanDerWaalsContact O-N 3.17Å; A141-I144 PolarHBondContact O-N 3.22Å; A141-L145 VanDerWaalsContact O-CB 3.3Å; A141-L145 WeakPolarHBondContact O-CB 3.32Å; A141-L145 PolarHBondContact O-N 2.83Å; A141-I481 HydrophobicContact CB-CD1 3.96Å; A141-I481 HydrophobicContact CB-CG1 4.15Å; A141-P562 HydrophobicContact CB-CB 3.96Å; A141-P562 WeakPolarHBondContact CB-O 3.47Å; A141-I566 HydrophobicContact CB-CD1 4.03Å; A141-I566 HydrophobicContact CB-CG1 3.76Å
142	M	97.4	Very high	95.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58	-49.1	173.9	-72.8	170.6	167.4	0	0	111.7	P125 W129 I138 G139 Y140 L145 S146 N315 I319 I481 E485	P125-M142 HydrophobicContact CB-SD 4.44Å; W129-M142 HydrophobicContact CZ2-CE 4.04Å; I138-M142 HydrophobicContact CG2-CE 4.12Å; I138-M142 WeakPolarHBondContact O-CG 3.29Å; I138-M142 PolarHBondContact O-N 3.09Å; G139-M142 WeakPolarHBondContact O-CB 3.36Å; G139-M142 PolarHBondContact O-N 3.41Å; Y140-M142 VanDerWaalsContact C-N 3.33Å; Y140-M142 PolarHBondContact O-N 2.92Å; M142-L145 PolarHBondContact O-N 3.36Å; M142-S146 WeakPolarHBondContact O-CB 3.48Å; M142-S146 PolarHBondContact O-N 3.4Å; M142-N315 CarbonylContact C-O 3.54Å; M142-N315 VanDerWaalsContact O-O 3.05Å; M142-I319 HydrophobicContact CE-CD1 3.94Å; M142-I319 HydrophobicContact SD-CD1 3.82Å; M142-I481 HydrophobicContact CE-CG2 3.76Å; M142-I481 HydrophobicContact CG-CG2 3.75Å; M142-E485 WeakPolarHBondContact CE-OE2 3.16Å
143	V	97.3	Very high	95.6	Very high	8 Å²	8	14.9 Å²	14.9	5%	0.048	7%	0.068	C	C	.	.	H	α-helix	trans	-67.3	-39.8	-179.5	171.9	0	0	0	0	112.2	P125 I126 G139 Y140 S146 W147 T419	P125-V143 HydrophobicContact CB-CG2 4.28Å; P125-V143 HydrophobicContact CG-CG2 3.64Å; I126-V143 HydrophobicContact CD1-CB 4.09Å; I126-V143 HydrophobicContact CD1-CG1 4.37Å; I126-V143 HydrophobicContact CD1-CG2 3.71Å; I126-V143 HydrophobicContact CG1-CB 4.38Å; I126-V143 HydrophobicContact CG1-CG2 3.7Å; G139-V143 PolarHBondContact O-N 2.92Å; G139-V143 VanDerWaalsContact O-N 3.1Å; Y140-V143 PolarHBondContact O-N 2.8Å; V143-S146 PolarHBondContact O-N 2.96Å; V143-W147 WeakPolarHBondContact O-CB 3.46Å; V143-W147 PolarHBondContact O-N 3.22Å; V143-T419 HydrophobicContact CG1-CG2 4.39Å
144	I	96.9	Very high	96.1	Very high	46 Å²	46	14.1 Å²	14.1	24%	0.236	6%	0.063	C	C	.	.	H	α-helix	trans	-63.3	-44.2	175.2	-65.8	163.6	0	0	0	110.4	Y140 A141 W147 I148 I561 P562 T565	Y140-I144 VanDerWaalsContact O-CG1 3.24Å; Y140-I144 WeakPolarHBondContact O-CG1 3.29Å; Y140-I144 PolarHBondContact O-N 2.72Å; A141-I144 PolarHBondContact O-N 3.22Å; I144-W147 PolarHBondContact O-N 3.37Å; I144-I148 HydrophobicContact CG2-CD1 4.28Å; I144-I148 WeakPolarHBondContact O-CG1 3.39Å; I144-I148 PolarHBondContact O-N 3.02Å; I144-I561 HydrophobicContact CD1-CG2 4.37Å; I144-I561 HydrophobicContact CG2-CG2 4.1Å; I144-P562 HydrophobicContact CB-CG 4.43Å; I144-P562 HydrophobicContact CG2-CG 3.91Å; I144-T565 HydrophobicContact CD1-CG2 4.24Å
145	L	96	Very high	96.5	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.021	6%	0.063	C	C	.	.	H	α-helix	trans	-61.7	-45.3	177	-171.8	71.5	0	0	0	111.2	A141 M142 W147 I148 L149 N315 I473 T477 P478 I481	A141-L145 VanDerWaalsContact O-CB 3.3Å; A141-L145 WeakPolarHBondContact O-CB 3.32Å; A141-L145 PolarHBondContact O-N 2.83Å; M142-L145 PolarHBondContact O-N 3.36Å; L145-W147 VanDerWaalsContact C-N 3.3Å; L145-W147 PolarHBondContact O-N 2.71Å; L145-I148 PolarHBondContact O-N 3.35Å; L145-L149 WeakPolarHBondContact O-CB 3.4Å; L145-L149 PolarHBondContact O-N 3.04Å; L145-N315 HydrophobicContact CD2-CB 4.24Å; L145-I473 HydrophobicContact CD1-CD1 3.37Å; L145-I473 HydrophobicContact CG-CD1 3.95Å; L145-T477 HydrophobicContact CD1-CG2 3.84Å; L145-P478 HydrophobicContact CD2-CB 4.1Å; L145-I481 HydrophobicContact CB-CD1 4.42Å; L145-I481 HydrophobicContact CD2-CD1 3.95Å
146	S	96.7	Very high	96.6	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-59.4	-38.7	173.3	-87.2	0	0	0	0	112.2	M142 V143 L149 V150 N315	M142-S146 WeakPolarHBondContact O-CB 3.48Å; M142-S146 PolarHBondContact O-N 3.4Å; V143-S146 PolarHBondContact O-N 2.96Å; S146-L149 CarbonylContact O-C 3.2Å; S146-L149 WeakPolarHBondContact O-CB 3.45Å; S146-L149 PolarHBondContact O-N 3.32Å; S146-V150 VanDerWaalsContact O-CG2 3.3Å; S146-V150 WeakPolarHBondContact O-CG2 3.47Å; S146-V150 PolarHBondContact O-N 2.76Å; S146-N315 PolarHBondContact OG-O 3.3Å
147	W	97	Very high	96.8	Very high	86 Å²	86	12.4 Å²	12.4	33%	0.326	6%	0.056	S	C	.	.	H	α-helix	trans	-67.1	-43.6	179.1	-161	-5.5	0	0	0	112.1	V143 I144 L145 L149 V150 V151 T419 D450	V143-W147 WeakPolarHBondContact O-CB 3.46Å; V143-W147 PolarHBondContact O-N 3.22Å; I144-W147 PolarHBondContact O-N 3.37Å; L145-W147 VanDerWaalsContact C-N 3.3Å; L145-W147 PolarHBondContact O-N 2.71Å; W147-L149 VanDerWaalsContact C-N 3.27Å; W147-L149 PolarHBondContact O-N 3.1Å; W147-V150 PolarHBondContact O-N 2.94Å; W147-V151 WeakPolarHBondContact O-CG2 3.4Å; W147-V151 PolarHBondContact O-N 3.05Å; W147-T419 HydrophobicContact CB-CG2 3.92Å; W147-T419 HydrophobicContact CD2-CG2 4.05Å; W147-T419 HydrophobicContact CE3-CG2 4.49Å; W147-T419 HydrophobicContact CG-CG2 3.8Å; W147-D450 PolarHBondContact NE1-OD1 3.28Å
148	I	96.2	Very high	96.9	Very high	25 Å²	25	12.5 Å²	12.5	13%	0.128	6%	0.056	C	C	.	.	H	α-helix	trans	-58.2	-46	172.1	-62.9	165.2	0	0	0	109.6	I144 L145 V151 Y152 I473 L558	I144-I148 HydrophobicContact CG2-CD1 4.28Å; I144-I148 WeakPolarHBondContact O-CG1 3.39Å; I144-I148 PolarHBondContact O-N 3.02Å; L145-I148 PolarHBondContact O-N 3.35Å; I148-V151 PolarHBondContact O-N 2.84Å; I148-Y152 WeakPolarHBondContact O-CD1 3.32Å; I148-Y152 PolarHBondContact O-N 3.35Å; I148-Y152 VanDerWaalsContact O-N 3.16Å; I148-I473 HydrophobicContact CB-CD1 4.07Å; I148-I473 HydrophobicContact CG2-CD1 3.86Å; I148-I473 HydrophobicContact CG2-CG1 4.31Å; I148-L558 HydrophobicContact CD1-CD1 3.67Å; I148-L558 HydrophobicContact CD1-CG 4.08Å; I148-L558 HydrophobicContact CG1-CD1 4.18Å
149	L	95.9	Very high	96.9	Very high	8 Å²	8	13.1 Å²	13.1	4%	0.042	6%	0.059	C	C	.	.	H	α-helix	trans	-57.7	-47.2	177.5	172.4	58.6	0	0	0	112.2	L145 S146 W147 V151 Y152 Y153 F309 I415 I473	L145-L149 WeakPolarHBondContact O-CB 3.4Å; L145-L149 PolarHBondContact O-N 3.04Å; S146-L149 CarbonylContact O-C 3.2Å; S146-L149 WeakPolarHBondContact O-CB 3.45Å; S146-L149 PolarHBondContact O-N 3.32Å; W147-L149 VanDerWaalsContact C-N 3.27Å; W147-L149 PolarHBondContact O-N 3.1Å; L149-V151 PolarHBondContact O-N 2.61Å; L149-Y152 HydrophobicContact CB-CE1 4.22Å; L149-Y152 HydrophobicContact CD1-CD1 4.24Å; L149-Y152 HydrophobicContact CD1-CE1 3.3Å; L149-Y152 HydrophobicContact CG-CE1 4.3Å; L149-Y152 WeakPolarHBondContact O-CD1 3.35Å; L149-Y153 HydrophobicContact CD1-CD2 4.32Å; L149-Y153 WeakPolarHBondContact O-CB 3.43Å; L149-Y153 PolarHBondContact O-N 3.35Å; L149-F309 HydrophobicContact CD1-CE2 4.09Å; L149-I415 HydrophobicContact CB-CG2 4.21Å; L149-I415 HydrophobicContact CD1-CD1 4.3Å; L149-I415 HydrophobicContact CD2-CD1 3.98Å; L149-I415 HydrophobicContact CD2-CG1 4.19Å; L149-I415 HydrophobicContact CD2-CG2 3.84Å; L149-I415 HydrophobicContact CG-CD1 3.94Å; L149-I415 HydrophobicContact CG-CG1 4.47Å; L149-I415 HydrophobicContact CG-CG2 3.76Å; L149-I473 HydrophobicContact CB-CD1 4.16Å; L149-I473 HydrophobicContact CB-CG1 4.47Å; L149-I473 HydrophobicContact CD1-CG2 4.34Å
150	V	97.7	Very high	97	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-54.4	-49.8	176.7	163.2	0	0	0	0	111.3	S146 W147 Q154 W237 Q412 I415 L416	S146-V150 VanDerWaalsContact O-CG2 3.3Å; S146-V150 WeakPolarHBondContact O-CG2 3.47Å; S146-V150 PolarHBondContact O-N 2.76Å; W147-V150 PolarHBondContact O-N 2.94Å; V150-Q154 PolarHBondContact O-N 3.35Å; V150-W237 HydrophobicContact CG1-CH2 3.39Å; V150-W237 HydrophobicContact CG1-CZ2 4.1Å; V150-W237 HydrophobicContact CG1-CZ3 4.36Å; V150-Q412 PolarHBondContact O-NE2 3.46Å; V150-I415 HydrophobicContact CB-CG2 4.37Å; V150-I415 HydrophobicContact CG2-CB 3.93Å; V150-I415 HydrophobicContact CG2-CG2 3.33Å; V150-L416 HydrophobicContact CG1-CD1 4.19Å; V150-L416 HydrophobicContact CG2-CB 4.34Å
151	V	97.8	Very high	97	Very high	12 Å²	12	11.8 Å²	11.8	7%	0.073	6%	0.055	C	C	.	.	H	α-helix	trans	-70.2	-46.1	-172.8	-177.8	0	0	0	0	111.1	W147 I148 L149 D450 L453 M457	W147-V151 WeakPolarHBondContact O-CG2 3.4Å; W147-V151 PolarHBondContact O-N 3.05Å; I148-V151 PolarHBondContact O-N 2.84Å; L149-V151 PolarHBondContact O-N 2.61Å; V151-D450 HydrophobicContact CG2-CB 4.25Å; V151-L453 HydrophobicContact CG1-CB 3.88Å; V151-L453 HydrophobicContact CG2-CB 4.21Å; V151-L453 HydrophobicContact CG2-CD1 4.39Å; V151-M457 HydrophobicContact CB-CE 4.46Å; V151-M457 HydrophobicContact CG1-CE 3.6Å
152	Y	94.2	Very high	97.1	Very high	4 Å²	4	13.3 Å²	13.3	2%	0.016	6%	0.061	C	C	.	.	H	α-helix	trans	-75.1	-38.5	-177	100.1	-89.1	0	0	0	112.7	I148 L149 Q154 I155 F309 F466 C469 D470 I473	I148-Y152 WeakPolarHBondContact O-CD1 3.32Å; I148-Y152 PolarHBondContact O-N 3.35Å; I148-Y152 VanDerWaalsContact O-N 3.16Å; L149-Y152 HydrophobicContact CB-CE1 4.22Å; L149-Y152 HydrophobicContact CD1-CD1 4.24Å; L149-Y152 HydrophobicContact CD1-CE1 3.3Å; L149-Y152 HydrophobicContact CG-CE1 4.3Å; L149-Y152 WeakPolarHBondContact O-CD1 3.35Å; Y152-Q154 PolarHBondContact O-N 3.38Å; Y152-I155 VanDerWaalsContact O-CB 3.23Å; Y152-I155 WeakPolarHBondContact O-CB 3.4Å; Y152-I155 WeakPolarHBondContact O-CG1 3.43Å; Y152-I155 PolarHBondContact O-N 2.66Å; Y152-F309 WeakPolarHBondContact OH-CE2 3.41Å; Y152-F309 WeakPolarHBondContact OH-CZ 3.45Å; Y152-F466 HydrophobicContact CD2-CD2 4.1Å; Y152-F466 AromaticContact CD2-CE2 3.58Å; Y152-F466 HydrophobicContact CD2-CE2 3.58Å; Y152-F466 HydrophobicContact CD2-CZ 4.07Å; Y152-F466 HydrophobicContact CE2-CE2 4.24Å; Y152-F466 HydrophobicContact CE2-CZ 4.32Å; Y152-C469 HydrophobicContact CG-CB 4.25Å; Y152-D470 HydrophobicContact CD2-CB 4.48Å; Y152-D470 HydrophobicContact CE2-CB 4.09Å; Y152-D470 PolarHBondContact OH-OD1 2.8Å; Y152-I473 HydrophobicContact CD1-CG1 4.19Å; Y152-I473 HydrophobicContact CE1-CB 4.29Å; Y152-I473 HydrophobicContact CE1-CG1 3.69Å; Y152-I473 HydrophobicContact CE1-CG2 4.46Å
153	Y	96.2	Very high	97.1	Very high	11 Å²	11	13.3 Å²	13.3	4%	0.043	6%	0.061	C	C	.	.	H	α-helix	trans	-63.6	-35.7	-178	-170.4	-88.9	0	0	0	111.1	L77 L149 I155 V156 V157 F309 G408 Q412	L77-Y153 HydrophobicContact CD1-CE1 4.21Å; L77-Y153 HydrophobicContact CD1-CE2 4.38Å; L77-Y153 WeakPolarHBondContact CG-OH 3.48Å; L77-Y153 PolarHBondContact N-OH 3.03Å; L149-Y153 HydrophobicContact CD1-CD2 4.32Å; L149-Y153 WeakPolarHBondContact O-CB 3.43Å; L149-Y153 PolarHBondContact O-N 3.35Å; Y153-I155 PolarHBondContact O-N 2.84Å; Y153-V156 PolarHBondContact O-N 3.48Å; Y153-V156 VanDerWaalsContact O-N 3.08Å; Y153-V157 HydrophobicContact CD1-CG2 3.83Å; Y153-V157 HydrophobicContact CE1-CG2 3.76Å; Y153-V157 PolarHBondContact O-N 3.34Å; Y153-F309 HydrophobicContact CD2-CZ 4.38Å; Y153-F309 HydrophobicContact CE2-CZ 4.32Å; Y153-G408 VanDerWaalsContact CE1-O 3.32Å; Y153-G408 WeakPolarHBondContact CE1-O 3.29Å; Y153-Q412 HydrophobicContact CD1-CB 4.23Å; Y153-Q412 HydrophobicContact CE1-CB 4.39Å
154	Q	97.9	Very high	97.1	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-58.1	-30.3	175.7	-162.8	67.9	74	0	0	113.2	V150 Y152 V156 V157 A158 L233 C236 W237 C240	V150-Q154 PolarHBondContact O-N 3.35Å; Y152-Q154 PolarHBondContact O-N 3.38Å; Q154-V156 VanDerWaalsContact C-N 3.34Å; Q154-V157 PolarHBondContact O-N 3.16Å; Q154-A158 PolarHBondContact O-N 2.64Å; Q154-L233 HydrophobicContact CB-CD1 4.15Å; Q154-L233 HydrophobicContact CG-CD1 3.58Å; Q154-C236 HydrophobicContact CG-CB 4.47Å; Q154-W237 HydrophobicContact CB-CZ2 4.17Å; Q154-W237 HydrophobicContact CG-CD2 4.34Å; Q154-W237 HydrophobicContact CG-CZ2 4.07Å; Q154-C240 PolarHBondContact OE1-SG 2.92Å
155	I	97.5	Very high	97.2	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-61.9	-44.8	177.2	-52.9	-56.9	0	0	0	110.1	Y152 Y153 V157 A158 H159 L233 G454 M457 V458 F466	Y152-I155 VanDerWaalsContact O-CB 3.23Å; Y152-I155 WeakPolarHBondContact O-CB 3.4Å; Y152-I155 WeakPolarHBondContact O-CG1 3.43Å; Y152-I155 PolarHBondContact O-N 2.66Å; Y153-I155 PolarHBondContact O-N 2.84Å; I155-V157 VanDerWaalsContact C-N 3.33Å; I155-V157 PolarHBondContact O-N 3.32Å; I155-A158 WeakPolarHBondContact O-CB 3.38Å; I155-A158 PolarHBondContact O-N 3.45Å; I155-H159 PolarHBondContact O-N 2.97Å; I155-H159 VanDerWaalsContact O-N 3.11Å; I155-H159 PolarHBondContact O-ND1 2.86Å; I155-L233 HydrophobicContact CD1-CD1 4Å; I155-L233 HydrophobicContact CD1-CD2 4.03Å; I155-G454 WeakPolarHBondContact CD1-O 3.38Å; I155-M457 HydrophobicContact CD1-CB 3.89Å; I155-M457 HydrophobicContact CD1-CE 4.19Å; I155-M457 HydrophobicContact CG1-CB 3.82Å; I155-M457 HydrophobicContact CG1-CE 3.82Å; I155-M457 HydrophobicContact CG1-SD 4.18Å; I155-M457 HydrophobicContact CG2-CB 4.46Å; I155-V458 HydrophobicContact CD1-CG1 4.04Å; I155-V458 HydrophobicContact CG2-CG1 4.47Å; I155-F466 HydrophobicContact CB-CD2 4.06Å; I155-F466 HydrophobicContact CB-CE2 4.26Å; I155-F466 HydrophobicContact CG1-CD2 4.49Å; I155-F466 HydrophobicContact CG2-CD2 4.11Å
156	V	95.4	Very high	97.3	Very high	7 Å²	7	15.9 Å²	15.9	4%	0.042	8%	0.083	C	C	.	.	H	α-helix	trans	-64.9	-40.2	176.9	-170	0	0	0	0	111.2	L77 W81 Y153 Q154 A158 H159 C160 F380 F466	L77-V156 HydrophobicContact CD1-CB 4.04Å; L77-V156 HydrophobicContact CD1-CG1 3.6Å; W81-V156 HydrophobicContact CH2-CG1 3.37Å; W81-V156 HydrophobicContact CH2-CG2 4.32Å; W81-V156 HydrophobicContact CZ2-CG1 3.67Å; W81-V156 HydrophobicContact CZ2-CG2 4.5Å; W81-V156 HydrophobicContact CZ3-CG1 4.33Å; Y153-V156 PolarHBondContact O-N 3.48Å; Y153-V156 VanDerWaalsContact O-N 3.08Å; Q154-V156 VanDerWaalsContact C-N 3.34Å; V156-A158 VanDerWaalsContact C-N 3.27Å; V156-A158 PolarHBondContact O-N 3.27Å; V156-H159 WeakPolarHBondContact O-CB 3.12Å; V156-H159 PolarHBondContact O-N 3.34Å; V156-H159 VanDerWaalsContact O-N 3.14Å; V156-C160 PolarHBondContact O-N 3.48Å; V156-C160 PolarHBondContact O-SG 3.44Å; V156-C160 VanDerWaalsContact O-SG 3.4Å; V156-F380 HydrophobicContact CG1-CE2 3.86Å; V156-F380 HydrophobicContact CG1-CZ 3.95Å; V156-F466 HydrophobicContact CG2-CE2 3.47Å; V156-F466 VanDerWaalsContact CG2-CE2 3.47Å; V156-F466 HydrophobicContact CG2-CZ 3.45Å; V156-F466 VanDerWaalsContact CG2-CZ 3.45Å
157	V	97.9	Very high	97.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.5	-37.9	175.7	-176.2	0	0	0	0	111.2	L77 Y153 Q154 I155 C160 L161 L405 L409	L77-V157 HydrophobicContact CD1-CG2 4.41Å; Y153-V157 HydrophobicContact CD1-CG2 3.83Å; Y153-V157 HydrophobicContact CE1-CG2 3.76Å; Y153-V157 PolarHBondContact O-N 3.34Å; Q154-V157 PolarHBondContact O-N 3.16Å; I155-V157 VanDerWaalsContact C-N 3.33Å; I155-V157 PolarHBondContact O-N 3.32Å; V157-C160 WeakPolarHBondContact O-CB 3.24Å; V157-C160 PolarHBondContact O-N 2.85Å; V157-L161 PolarHBondContact O-N 2.93Å; V157-L405 HydrophobicContact CG1-CD1 3.68Å; V157-L409 HydrophobicContact CG1-CD2 3.84Å; V157-L409 HydrophobicContact CG1-CG 3.91Å
158	A	98.3	Very high	97.4	Very high	1 Å²	1	19 Å²	19	1%	0.008	10%	0.099	C	C	.	.	H	α-helix	trans	-64.6	-37.7	174.9	0	0	0	0	0	112.2	Q154 I155 V156 L161 Y162 C232 L233	Q154-A158 PolarHBondContact O-N 2.64Å; I155-A158 WeakPolarHBondContact O-CB 3.38Å; I155-A158 PolarHBondContact O-N 3.45Å; V156-A158 VanDerWaalsContact C-N 3.27Å; V156-A158 PolarHBondContact O-N 3.27Å; A158-L161 PolarHBondContact O-N 2.87Å; A158-Y162 PolarHBondContact O-N 3.31Å; A158-C232 HydrophobicContact CB-CB 4.15Å; A158-L233 HydrophobicContact CB-CB 4.13Å; A158-L233 HydrophobicContact CB-CD1 4.33Å
159	H	97.5	Very high	97.3	Very high	14 Å²	14	20.3 Å²	20.3	7%	0.065	11%	0.108	C	C	.	.	H	α-helix	trans	-62.8	-41.9	171	-67.1	92.5	0	0	0	111.5	I155 V156 L161 Y162 F163 Y208 F380	I155-H159 PolarHBondContact O-N 2.97Å; I155-H159 VanDerWaalsContact O-N 3.11Å; I155-H159 PolarHBondContact O-ND1 2.86Å; V156-H159 WeakPolarHBondContact O-CB 3.12Å; V156-H159 PolarHBondContact O-N 3.34Å; V156-H159 VanDerWaalsContact O-N 3.14Å; H159-L161 VanDerWaalsContact C-N 3.29Å; H159-L161 PolarHBondContact O-N 2.72Å; H159-Y162 PolarHBondContact O-N 3.08Å; H159-F163 WeakPolarHBondContact O-CD2 3.43Å; H159-F163 PolarHBondContact O-N 3.27Å; H159-Y208 AromaticContact CD2-CE2 3.87Å; H159-F380 HydrophobicContact CB-CD1 4.4Å; H159-F380 HydrophobicContact CB-CE1 3.78Å; H159-F380 HydrophobicContact CB-CE2 4.24Å; H159-F380 HydrophobicContact CB-CZ 3.69Å
160	C	97.7	Very high	97.2	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.1	-42.2	174	-61	0	0	0	0	112	V156 V157 L164 M404 L405	V156-C160 PolarHBondContact O-N 3.48Å; V156-C160 PolarHBondContact O-SG 3.44Å; V156-C160 VanDerWaalsContact O-SG 3.4Å; V157-C160 WeakPolarHBondContact O-CB 3.24Å; V157-C160 PolarHBondContact O-N 2.85Å; C160-L164 WeakPolarHBondContact O-CB 3.19Å; C160-L164 PolarHBondContact O-N 3.21Å; C160-M404 HydrophobicContact CB-CB 4.38Å; C160-L405 HydrophobicContact CB-CB 4.15Å; C160-L405 HydrophobicContact CB-CD1 4.45Å
161	L	98.5	Very high	97.1	Very high	20 Å²	20	33.6 Å²	33.6	11%	0.105	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-42.5	176.6	-179.4	59.7	0	0	0	112	V157 A158 H159 F163 L164 C165 C232 T235 L405	V157-L161 PolarHBondContact O-N 2.93Å; A158-L161 PolarHBondContact O-N 2.87Å; H159-L161 VanDerWaalsContact C-N 3.29Å; H159-L161 PolarHBondContact O-N 2.72Å; L161-F163 PolarHBondContact O-N 2.88Å; L161-L164 PolarHBondContact O-N 2.93Å; L161-C165 PolarHBondContact O-N 3.26Å; L161-C165 PolarHBondContact O-SG 3.42Å; L161-C165 VanDerWaalsContact O-SG 3.39Å; L161-C232 HydrophobicContact CB-CB 4.43Å; L161-C232 HydrophobicContact CD2-CB 4.18Å; L161-C232 HydrophobicContact CG-CB 4.41Å; L161-T235 HydrophobicContact CD2-CG2 3.79Å; L161-L405 HydrophobicContact CB-CD1 4.06Å; L161-L405 HydrophobicContact CD1-CD2 3.9Å
162	Y	98.4	Very high	97	Very high	31 Å²	31	33.2 Å²	33.2	12%	0.122	18%	0.175	C	C	.	.	H	α-helix	trans	-56.6	-52.2	175.9	-179.9	-81.7	0	0	0	111.1	A158 H159 L164 C165 A166 Y207 V212 L229	A158-Y162 PolarHBondContact O-N 3.31Å; H159-Y162 PolarHBondContact O-N 3.08Å; Y162-L164 PolarHBondContact O-N 2.84Å; Y162-C165 PolarHBondContact O-N 3.11Å; Y162-A166 HydrophobicContact CE1-CB 4.44Å; Y162-A166 WeakPolarHBondContact O-CB 3.49Å; Y162-A166 PolarHBondContact O-N 3.23Å; Y162-Y207 HydrophobicContact CE1-CE1 4.11Å; Y162-Y207 WeakPolarHBondContact CE1-OH 3.44Å; Y162-Y207 PolarHBondContact OH-OH 3.23Å; Y162-V212 HydrophobicContact CD1-CB 4.45Å; Y162-V212 HydrophobicContact CD1-CG1 3.73Å; Y162-V212 HydrophobicContact CD1-CG2 3.88Å; Y162-V212 HydrophobicContact CD2-CG1 4.45Å; Y162-V212 HydrophobicContact CE1-CB 4.14Å; Y162-V212 HydrophobicContact CE1-CG1 3.87Å; Y162-V212 HydrophobicContact CE1-CG2 3.32Å; Y162-V212 HydrophobicContact CG-CG1 4.05Å; Y162-L229 HydrophobicContact CD2-CD2 4.17Å; Y162-L229 HydrophobicContact CG-CD2 4.3Å
163	F	98.1	Very high	97.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-40.1	179.6	-88.1	-95.4	0	0	0	111.8	H159 L161 C165 A166 S167 W174 Y207 Y208 V212 F380 P384 F401	H159-F163 WeakPolarHBondContact O-CD2 3.43Å; H159-F163 PolarHBondContact O-N 3.27Å; L161-F163 PolarHBondContact O-N 2.88Å; F163-C165 VanDerWaalsContact C-N 3.32Å; F163-C165 PolarHBondContact O-N 3.24Å; F163-A166 CarbonylContact O-C 3.33Å; F163-A166 PolarHBondContact O-N 2.66Å; F163-A166 VanDerWaalsContact O-N 3.13Å; F163-S167 PolarHBondContact O-N 3.44Å; F163-S167 PolarHBondContact O-OG 3.33Å; F163-W174 HydrophobicContact CD1-CE3 4Å; F163-W174 AromaticContact CD1-CH2 3.59Å; F163-W174 HydrophobicContact CD1-CH2 3.59Å; F163-W174 HydrophobicContact CD1-CZ2 4.21Å; F163-W174 AromaticContact CD1-CZ3 3.47Å; F163-W174 HydrophobicContact CD1-CZ3 3.47Å; F163-W174 VanDerWaalsContact CD1-CZ3 3.47Å; F163-W174 HydrophobicContact CE1-CD2 4.27Å; F163-W174 AromaticContact CE1-CE3 3.84Å; F163-W174 HydrophobicContact CE1-CE3 3.84Å; F163-W174 HydrophobicContact CE1-CH2 4.24Å; F163-W174 AromaticContact CE1-CZ3 3.81Å; F163-W174 HydrophobicContact CE1-CZ3 3.81Å; F163-W174 HydrophobicContact CG-CZ3 4.45Å; F163-Y207 HydrophobicContact CE1-CD1 4.17Å; F163-Y207 HydrophobicContact CE1-CE1 4.17Å; F163-Y207 HydrophobicContact CZ-CD1 4.15Å; F163-Y207 HydrophobicContact CZ-CE1 4.25Å; F163-Y208 AromaticContact CE2-CD2 3.72Å; F163-Y208 HydrophobicContact CE2-CD2 3.72Å; F163-Y208 HydrophobicContact CE2-CE2 4.17Å; F163-Y208 AromaticContact CZ-CD2 3.86Å; F163-Y208 HydrophobicContact CZ-CD2 3.86Å; F163-V212 HydrophobicContact CE2-CG1 4.34Å; F163-V212 HydrophobicContact CE2-CG2 4.1Å; F163-V212 HydrophobicContact CZ-CG2 4.22Å; F163-F380 AromaticContact CD2-CD1 3.64Å; F163-F380 HydrophobicContact CD2-CD1 3.64Å; F163-F380 HydrophobicContact CD2-CE1 4.19Å; F163-F380 HydrophobicContact CE2-CB 4.07Å; F163-F380 AromaticContact CE2-CD1 3.73Å; F163-F380 HydrophobicContact CE2-CD1 3.73Å; F163-F380 HydrophobicContact CE2-CG 4.25Å; F163-F380 HydrophobicContact CG-CD1 4.21Å; F163-F380 HydrophobicContact CZ-CB 4.07Å; F163-F380 HydrophobicContact CZ-CD1 4.36Å; F163-P384 HydrophobicContact CD1-CG 4.49Å; F163-P384 HydrophobicContact CE1-CG 4.21Å; F163-F401 HydrophobicContact CB-CD1 3.57Å; F163-F401 HydrophobicContact CB-CD2 3.74Å; F163-F401 HydrophobicContact CB-CE1 3.44Å; F163-F401 VanDerWaalsContact CB-CE1 3.44Å; F163-F401 HydrophobicContact CB-CE2 3.61Å; F163-F401 HydrophobicContact CB-CG 3.72Å; F163-F401 HydrophobicContact CB-CZ 3.45Å; F163-F401 VanDerWaalsContact CB-CZ 3.45Å; F163-F401 HydrophobicContact CD1-CE1 4.11Å; F163-F401 AromaticContact CD1-CE2 3.67Å; F163-F401 HydrophobicContact CD1-CE2 3.67Å; F163-F401 AromaticContact CD1-CZ 3.38Å; F163-F401 HydrophobicContact CD1-CZ 3.38Å; F163-F401 HydrophobicContact CD2-CE1 4.49Å; F163-F401 HydrophobicContact CD2-CZ 4.5Å; F163-F401 HydrophobicContact CE1-CZ 4.24Å; F163-F401 HydrophobicContact CG-CD1 4.41Å; F163-F401 AromaticContact CG-CE1 3.78Å; F163-F401 HydrophobicContact CG-CE1 3.78Å; F163-F401 AromaticContact CG-CE2 3.99Å; F163-F401 HydrophobicContact CG-CE2 3.99Å; F163-F401 AromaticContact CG-CZ 3.53Å; F163-F401 HydrophobicContact CG-CZ 3.53Å
164	L	98.1	Very high	97.1	Very high	17 Å²	17	34.5 Å²	34.5	9%	0.089	19%	0.185	C	C	.	.	H	α-helix	trans	-56.3	-46.1	174.2	177.5	59.3	0	0	0	111.7	C160 L161 Y162 S167 F168 V398 F401 I402 L405	C160-L164 WeakPolarHBondContact O-CB 3.19Å; C160-L164 PolarHBondContact O-N 3.21Å; L161-L164 PolarHBondContact O-N 2.93Å; Y162-L164 PolarHBondContact O-N 2.84Å; L164-S167 WeakPolarHBondContact O-CB 3.22Å; L164-S167 PolarHBondContact O-N 3.18Å; L164-F168 HydrophobicContact CD1-CE2 4.01Å; L164-F168 HydrophobicContact CD1-CZ 4.47Å; L164-F168 HydrophobicContact CG-CE2 4.2Å; L164-F168 WeakPolarHBondContact O-CD2 3.44Å; L164-F168 WeakPolarHBondContact O-CE2 3.5Å; L164-V398 HydrophobicContact CD1-CG1 4.14Å; L164-F401 HydrophobicContact CB-CB 3.88Å; L164-F401 HydrophobicContact CD1-CB 4.3Å; L164-I402 HydrophobicContact CD1-CB 4.07Å; L164-I402 HydrophobicContact CD2-CB 4.34Å; L164-I402 HydrophobicContact CD2-CG1 4.42Å; L164-L405 HydrophobicContact CD2-CD2 3.63Å
165	C	98.2	Very high	96.9	Very high	81 Å²	81	35.9 Å²	35.9	55%	0.547	19%	0.193	S	C	.	.	H	α-helix	trans	-63	-42.8	176	-69.7	0	0	0	0	111.7	L161 Y162 F163 S167 F168	L161-C165 PolarHBondContact O-N 3.26Å; L161-C165 PolarHBondContact O-SG 3.42Å; L161-C165 VanDerWaalsContact O-SG 3.39Å; Y162-C165 PolarHBondContact O-N 3.11Å; F163-C165 VanDerWaalsContact C-N 3.32Å; F163-C165 PolarHBondContact O-N 3.24Å; C165-S167 PolarHBondContact O-N 3.05Å; C165-F168 PolarHBondContact O-N 3.36Å
166	A	97.7	Very high	96.7	Very high	15 Å²	15	37.8 Å²	37.8	12%	0.124	20%	0.204	C	C	.	.	H	α-helix	trans	-67.7	-21.4	177.8	0	0	0	0	0	113.6	Y162 F163 F168 T169 P173 W174	Y162-A166 HydrophobicContact CE1-CB 4.44Å; Y162-A166 WeakPolarHBondContact O-CB 3.49Å; Y162-A166 PolarHBondContact O-N 3.23Å; F163-A166 CarbonylContact O-C 3.33Å; F163-A166 PolarHBondContact O-N 2.66Å; F163-A166 VanDerWaalsContact O-N 3.13Å; A166-F168 VanDerWaalsContact C-N 3.29Å; A166-F168 PolarHBondContact O-N 3.11Å; A166-T169 PolarHBondContact O-OG1 2.98Å; A166-P173 HydrophobicContact CB-CG 4.3Å; A166-P173 WeakPolarHBondContact O-CD 3.47Å; A166-W174 HydrophobicContact CB-CH2 4.41Å; A166-W174 HydrophobicContact CB-CZ3 3.79Å
167	S	97.9	Very high	96.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-16.1	176.7	-57.4	0	0	0	0	114.1	F163 L164 C165 T169 S397	F163-S167 PolarHBondContact O-N 3.44Å; F163-S167 PolarHBondContact O-OG 3.33Å; L164-S167 WeakPolarHBondContact O-CB 3.22Å; L164-S167 PolarHBondContact O-N 3.18Å; C165-S167 PolarHBondContact O-N 3.05Å; S167-T169 PolarHBondContact O-N 3.47Å; S167-S397 WeakPolarHBondContact CB-OG 3.49Å; S167-S397 PolarHBondContact OG-OG 3.07Å
168	F	97.1	Very high	96.4	Very high	150 Å²	150	41.7 Å²	41.7	66%	0.658	23%	0.225	S	C	*	.	S	Bend	trans	-80.6	48.7	178.7	-71.3	-77.7	0	0	0	112.7	L164 C165 A166 V398	L164-F168 HydrophobicContact CD1-CE2 4.01Å; L164-F168 HydrophobicContact CD1-CZ 4.47Å; L164-F168 HydrophobicContact CG-CE2 4.2Å; L164-F168 WeakPolarHBondContact O-CD2 3.44Å; L164-F168 WeakPolarHBondContact O-CE2 3.5Å; C165-F168 PolarHBondContact O-N 3.36Å; A166-F168 VanDerWaalsContact C-N 3.29Å; A166-F168 PolarHBondContact O-N 3.11Å; F168-V398 HydrophobicContact CD1-CG2 4.24Å; F168-V398 HydrophobicContact CE1-CG1 4.24Å; F168-V398 HydrophobicContact CE1-CG2 4.07Å; F168-V398 HydrophobicContact CE2-CG2 4.47Å; F168-V398 HydrophobicContact CZ-CG1 3.98Å; F168-V398 HydrophobicContact CZ-CG2 4.2Å
169	T	96.1	Very high	96	Very high	54 Å²	54	47.7 Å²	47.7	33%	0.331	27%	0.265	S	S	.	.	S	Bend	trans	-127.9	156.8	175.7	60.6	0	0	0	0	109.9	A166 S167 R171 S394	A166-T169 PolarHBondContact O-OG1 2.98Å; S167-T169 PolarHBondContact O-N 3.47Å; T169-R171 WeakPolarHBondContact CB-O 3.36Å; T169-R171 PolarHBondContact OG1-O 3.31Å; T169-S394 WeakPolarHBondContact O-CB 3.39Å; T169-S394 PolarHBondContact O-OG 3.28Å
170	S	92.9	Very high	95.9	Very high	127 Å²	127	51.3 Å²	51.3	89%	0.888	29%	0.291	S	S	*	.	S	Bend	trans	-70	-34.7	175.9	53.1	0	0	0	0	112.6	S394	S170-S394 PolarHBondContact O-OG 3.46Å
171	R	94.6	Very high	95.7	Very high	159 Å²	159	52.5 Å²	52.5	60%	0.6	30%	0.296	S	S	*	.	S	Bend	trans	-121.5	127.5	173	-167.7	174.4	-171.4	173.3	3.3	107.9	T169 T175 D176	T169-R171 WeakPolarHBondContact CB-O 3.36Å; T169-R171 PolarHBondContact OG1-O 3.31Å; R171-T175 HydrophobicContact CG-CG2 4.27Å; R171-D176 IonicContact CZ-OD1 2.72Å; R171-D176 IonicContact CZ-OD2 2.7Å; R171-D176 IonicContact NE-OD2 3.63Å; R171-D176 PolarHBondContact NE-OD2 2.95Å; R171-D176 IonicContact NH1-OD2 2.72Å; R171-D176 IonicContact NH2-OD1 3.01Å; R171-D176 PolarHBondContact NH2-OD1 3.23Å; R171-D176 IonicContact NH2-OD2 3.76Å; R171-D176 PolarHBondContact NH2-OD2 2.79Å
172	L	97	Very high	95.5	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	30%	0.298	C	S	.	.			trans	-66.8	140.3	-175.2	-65.6	171.7	0	0	0	109.8	W174 T175 P393	L172-W174 HydrophobicContact CB-CD2 4.26Å; L172-W174 HydrophobicContact CB-CZ2 4.11Å; L172-W174 HydrophobicContact CD1-CZ2 3.9Å; L172-W174 HydrophobicContact CD2-CH2 4.12Å; L172-W174 HydrophobicContact CD2-CZ2 3.75Å; L172-W174 HydrophobicContact CG-CZ2 4.14Å; L172-W174 PolarHBondContact O-N 3.49Å; L172-W174 VanDerWaalsContact O-N 3.12Å; L172-T175 WeakPolarHBondContact CB-OG1 3.37Å; L172-T175 VanDerWaalsContact O-CB 3.28Å; L172-T175 WeakPolarHBondContact O-CB 3.19Å; L172-T175 PolarHBondContact O-N 2.8Å; L172-T175 PolarHBondContact O-OG1 2.87Å; L172-T175 VanDerWaalsContact O-OG1 3.08Å; L172-P393 HydrophobicContact CD1-CB 3.54Å; L172-P393 HydrophobicContact CG-CB 4.13Å
173	P	96.4	Very high	95.2	Very high	43 Å²	43	52.4 Å²	52.4	28%	0.279	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.2	-176.4	-27.6	37.1	0	0	0	114.5	A166 W181 Y207	A166-P173 HydrophobicContact CB-CG 4.3Å; A166-P173 WeakPolarHBondContact O-CD 3.47Å; P173-W181 WeakPolarHBondContact O-CZ2 3.37Å; P173-Y207 HydrophobicContact CB-CD2 4.33Å; P173-Y207 HydrophobicContact CB-CE2 3.57Å
174	W	95.5	Very high	94.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	17.9	177.6	55.4	80.6	0	0	0	113.6	F163 A166 L172 Y207 P384 S397 F401	F163-W174 HydrophobicContact CD1-CE3 4Å; F163-W174 AromaticContact CD1-CH2 3.59Å; F163-W174 HydrophobicContact CD1-CH2 3.59Å; F163-W174 HydrophobicContact CD1-CZ2 4.21Å; F163-W174 AromaticContact CD1-CZ3 3.47Å; F163-W174 HydrophobicContact CD1-CZ3 3.47Å; F163-W174 VanDerWaalsContact CD1-CZ3 3.47Å; F163-W174 HydrophobicContact CE1-CD2 4.27Å; F163-W174 AromaticContact CE1-CE3 3.84Å; F163-W174 HydrophobicContact CE1-CE3 3.84Å; F163-W174 HydrophobicContact CE1-CH2 4.24Å; F163-W174 AromaticContact CE1-CZ3 3.81Å; F163-W174 HydrophobicContact CE1-CZ3 3.81Å; F163-W174 HydrophobicContact CG-CZ3 4.45Å; A166-W174 HydrophobicContact CB-CH2 4.41Å; A166-W174 HydrophobicContact CB-CZ3 3.79Å; L172-W174 HydrophobicContact CB-CD2 4.26Å; L172-W174 HydrophobicContact CB-CZ2 4.11Å; L172-W174 HydrophobicContact CD1-CZ2 3.9Å; L172-W174 HydrophobicContact CD2-CH2 4.12Å; L172-W174 HydrophobicContact CD2-CZ2 3.75Å; L172-W174 HydrophobicContact CG-CZ2 4.14Å; L172-W174 PolarHBondContact O-N 3.49Å; L172-W174 VanDerWaalsContact O-N 3.12Å; W174-Y207 HydrophobicContact CB-CD1 3.97Å; W174-Y207 HydrophobicContact CB-CD2 4.44Å; W174-Y207 HydrophobicContact CB-CG 3.8Å; W174-Y207 HydrophobicContact CD2-CD1 4.43Å; W174-Y207 AromaticContact CE3-CD1 3.75Å; W174-Y207 HydrophobicContact CE3-CD1 3.75Å; W174-Y207 AromaticContact CE3-CE1 3.48Å; W174-Y207 HydrophobicContact CE3-CE1 3.48Å; W174-Y207 VanDerWaalsContact CE3-CE1 3.48Å; W174-Y207 HydrophobicContact CZ3-CE1 4.02Å; W174-P384 HydrophobicContact CD2-CB 4.31Å; W174-P384 HydrophobicContact CG-CB 4.27Å; W174-P384 HydrophobicContact CZ2-CB 4.35Å; W174-P384 PolarHBondContact NE1-O 2.95Å; W174-S397 WeakPolarHBondContact CZ2-OG 3.37Å; W174-F401 HydrophobicContact CH2-CE2 4.26Å; W174-F401 HydrophobicContact CZ2-CE2 4.23Å
175	T	94.7	Very high	94.2	Very high	28 Å²	28	59.9 Å²	59.9	17%	0.172	35%	0.348	C	S	.	.	S	Bend	trans	-74.7	-38.5	176.2	-66.7	0	0	0	0	112.4	R171 L172 T388	R171-T175 HydrophobicContact CG-CG2 4.27Å; L172-T175 WeakPolarHBondContact CB-OG1 3.37Å; L172-T175 VanDerWaalsContact O-CB 3.28Å; L172-T175 WeakPolarHBondContact O-CB 3.19Å; L172-T175 PolarHBondContact O-N 2.8Å; L172-T175 PolarHBondContact O-OG1 2.87Å; L172-T175 VanDerWaalsContact O-OG1 3.08Å; T175-T388 HydrophobicContact CG2-CG2 3.63Å
176	D	93.1	Very high	93.8	Very high	42 Å²	42	56 Å²	56	23%	0.225	32%	0.321	C	S	.	.	S	Bend	trans	-128.4	157.8	-174.2	-50.2	-82	0	0	0	110.8	R171 D178 W181	R171-D176 IonicContact CZ-OD1 2.72Å; R171-D176 IonicContact CZ-OD2 2.7Å; R171-D176 IonicContact NE-OD2 3.63Å; R171-D176 PolarHBondContact NE-OD2 2.95Å; R171-D176 IonicContact NH1-OD2 2.72Å; R171-D176 IonicContact NH2-OD1 3.01Å; R171-D176 PolarHBondContact NH2-OD1 3.23Å; R171-D176 IonicContact NH2-OD2 3.76Å; R171-D176 PolarHBondContact NH2-OD2 2.79Å; D176-D178 PolarHBondContact O-N 3.16Å; D176-W181 VanDerWaalsContact O-CH2 3.24Å; D176-W181 WeakPolarHBondContact O-CH2 3.48Å; D176-W181 WeakPolarHBondContact O-CZ2 3.35Å
177	C	92.8	Very high	93.2	Very high	18 Å²	18	56.2 Å²	56.2	12%	0.122	32%	0.32	C	S	.	.			trans	-73.4	123.5	174.3	-60.1	0	0	0	0	110	C186 M187 D188	C177-C186 HydrophobicContact CB-CB 3.85Å; C177-C186 WeakPolarHBondContact CB-SG 3.48Å; C177-C186 WeakPolarHBondContact SG-CB 3.41Å; C177-C186 CovalentContact SG-SG 2.03Å; C177-C186 PolarHBondContact SG-SG 3.27Å; C177-M187 PolarHBondContact SG-N 3.04Å; C177-D188 WeakPolarHBondContact CB-OD2 3.43Å; C177-D188 PolarHBondContact N-OD2 3.08Å
178	D	92.7	Very high	92.6	Very high	71 Å²	71	57 Å²	57	38%	0.38	32%	0.324	S	S	.	.			trans	-108.1	130.9	176.1	-168.3	-59.5	0	0	0	111	D176 S180 W181 S182	D176-D178 PolarHBondContact O-N 3.16Å; D178-S180 VanDerWaalsContact CG-OG 3.24Å; D178-S180 PolarHBondContact O-N 3.05Å; D178-S180 VanDerWaalsContact OD1-CB 3.27Å; D178-S180 WeakPolarHBondContact OD1-CB 3.42Å; D178-S180 PolarHBondContact OD1-N 3.35Å; D178-S180 PolarHBondContact OD1-OG 3.36Å; D178-W181 HydrophobicContact CB-CD2 4.29Å; D178-W181 HydrophobicContact CB-CZ2 3.71Å; D178-W181 PolarHBondContact O-N 2.94Å; D178-S182 PolarHBondContact N-OG 3.16Å; D178-S182 WeakPolarHBondContact O-CA 3.27Å; D178-S182 WeakPolarHBondContact O-CB 3.27Å; D178-S182 PolarHBondContact O-N 2.91Å; D178-S182 PolarHBondContact O-OG 2.72Å
179	P	91.1	Very high	91.8	Very high	128 Å²	128	55 Å²	55	83%	0.831	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-21	178	-25.6	34.7	0	0	0	115.6
180	S	94.3	Very high	90.9	Very high	89 Å²	89	56.8 Å²	56.8	62%	0.622	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-27.7	-179.7	58	0	0	0	0	114.1	D178	D178-S180 VanDerWaalsContact CG-OG 3.24Å; D178-S180 PolarHBondContact O-N 3.05Å; D178-S180 VanDerWaalsContact OD1-CB 3.27Å; D178-S180 WeakPolarHBondContact OD1-CB 3.42Å; D178-S180 PolarHBondContact OD1-N 3.35Å; D178-S180 PolarHBondContact OD1-OG 3.36Å
181	W	95.2	Very high	89.9	Confident	26 Å²	26	55.3 Å²	55.3	10%	0.098	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140	-18.2	-177	53.8	-103.8	0	0	0	114.6	P173 D176 D178 P203 D206 Y207 N210 E211	P173-W181 WeakPolarHBondContact O-CZ2 3.37Å; D176-W181 VanDerWaalsContact O-CH2 3.24Å; D176-W181 WeakPolarHBondContact O-CH2 3.48Å; D176-W181 WeakPolarHBondContact O-CZ2 3.35Å; D178-W181 HydrophobicContact CB-CD2 4.29Å; D178-W181 HydrophobicContact CB-CZ2 3.71Å; D178-W181 PolarHBondContact O-N 2.94Å; W181-P203 HydrophobicContact CH2-CB 4.26Å; W181-P203 VanDerWaalsContact CZ3-O 3.29Å; W181-P203 WeakPolarHBondContact CZ3-O 3.45Å; W181-D206 HydrophobicContact CE3-CB 3.96Å; W181-D206 HydrophobicContact CZ3-CB 3.77Å; W181-Y207 HydrophobicContact CD2-CD2 4.26Å; W181-Y207 AromaticContact CE2-CD2 3.85Å; W181-Y207 HydrophobicContact CH2-CD2 4.38Å; W181-Y207 AromaticContact CZ2-CD2 3.93Å; W181-Y207 HydrophobicContact CZ2-CD2 3.93Å; W181-Y207 VanDerWaalsContact CZ3-N 3.33Å; W181-N210 HydrophobicContact CB-CB 4.43Å; W181-N210 WeakPolarHBondContact O-CB 3.45Å; W181-N210 PolarHBondContact O-ND2 3.36Å; W181-E211 HydrophobicContact CB-CB 3.79Å; W181-E211 HydrophobicContact CD2-CB 4.37Å; W181-E211 HydrophobicContact CG-CB 3.81Å; W181-E211 HydrophobicContact CG-CG 4.36Å
182	S	93.7	Very high	88.1	Confident	21 Å²	21	51.8 Å²	51.8	15%	0.147	33%	0.329	C	S	.	.			trans	-76.5	140.3	-177.7	68.5	0	0	0	0	112.1	D178	D178-S182 PolarHBondContact N-OG 3.16Å; D178-S182 WeakPolarHBondContact O-CA 3.27Å; D178-S182 WeakPolarHBondContact O-CB 3.27Å; D178-S182 PolarHBondContact O-N 2.91Å; D178-S182 PolarHBondContact O-OG 2.72Å
183	S	91.8	Very high	86.4	Confident	28 Å²	28	57.2 Å²	57.2	20%	0.196	36%	0.358	C	S	.	.			trans	-74.5	162.8	172.5	75.3	0	0	0	0	110.8	N185 C186 D206	S183-N185 PolarHBondContact O-N 3.18Å; S183-N185 VanDerWaalsContact O-N 3.08Å; S183-N185 PolarHBondContact OG-N 3.02Å; S183-C186 VanDerWaalsContact O-CB 3.29Å; S183-C186 WeakPolarHBondContact O-CB 3.39Å; S183-C186 PolarHBondContact O-N 3.13Å; S183-C186 VanDerWaalsContact O-N 3.07Å; S183-D206 WeakPolarHBondContact CA-OD2 3.34Å; S183-D206 WeakPolarHBondContact CB-OD2 3.38Å; S183-D206 PolarHBondContact N-OD2 3.04Å; S183-D206 PolarHBondContact OG-OD2 3.45Å
184	P	88.5	Confident	84.7	Confident	111 Å²	111	61.9 Å²	61.9	72%	0.721	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.2	173.1	-26	35.6	0	0	0	113.7	C186 R191	P184-C186 VanDerWaalsContact C-N 3.34Å; P184-R191 PolarHBondContact O-NH1 2.94Å; P184-R191 VanDerWaalsContact O-NH1 3.15Å
185	N	87.8	Confident	83.3	Confident	63 Å²	63	67.9 Å²	67.9	34%	0.337	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.9	-177.7	-63.2	-14.3	0	0	0	113.8	S183 M187 I197 K201	S183-N185 PolarHBondContact O-N 3.18Å; S183-N185 VanDerWaalsContact O-N 3.08Å; S183-N185 PolarHBondContact OG-N 3.02Å; N185-M187 PolarHBondContact O-N 3.47Å; N185-I197 HydrophobicContact CB-CG2 3.91Å; N185-K201 PolarHBondContact O-N 3.44Å
186	C	88.9	Confident	82.1	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-60.9	133.5	175.9	-174.3	0	0	0	0	111	C177 S183 P184 R191 D206	C177-C186 HydrophobicContact CB-CB 3.85Å; C177-C186 WeakPolarHBondContact CB-SG 3.48Å; C177-C186 WeakPolarHBondContact SG-CB 3.41Å; C177-C186 CovalentContact SG-SG 2.03Å; C177-C186 PolarHBondContact SG-SG 3.27Å; S183-C186 VanDerWaalsContact O-CB 3.29Å; S183-C186 WeakPolarHBondContact O-CB 3.39Å; S183-C186 PolarHBondContact O-N 3.13Å; S183-C186 VanDerWaalsContact O-N 3.07Å; P184-C186 VanDerWaalsContact C-N 3.34Å; C186-R191 WeakPolarHBondContact O-CD 3.3Å; C186-R191 PolarHBondContact O-NH1 3.31Å; C186-D206 WeakPolarHBondContact CB-OD2 3.34Å
187	M	85.2	Confident	81	Confident	19 Å²	19	72.9 Å²	72.9	9%	0.094	44%	0.437	C	S	.	.			trans	-125.7	118.9	176.4	-71.8	-162.5	176.8	0	0	111.3	C177 N185 F194 I197 P200 K201 P203	C177-M187 PolarHBondContact SG-N 3.04Å; N185-M187 PolarHBondContact O-N 3.47Å; M187-F194 HydrophobicContact CE-CD1 4.34Å; M187-F194 HydrophobicContact SD-CD1 3.5Å; M187-F194 VanDerWaalsContact SD-CD1 3.5Å; M187-F194 HydrophobicContact SD-CE1 3.76Å; M187-F194 HydrophobicContact SD-CG 4.35Å; M187-I197 HydrophobicContact CE-CB 3.5Å; M187-I197 VanDerWaalsContact CE-CB 3.5Å; M187-I197 HydrophobicContact CE-CD1 3.63Å; M187-I197 HydrophobicContact CE-CG1 3.84Å; M187-I197 HydrophobicContact CE-CG2 4.09Å; M187-I197 HydrophobicContact CG-CD1 4.25Å; M187-P200 HydrophobicContact CE-CB 3.63Å; M187-P200 HydrophobicContact CG-CB 3.86Å; M187-P200 HydrophobicContact SD-CB 3.35Å; M187-P200 WeakPolarHBondContact SD-CB 3.48Å; M187-P200 HydrophobicContact SD-CG 4.33Å; M187-K201 PolarHBondContact N-O 3.39Å; M187-P203 VanDerWaalsContact O-CD 3.31Å; M187-P203 WeakPolarHBondContact O-CD 3.35Å
188	D	86	Confident	80.1	Confident	16 Å²	16	77.5 Å²	77.5	9%	0.086	46%	0.464	C	S	.	.			trans	-112.9	-178.9	169.8	61.9	30.5	0	0	0	110.9	C177 S190 R191 P203	C177-D188 WeakPolarHBondContact CB-OD2 3.43Å; C177-D188 PolarHBondContact N-OD2 3.08Å; D188-S190 PolarHBondContact O-N 2.91Å; D188-S190 VanDerWaalsContact O-N 3.16Å; D188-S190 WeakPolarHBondContact OD1-CA 3.48Å; D188-S190 WeakPolarHBondContact OD1-CB 3.42Å; D188-S190 PolarHBondContact OD1-N 3.07Å; D188-S190 PolarHBondContact OD1-OG 3.08Å; D188-R191 PolarHBondContact O-N 3.42Å; D188-R191 PolarHBondContact OD1-N 2.91Å; D188-P203 HydrophobicContact CB-CG 3.91Å
189	A	79.9	Confident	79.4	Confident	107 Å²	107	80.2 Å²	80.2	88%	0.884	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.3	179.8	0	0	0	0	0	114.2
190	S	76.4	Confident	78.9	Confident	92 Å²	92	77.9 Å²	77.9	64%	0.643	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-23.8	-178.2	79.6	0	0	0	0	113.2	D188 A192	D188-S190 PolarHBondContact O-N 2.91Å; D188-S190 VanDerWaalsContact O-N 3.16Å; D188-S190 WeakPolarHBondContact OD1-CA 3.48Å; D188-S190 WeakPolarHBondContact OD1-CB 3.42Å; D188-S190 PolarHBondContact OD1-N 3.07Å; D188-S190 PolarHBondContact OD1-OG 3.08Å; S190-A192 PolarHBondContact O-N 3.5Å
191	R	72.1	Confident	78.5	Confident	97 Å²	97	77 Å²	77	37%	0.366	45%	0.449	S	S	.	.			trans	-85.6	92.8	-179.2	-68.3	-174.9	-178.8	-165.9	-1.3	111.2	P184 C186 D188 N193	P184-R191 PolarHBondContact O-NH1 2.94Å; P184-R191 VanDerWaalsContact O-NH1 3.15Å; C186-R191 WeakPolarHBondContact O-CD 3.3Å; C186-R191 PolarHBondContact O-NH1 3.31Å; D188-R191 PolarHBondContact O-N 3.42Å; D188-R191 PolarHBondContact OD1-N 2.91Å; R191-N193 PolarHBondContact O-N 3.45Å
192	A	57	Low	78.2	Confident	84 Å²	84	76.6 Å²	76.6	69%	0.694	45%	0.451	S	S	*	.			trans	-68.9	-24.9	-175	0	0	0	0	0	116.2	S190 F194	S190-A192 PolarHBondContact O-N 3.5Å; A192-F194 PolarHBondContact O-N 3.04Å
193	N	60.4	Low	78.1	Confident	118 Å²	118	75.6 Å²	75.6	63%	0.631	44%	0.444	S	S	*	.			trans	-93.9	80.9	-174.6	-80	-12.3	0	0	0	112.4	R191 T195	R191-N193 PolarHBondContact O-N 3.45Å; N193-T195 PolarHBondContact O-N 2.75Å; N193-T195 VanDerWaalsContact O-N 3.16Å
194	F	61.5	Low	78.2	Confident	142 Å²	142	74.2 Å²	74.2	62%	0.623	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-61	-18.6	176.4	-77.1	-93	0	0	0	114.4	M187 A192	M187-F194 HydrophobicContact CE-CD1 4.34Å; M187-F194 HydrophobicContact SD-CD1 3.5Å; M187-F194 VanDerWaalsContact SD-CD1 3.5Å; M187-F194 HydrophobicContact SD-CE1 3.76Å; M187-F194 HydrophobicContact SD-CG 4.35Å; A192-F194 PolarHBondContact O-N 3.04Å
195	T	66.1	Low	78.4	Confident	125 Å²	125	71.2 Å²	71.2	77%	0.767	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-81.3	-17.8	-168.5	54.7	0	0	0	0	115.7	N193	N193-T195 PolarHBondContact O-N 2.75Å; N193-T195 VanDerWaalsContact O-N 3.16Å
196	N	70	Confident	78.6	Confident	134 Å²	134	68.3 Å²	68.3	72%	0.717	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-93.9	-7	-170.7	-78.8	7.1	0	0	0	114.6
197	I	68.7	Low	79	Confident	42 Å²	42	68.9 Å²	68.9	22%	0.215	40%	0.397	C	S	.	.			trans	-111.1	123.6	-173.3	-59	-176.9	0	0	0	109.5	N185 M187	N185-I197 HydrophobicContact CB-CG2 3.91Å; M187-I197 HydrophobicContact CE-CB 3.5Å; M187-I197 VanDerWaalsContact CE-CB 3.5Å; M187-I197 HydrophobicContact CE-CD1 3.63Å; M187-I197 HydrophobicContact CE-CG1 3.84Å; M187-I197 HydrophobicContact CE-CG2 4.09Å; M187-I197 HydrophobicContact CG-CD1 4.25Å
198	T	74.6	Confident	79.4	Confident	114 Å²	114	68.4 Å²	68.4	70%	0.699	40%	0.395	S	S	*	.	S	Bend	trans	-82	124.9	170.6	-44.7	0	0	0	0	108.8
199	N	78.7	Confident	79.8	Confident	129 Å²	129	69.5 Å²	69.5	69%	0.69	40%	0.399	S	S	*	.	S	Bend	trans	60.3	73.6	-177.1	-58.9	-24.3	0	0	0	114.3
200	P	81.2	Confident	80.6	Confident	79 Å²	79	67.5 Å²	67.5	51%	0.513	37%	0.373	S	S	.	.			trans	-63.8	141.4	178.3	29	-36.4	0	0	0	112.5	M187	M187-P200 HydrophobicContact CE-CB 3.63Å; M187-P200 HydrophobicContact CG-CB 3.86Å; M187-P200 HydrophobicContact SD-CB 3.35Å; M187-P200 WeakPolarHBondContact SD-CB 3.48Å; M187-P200 HydrophobicContact SD-CG 4.33Å
201	K	85.8	Confident	81.5	Confident	70 Å²	70	65.8 Å²	65.8	30%	0.304	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-114.9	146.1	178	-69.4	-170.5	170.9	-137.8	0	112.2	N185 M187 E205 D206	N185-K201 PolarHBondContact O-N 3.44Å; M187-K201 PolarHBondContact N-O 3.39Å; K201-E205 WeakPolarHBondContact CD-OE1 3.37Å; K201-E205 VanDerWaalsContact CE-OE1 3.27Å; K201-E205 WeakPolarHBondContact CE-OE1 3.17Å; K201-E205 IonicContact NZ-OE1 2.84Å; K201-E205 PolarHBondContact NZ-OE1 3.43Å; K201-D206 VanDerWaalsContact CD-OD1 3.3Å; K201-D206 WeakPolarHBondContact CD-OD1 3.28Å
202	A	87.9	Confident	82.6	Confident	17 Å²	17	61.1 Å²	61.1	14%	0.14	34%	0.337	C	S	.	.			trans	-74.5	149.3	174	0	0	0	0	0	111	S204 E205 D206 E385	A202-S204 PolarHBondContact O-N 3.2Å; A202-E205 WeakPolarHBondContact O-CB 3.36Å; A202-E205 PolarHBondContact O-N 3.31Å; A202-D206 PolarHBondContact O-N 2.89Å; A202-E385 HydrophobicContact CB-CG 4.25Å
203	P	92.4	Very high	84.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-34.3	178.9	-19.1	32.5	0	0	0	112.2	W181 M187 D188 E205 D206 Y207	W181-P203 HydrophobicContact CH2-CB 4.26Å; W181-P203 VanDerWaalsContact CZ3-O 3.29Å; W181-P203 WeakPolarHBondContact CZ3-O 3.45Å; M187-P203 VanDerWaalsContact O-CD 3.31Å; M187-P203 WeakPolarHBondContact O-CD 3.35Å; D188-P203 HydrophobicContact CB-CG 3.91Å; P203-E205 VanDerWaalsContact C-N 3.29Å; P203-E205 PolarHBondContact O-N 3.31Å; P203-D206 PolarHBondContact O-N 3.48Å; P203-Y207 VanDerWaalsContact O-CB 3.24Å; P203-Y207 WeakPolarHBondContact O-CB 3.24Å; P203-Y207 PolarHBondContact O-N 3.45Å
204	S	93.1	Very high	86.1	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-31.5	171.2	50.4	0	0	0	0	114.9	A202 Y208 V381 E385	A202-S204 PolarHBondContact O-N 3.2Å; S204-Y208 WeakPolarHBondContact O-CB 3.47Å; S204-Y208 PolarHBondContact O-N 3.37Å; S204-Y208 VanDerWaalsContact O-N 3.1Å; S204-V381 WeakPolarHBondContact CB-O 3.29Å; S204-V381 PolarHBondContact OG-O 2.93Å; S204-E385 WeakPolarHBondContact OG-CB 3.47Å; S204-E385 PolarHBondContact OG-OE2 3.48Å
205	E	91.9	Very high	87.6	Confident	47 Å²	47	51.9 Å²	51.9	22%	0.22	28%	0.278	C	S	.	.	H	α-helix	trans	-70.3	-52.3	177.3	-170.2	-176.1	144.1	0	0	110.4	K201 A202 P203 Y207 Y208 F209 V381	K201-E205 WeakPolarHBondContact CD-OE1 3.37Å; K201-E205 VanDerWaalsContact CE-OE1 3.27Å; K201-E205 WeakPolarHBondContact CE-OE1 3.17Å; K201-E205 IonicContact NZ-OE1 2.84Å; K201-E205 PolarHBondContact NZ-OE1 3.43Å; A202-E205 WeakPolarHBondContact O-CB 3.36Å; A202-E205 PolarHBondContact O-N 3.31Å; P203-E205 VanDerWaalsContact C-N 3.29Å; P203-E205 PolarHBondContact O-N 3.31Å; E205-Y207 VanDerWaalsContact C-N 3.32Å; E205-Y207 PolarHBondContact O-N 3.16Å; E205-Y208 PolarHBondContact O-N 3.36Å; E205-F209 HydrophobicContact CG-CD2 3.9Å; E205-F209 HydrophobicContact CG-CE2 4.07Å; E205-F209 WeakPolarHBondContact O-CD2 3.25Å; E205-F209 PolarHBondContact O-N 3.47Å; E205-V381 VanDerWaalsContact CA-CG1 3.49Å; E205-V381 HydrophobicContact CB-CG1 3.55Å; E205-V381 HydrophobicContact CB-CG2 4.48Å; E205-V381 HydrophobicContact CG-CG1 4.06Å
206	D	93.5	Very high	89	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.011	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-37.3	178.9	-82.3	0.8	0	0	0	111.1	W181 S183 C186 K201 A202 P203 Y208 N210	W181-D206 HydrophobicContact CE3-CB 3.96Å; W181-D206 HydrophobicContact CZ3-CB 3.77Å; S183-D206 WeakPolarHBondContact CA-OD2 3.34Å; S183-D206 WeakPolarHBondContact CB-OD2 3.38Å; S183-D206 PolarHBondContact N-OD2 3.04Å; S183-D206 PolarHBondContact OG-OD2 3.45Å; C186-D206 WeakPolarHBondContact CB-OD2 3.34Å; K201-D206 VanDerWaalsContact CD-OD1 3.3Å; K201-D206 WeakPolarHBondContact CD-OD1 3.28Å; A202-D206 PolarHBondContact O-N 2.89Å; P203-D206 PolarHBondContact O-N 3.48Å; D206-Y208 PolarHBondContact O-N 3.31Å; D206-N210 WeakPolarHBondContact O-CA 3.26Å; D206-N210 WeakPolarHBondContact O-CB 3.35Å; D206-N210 PolarHBondContact O-N 3.24Å
207	Y	95.8	Very high	90.1	Very high	12 Å²	12	43.8 Å²	43.8	5%	0.047	24%	0.237	C	C	.	.	I	π-helix	trans	-59.3	-48	173.9	-176.1	-98.5	0	0	0	111	Y162 F163 P173 W174 W181 P203 E205 E211 V212	Y162-Y207 HydrophobicContact CE1-CE1 4.11Å; Y162-Y207 WeakPolarHBondContact CE1-OH 3.44Å; Y162-Y207 PolarHBondContact OH-OH 3.23Å; F163-Y207 HydrophobicContact CE1-CD1 4.17Å; F163-Y207 HydrophobicContact CE1-CE1 4.17Å; F163-Y207 HydrophobicContact CZ-CD1 4.15Å; F163-Y207 HydrophobicContact CZ-CE1 4.25Å; P173-Y207 HydrophobicContact CB-CD2 4.33Å; P173-Y207 HydrophobicContact CB-CE2 3.57Å; W174-Y207 HydrophobicContact CB-CD1 3.97Å; W174-Y207 HydrophobicContact CB-CD2 4.44Å; W174-Y207 HydrophobicContact CB-CG 3.8Å; W174-Y207 HydrophobicContact CD2-CD1 4.43Å; W174-Y207 AromaticContact CE3-CD1 3.75Å; W174-Y207 HydrophobicContact CE3-CD1 3.75Å; W174-Y207 AromaticContact CE3-CE1 3.48Å; W174-Y207 HydrophobicContact CE3-CE1 3.48Å; W174-Y207 VanDerWaalsContact CE3-CE1 3.48Å; W174-Y207 HydrophobicContact CZ3-CE1 4.02Å; W181-Y207 HydrophobicContact CD2-CD2 4.26Å; W181-Y207 AromaticContact CE2-CD2 3.85Å; W181-Y207 HydrophobicContact CH2-CD2 4.38Å; W181-Y207 AromaticContact CZ2-CD2 3.93Å; W181-Y207 HydrophobicContact CZ2-CD2 3.93Å; W181-Y207 VanDerWaalsContact CZ3-N 3.33Å; P203-Y207 VanDerWaalsContact O-CB 3.24Å; P203-Y207 WeakPolarHBondContact O-CB 3.24Å; P203-Y207 PolarHBondContact O-N 3.45Å; E205-Y207 VanDerWaalsContact C-N 3.32Å; E205-Y207 PolarHBondContact O-N 3.16Å; Y207-E211 HydrophobicContact CD2-CB 3.99Å; Y207-E211 HydrophobicContact CD2-CG 4.09Å; Y207-E211 HydrophobicContact CE2-CB 4.16Å; Y207-E211 HydrophobicContact CE2-CG 3.74Å; Y207-E211 WeakPolarHBondContact O-CA 3.3Å; Y207-E211 VanDerWaalsContact O-CB 3.28Å; Y207-E211 WeakPolarHBondContact O-CB 3.33Å; Y207-E211 PolarHBondContact O-N 3.28Å; Y207-V212 HydrophobicContact CD1-CG2 3.76Å; Y207-V212 HydrophobicContact CE1-CG2 3.45Å; Y207-V212 VanDerWaalsContact CE1-CG2 3.45Å; Y207-V212 WeakPolarHBondContact O-CG2 3.46Å; Y207-V212 PolarHBondContact O-N 3.22Å
208	Y	95.2	Very high	91.4	Very high	10 Å²	10	41.8 Å²	41.8	4%	0.039	23%	0.227	C	C	.	.	I	π-helix	trans	-63.5	-51.9	-179.6	-178.1	-119.8	0	0	0	112.5	H159 F163 S204 E205 D206 V212 I213 F380 V381	H159-Y208 AromaticContact CD2-CE2 3.87Å; F163-Y208 AromaticContact CE2-CD2 3.72Å; F163-Y208 HydrophobicContact CE2-CD2 3.72Å; F163-Y208 HydrophobicContact CE2-CE2 4.17Å; F163-Y208 AromaticContact CZ-CD2 3.86Å; F163-Y208 HydrophobicContact CZ-CD2 3.86Å; S204-Y208 WeakPolarHBondContact O-CB 3.47Å; S204-Y208 PolarHBondContact O-N 3.37Å; S204-Y208 VanDerWaalsContact O-N 3.1Å; E205-Y208 PolarHBondContact O-N 3.36Å; D206-Y208 PolarHBondContact O-N 3.31Å; Y208-V212 HydrophobicContact CD2-CB 4.46Å; Y208-V212 WeakPolarHBondContact O-CB 3.36Å; Y208-I213 HydrophobicContact CD1-CD1 3.92Å; Y208-I213 HydrophobicContact CD2-CD1 4.25Å; Y208-I213 HydrophobicContact CE1-CD1 3.39Å; Y208-I213 HydrophobicContact CE2-CD1 3.78Å; Y208-I213 HydrophobicContact CE2-CG1 4.2Å; Y208-I213 HydrophobicContact CG-CD1 4.33Å; Y208-I213 PolarHBondContact O-N 2.82Å; Y208-F380 HydrophobicContact CD1-CB 4.4Å; Y208-F380 HydrophobicContact CD2-CB 3.56Å; Y208-F380 HydrophobicContact CD2-CG 4.29Å; Y208-F380 HydrophobicContact CE1-CB 4.34Å; Y208-F380 HydrophobicContact CE2-CB 3.47Å; Y208-F380 VanDerWaalsContact CE2-CB 3.47Å; Y208-F380 HydrophobicContact CE2-CD1 4.49Å; Y208-F380 HydrophobicContact CE2-CD2 4Å; Y208-F380 AromaticContact CE2-CG 3.76Å; Y208-F380 HydrophobicContact CE2-CG 3.76Å; Y208-F380 HydrophobicContact CG-CB 4.02Å; Y208-F380 AromaticContact CZ-CD2 3.97Å; Y208-V381 HydrophobicContact CD1-CG2 3.84Å; Y208-V381 HydrophobicContact CG-CG2 4.12Å
209	F	94.1	Very high	92.3	Very high	38 Å²	38	36.7 Å²	36.7	17%	0.167	20%	0.196	C	C	.	.	I	π-helix	trans	-78.7	-36.7	-174.1	-71.6	-68.2	0	0	0	113.3	E205 I213 K214 L215 V381 Y463	E205-F209 HydrophobicContact CG-CD2 3.9Å; E205-F209 HydrophobicContact CG-CE2 4.07Å; E205-F209 WeakPolarHBondContact O-CD2 3.25Å; E205-F209 PolarHBondContact O-N 3.47Å; F209-I213 HydrophobicContact CD1-CD1 4.14Å; F209-I213 HydrophobicContact CE1-CD1 4.38Å; F209-K214 CarbonylContact O-C 3.52Å; F209-K214 WeakPolarHBondContact O-CA 3.44Å; F209-K214 PolarHBondContact O-N 2.78Å; F209-L215 HydrophobicContact CB-CB 4.46Å; F209-L215 HydrophobicContact CD1-CB 4.47Å; F209-L215 HydrophobicContact CD1-CD2 3.79Å; F209-L215 HydrophobicContact CE1-CD2 4.36Å; F209-L215 HydrophobicContact CG-CD2 4.49Å; F209-L215 WeakPolarHBondContact O-CB 3.18Å; F209-L215 PolarHBondContact O-N 3.1Å; F209-V381 HydrophobicContact CE2-CG2 4.37Å; F209-Y463 HydrophobicContact CE1-CE2 4.2Å
210	N	95.2	Very high	93	Very high	65 Å²	65	35.9 Å²	35.9	35%	0.348	19%	0.187	S	C	.	.	I	π-helix	trans	-97	-33.6	-172.9	-53.7	-16.9	0	0	0	113.2	W181 D206 K214	W181-N210 HydrophobicContact CB-CB 4.43Å; W181-N210 WeakPolarHBondContact O-CB 3.45Å; W181-N210 PolarHBondContact O-ND2 3.36Å; D206-N210 WeakPolarHBondContact O-CA 3.26Å; D206-N210 WeakPolarHBondContact O-CB 3.35Å; D206-N210 PolarHBondContact O-N 3.24Å; N210-K214 WeakPolarHBondContact O-CG 3.36Å
211	E	95.5	Very high	93.6	Very high	56 Å²	56	37.7 Å²	37.7	26%	0.262	19%	0.189	S	C	.	.	I	π-helix	trans	-95.7	-50.1	-179.5	179.2	54.8	-154.5	0	0	112.3	W181 Y207 K214	W181-E211 HydrophobicContact CB-CB 3.79Å; W181-E211 HydrophobicContact CD2-CB 4.37Å; W181-E211 HydrophobicContact CG-CB 3.81Å; W181-E211 HydrophobicContact CG-CG 4.36Å; Y207-E211 HydrophobicContact CD2-CB 3.99Å; Y207-E211 HydrophobicContact CD2-CG 4.09Å; Y207-E211 HydrophobicContact CE2-CB 4.16Å; Y207-E211 HydrophobicContact CE2-CG 3.74Å; Y207-E211 WeakPolarHBondContact O-CA 3.3Å; Y207-E211 VanDerWaalsContact O-CB 3.28Å; Y207-E211 WeakPolarHBondContact O-CB 3.33Å; Y207-E211 PolarHBondContact O-N 3.28Å; E211-K214 WeakPolarHBondContact O-CE 3.41Å; E211-K214 WeakPolarHBondContact O-CG 3.13Å
212	V	96	Very high	94.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-76.5	-59.6	-175	-174.3	0	0	0	0	111.4	Y162 F163 Y207 Y208 L229	Y162-V212 HydrophobicContact CD1-CB 4.45Å; Y162-V212 HydrophobicContact CD1-CG1 3.73Å; Y162-V212 HydrophobicContact CD1-CG2 3.88Å; Y162-V212 HydrophobicContact CD2-CG1 4.45Å; Y162-V212 HydrophobicContact CE1-CB 4.14Å; Y162-V212 HydrophobicContact CE1-CG1 3.87Å; Y162-V212 HydrophobicContact CE1-CG2 3.32Å; Y162-V212 HydrophobicContact CG-CG1 4.05Å; F163-V212 HydrophobicContact CE2-CG1 4.34Å; F163-V212 HydrophobicContact CE2-CG2 4.1Å; F163-V212 HydrophobicContact CZ-CG2 4.22Å; Y207-V212 HydrophobicContact CD1-CG2 3.76Å; Y207-V212 HydrophobicContact CE1-CG2 3.45Å; Y207-V212 VanDerWaalsContact CE1-CG2 3.45Å; Y207-V212 WeakPolarHBondContact O-CG2 3.46Å; Y207-V212 PolarHBondContact O-N 3.22Å; Y208-V212 HydrophobicContact CD2-CB 4.46Å; Y208-V212 WeakPolarHBondContact O-CB 3.36Å; V212-L229 HydrophobicContact CG1-CD2 3.94Å; V212-L229 HydrophobicContact CG1-CG 4.49Å; V212-L229 VanDerWaalsContact O-CD1 3.3Å; V212-L229 WeakPolarHBondContact O-CD1 3.43Å
213	I	94.7	Very high	94.4	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.041	21%	0.207	C	C	.	.	S	Bend	trans	-78.3	-36.6	-178.6	-66.6	171.8	0	0	0	111.3	Y208 F209 L215 Y463	Y208-I213 HydrophobicContact CD1-CD1 3.92Å; Y208-I213 HydrophobicContact CD2-CD1 4.25Å; Y208-I213 HydrophobicContact CE1-CD1 3.39Å; Y208-I213 HydrophobicContact CE2-CD1 3.78Å; Y208-I213 HydrophobicContact CE2-CG1 4.2Å; Y208-I213 HydrophobicContact CG-CD1 4.33Å; Y208-I213 PolarHBondContact O-N 2.82Å; F209-I213 HydrophobicContact CD1-CD1 4.14Å; F209-I213 HydrophobicContact CE1-CD1 4.38Å; I213-L215 HydrophobicContact CG2-CB 4.08Å; I213-L215 HydrophobicContact CG2-CD1 4.3Å; I213-Y463 HydrophobicContact CD1-CD2 4.02Å
214	K	95.3	Very high	94.6	Very high	87 Å²	87	44.7 Å²	44.7	38%	0.378	24%	0.24	S	C	.	.			trans	57.7	51.1	-170.2	-53.3	-177.9	176	-176.5	0	111	F209 N210 E211 S216 A460	F209-K214 CarbonylContact O-C 3.52Å; F209-K214 WeakPolarHBondContact O-CA 3.44Å; F209-K214 PolarHBondContact O-N 2.78Å; N210-K214 WeakPolarHBondContact O-CG 3.36Å; E211-K214 WeakPolarHBondContact O-CE 3.41Å; E211-K214 WeakPolarHBondContact O-CG 3.13Å; K214-S216 PolarHBondContact O-N 2.9Å; K214-A460 VanDerWaalsContact O-CA 3.31Å; K214-A460 WeakPolarHBondContact O-CA 3.27Å; K214-A460 WeakPolarHBondContact O-CB 3.36Å
215	L	93.7	Very high	94.8	Very high	54 Å²	54	47.5 Å²	47.5	28%	0.283	26%	0.259	S	S	.	.			trans	-56.8	122.6	-171.5	-175.1	66.2	0	0	0	111.1	F209 I213 Y463 Y464	F209-L215 HydrophobicContact CB-CB 4.46Å; F209-L215 HydrophobicContact CD1-CB 4.47Å; F209-L215 HydrophobicContact CD1-CD2 3.79Å; F209-L215 HydrophobicContact CE1-CD2 4.36Å; F209-L215 HydrophobicContact CG-CD2 4.49Å; F209-L215 WeakPolarHBondContact O-CB 3.18Å; F209-L215 PolarHBondContact O-N 3.1Å; I213-L215 HydrophobicContact CG2-CB 4.08Å; I213-L215 HydrophobicContact CG2-CD1 4.3Å; L215-Y463 HydrophobicContact CD1-CD1 3.76Å; L215-Y463 HydrophobicContact CD1-CG 3.78Å; L215-Y464 HydrophobicContact CD1-CE2 3.92Å
216	S	95.4	Very high	95	Very high	16 Å²	16	45.8 Å²	45.8	11%	0.112	25%	0.252	C	S	.	.			trans	-75	171.7	171.4	61.4	0	0	0	0	111.8	K214 G218 E221 A460 G461 Y464	K214-S216 PolarHBondContact O-N 2.9Å; S216-G218 PolarHBondContact O-N 3.41Å; S216-G218 PolarHBondContact OG-O 2.93Å; S216-E221 WeakPolarHBondContact CB-O 3.37Å; S216-E221 PolarHBondContact OG-O 3.48Å; S216-A460 PolarHBondContact N-O 3.31Å; S216-A460 PolarHBondContact OG-O 3.15Å; S216-A460 VanDerWaalsContact OG-O 3.08Å; S216-G461 WeakPolarHBondContact OG-CA 3.33Å; S216-G461 PolarHBondContact OG-N 3.42Å; S216-Y464 PolarHBondContact O-OH 3.25Å
217	S	93.8	Very high	95.2	Very high	74 Å²	74	54.8 Å²	54.8	52%	0.517	29%	0.286	S	S	.	.	S	Bend	trans	-68.3	-18.5	176.3	58.7	0	0	0	0	114.1	E221 Y464 Y545	S217-E221 PolarHBondContact OG-OE2 3Å; S217-Y464 PolarHBondContact O-OH 3.43Å; S217-Y545 WeakPolarHBondContact O-CD2 3.32Å
218	G	94.4	Very high	95.2	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	177.2	173.7	-172.9	0	0	0	0	0	113.1	S216 E220 E221	S216-G218 PolarHBondContact O-N 3.41Å; S216-G218 PolarHBondContact OG-O 2.93Å; G218-E220 VanDerWaalsContact C-N 3.25Å; G218-E220 WeakPolarHBondContact CA-OE1 3.32Å; G218-E220 PolarHBondContact O-N 3.23Å; G218-E221 PolarHBondContact O-N 3.47Å; G218-E221 VanDerWaalsContact O-N 3.13Å
219	L	94.4	Very high	95.4	Very high	7 Å²	7	54.6 Å²	54.6	4%	0.037	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.6	-174.1	-174.6	64.2	0	0	0	112.7	E221 F222 G461 Y464 L465 I468 Y545 W550 A551	L219-E221 PolarHBondContact O-N 3.15Å; L219-F222 HydrophobicContact CD1-CD2 3.89Å; L219-F222 HydrophobicContact CD1-CE2 3.82Å; L219-G461 WeakPolarHBondContact CD1-O 3.45Å; L219-Y464 HydrophobicContact CB-CD2 4.48Å; L219-L465 HydrophobicContact CD1-CB 4.24Å; L219-I468 HydrophobicContact CD2-CD1 4.2Å; L219-Y545 VanDerWaalsContact CB-OH 3.3Å; L219-Y545 WeakPolarHBondContact CB-OH 3.38Å; L219-Y545 PolarHBondContact N-OH 2.93Å; L219-W550 HydrophobicContact CB-CZ2 4.49Å; L219-W550 HydrophobicContact CD2-CH2 3.22Å; L219-W550 HydrophobicContact CD2-CZ2 3.75Å; L219-W550 HydrophobicContact CD2-CZ3 3.87Å; L219-W550 HydrophobicContact CG-CH2 3.58Å; L219-W550 HydrophobicContact CG-CZ2 3.92Å; L219-A551 HydrophobicContact CD2-CB 3.59Å
220	E	94.2	Very high	95.6	Very high	111 Å²	111	53.7 Å²	53.7	52%	0.519	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.2	172.4	51.2	-77.7	171.9	0	0	113.8	G218 F222 Y545	G218-E220 VanDerWaalsContact C-N 3.25Å; G218-E220 WeakPolarHBondContact CA-OE1 3.32Å; G218-E220 PolarHBondContact O-N 3.23Å; E220-F222 PolarHBondContact O-N 3.19Å; E220-Y545 PolarHBondContact OE2-OH 3.01Å
221	E	94.1	Very high	95.7	Very high	118 Å²	118	55.1 Å²	55.1	55%	0.551	29%	0.293	S	S	*	.	S	Bend	trans	-99.1	61	174.5	-68.6	-168.4	-177.7	0	0	110.7	S216 S217 G218 L219 G223	S216-E221 WeakPolarHBondContact CB-O 3.37Å; S216-E221 PolarHBondContact OG-O 3.48Å; S217-E221 PolarHBondContact OG-OE2 3Å; G218-E221 PolarHBondContact O-N 3.47Å; G218-E221 VanDerWaalsContact O-N 3.13Å; L219-E221 PolarHBondContact O-N 3.15Å; E221-G223 VanDerWaalsContact C-N 3.27Å; E221-G223 PolarHBondContact O-N 3.45Å; E221-G223 VanDerWaalsContact O-N 3.15Å
222	F	94.3	Very high	95.9	Very high	69 Å²	69	53.1 Å²	53.1	30%	0.303	29%	0.285	S	S	.	.			trans	-57.3	-37.4	-168.7	-155.7	-97.2	0	0	0	114.1	L219 E220 P456 C459 A460 G461 L465	L219-F222 HydrophobicContact CD1-CD2 3.89Å; L219-F222 HydrophobicContact CD1-CE2 3.82Å; E220-F222 PolarHBondContact O-N 3.19Å; F222-P456 HydrophobicContact CE1-CB 3.95Å; F222-P456 WeakPolarHBondContact CE1-O 3.46Å; F222-P456 HydrophobicContact CZ-CB 3.63Å; F222-P456 WeakPolarHBondContact CZ-O 3.26Å; F222-C459 HydrophobicContact CD1-CB 3.91Å; F222-C459 HydrophobicContact CE1-CB 3.76Å; F222-C459 VanDerWaalsContact CE1-SG 3.58Å; F222-C459 HydrophobicContact CZ-CB 4.48Å; F222-C459 WeakPolarHBondContact O-CB 3.37Å; F222-A460 PolarHBondContact O-N 3.39Å; F222-G461 PolarHBondContact O-N 2.98Å; F222-L465 HydrophobicContact CE2-CD2 4.38Å; F222-L465 HydrophobicContact CZ-CD2 4.18Å
223	G	95.4	Very high	96	Very high	50 Å²	50	53.1 Å²	53.1	52%	0.515	29%	0.285	S	S	.	.			trans	70.2	-167.1	-178	0	0	0	0	0	113.8	E221	E221-G223 VanDerWaalsContact C-N 3.27Å; E221-G223 PolarHBondContact O-N 3.45Å; E221-G223 VanDerWaalsContact O-N 3.15Å
224	T	96.3	Very high	96.2	Very high	114 Å²	114	55.6 Å²	55.6	70%	0.699	30%	0.298	S	S	*	.			trans	-105.7	156.2	177.3	56	0	0	0	0	111.2	S226 C459	T224-S226 PolarHBondContact O-N 3.25Å; T224-C459 VanDerWaalsContact C-SG 3.58Å
225	P	96.8	Very high	96.4	Very high	59 Å²	59	54 Å²	54	38%	0.383	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-56.6	128.5	175.5	-24.3	33.4	0	0	0	111.5	W227 V458 C459	P225-W227 PolarHBondContact O-N 2.71Å; P225-V458 HydrophobicContact CB-CG2 4.19Å; P225-C459 VanDerWaalsContact CA-SG 3.58Å
226	S	96.6	Very high	96.6	Very high	11 Å²	11	51.5 Å²	51.5	8%	0.077	28%	0.282	C	S	.	.			trans	-64	122.9	174	175.1	0	0	0	0	109.4	T224 S228 L229 S230 V458	T224-S226 PolarHBondContact O-N 3.25Å; S226-S228 VanDerWaalsContact C-N 3.28Å; S226-S228 PolarHBondContact O-N 3.46Å; S226-S228 PolarHBondContact OG-OG 3.33Å; S226-L229 PolarHBondContact O-N 2.73Å; S226-S230 VanDerWaalsContact O-CB 3.23Å; S226-S230 WeakPolarHBondContact O-CB 3.41Å; S226-S230 PolarHBondContact O-N 3.46Å; S226-S230 PolarHBondContact O-OG 2.99Å; S226-V458 WeakPolarHBondContact CB-O 3.49Å; S226-V458 PolarHBondContact N-O 2.84Å
227	W	97.3	Very high	96.8	Very high	192 Å²	192	51 Å²	51	73%	0.727	28%	0.278	S	S	*	.	H	α-helix	trans	-61.9	-36.8	-174.8	74.2	-96	0	0	0	112.1	P225 L231	P225-W227 PolarHBondContact O-N 2.71Å; W227-L231 PolarHBondContact O-N 3.18Å
228	S	97.3	Very high	97	Very high	16 Å²	16	51.7 Å²	51.7	11%	0.112	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-48.9	-178.6	52.9	0	0	0	0	111.2	S226 S230 L231 C232	S226-S228 VanDerWaalsContact C-N 3.28Å; S226-S228 PolarHBondContact O-N 3.46Å; S226-S228 PolarHBondContact OG-OG 3.33Å; S228-S230 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 2.92Å; S228-L231 PolarHBondContact O-N 3.14Å; S228-C232 PolarHBondContact O-N 2.96Å; S228-C232 PolarHBondContact O-SG 2.98Å
229	L	98	Very high	97.2	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-35.6	174.7	-71.7	179.5	0	0	0	112.2	Y162 V212 S226 L231 C232 L233 V458	Y162-L229 HydrophobicContact CD2-CD2 4.17Å; Y162-L229 HydrophobicContact CG-CD2 4.3Å; V212-L229 HydrophobicContact CG1-CD2 3.94Å; V212-L229 HydrophobicContact CG1-CG 4.49Å; V212-L229 VanDerWaalsContact O-CD1 3.3Å; V212-L229 WeakPolarHBondContact O-CD1 3.43Å; S226-L229 PolarHBondContact O-N 2.73Å; L229-L231 VanDerWaalsContact C-N 3.3Å; L229-L231 PolarHBondContact O-N 3.5Å; L229-C232 PolarHBondContact O-N 3.1Å; L229-L233 VanDerWaalsContact O-CB 3.26Å; L229-L233 WeakPolarHBondContact O-CB 3.29Å; L229-L233 PolarHBondContact O-N 3.33Å; L229-V458 HydrophobicContact CB-CB 3.94Å; L229-V458 HydrophobicContact CB-CG1 4.11Å; L229-V458 HydrophobicContact CD1-CB 4.43Å
230	S	98.5	Very high	97.4	Very high	19 Å²	19	54.2 Å²	54.2	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-62.2	-38.9	175	-59.8	0	0	0	0	111.5	S226 S228 L233 L234	S226-S230 VanDerWaalsContact O-CB 3.23Å; S226-S230 WeakPolarHBondContact O-CB 3.41Å; S226-S230 PolarHBondContact O-N 3.46Å; S226-S230 PolarHBondContact O-OG 2.99Å; S228-S230 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 2.92Å; S230-L233 PolarHBondContact O-N 3.02Å; S230-L234 WeakPolarHBondContact O-CB 3.24Å; S230-L234 PolarHBondContact O-N 2.97Å
231	L	98.5	Very high	97.6	Very high	95 Å²	95	49.5 Å²	49.5	50%	0.497	27%	0.268	S	S	.	.	H	α-helix	trans	-68.3	-42	175.2	-176.6	63.2	0	0	0	112	W227 S228 L229 L234 T235	W227-L231 PolarHBondContact O-N 3.18Å; S228-L231 PolarHBondContact O-N 3.14Å; L229-L231 VanDerWaalsContact C-N 3.3Å; L229-L231 PolarHBondContact O-N 3.5Å; L231-L234 PolarHBondContact O-N 3.38Å; L231-T235 WeakPolarHBondContact O-CB 3.45Å; L231-T235 PolarHBondContact O-N 2.94Å; L231-T235 PolarHBondContact O-OG1 3.31Å
232	C	98.7	Very high	97.8	Very high	13 Å²	13	49.2 Å²	49.2	9%	0.088	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-46.4	173.1	-68	0	0	0	0	111.1	A158 L161 S228 L229 L234 T235 C236	A158-C232 HydrophobicContact CB-CB 4.15Å; L161-C232 HydrophobicContact CB-CB 4.43Å; L161-C232 HydrophobicContact CD2-CB 4.18Å; L161-C232 HydrophobicContact CG-CB 4.41Å; S228-C232 PolarHBondContact O-N 2.96Å; S228-C232 PolarHBondContact O-SG 2.98Å; L229-C232 PolarHBondContact O-N 3.1Å; C232-L234 PolarHBondContact O-N 3.34Å; C232-T235 PolarHBondContact O-N 3.33Å; C232-C236 PolarHBondContact O-N 3.5Å; C232-C236 PolarHBondContact O-SG 3.3Å
233	L	98.8	Very high	98	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-47.5	178	-178	60.6	0	0	0	111.4	Q154 I155 A158 L229 S230 T235 C236 W237 F451 L455 V458	Q154-L233 HydrophobicContact CB-CD1 4.15Å; Q154-L233 HydrophobicContact CG-CD1 3.58Å; I155-L233 HydrophobicContact CD1-CD1 4Å; I155-L233 HydrophobicContact CD1-CD2 4.03Å; A158-L233 HydrophobicContact CB-CB 4.13Å; A158-L233 HydrophobicContact CB-CD1 4.33Å; L229-L233 VanDerWaalsContact O-CB 3.26Å; L229-L233 WeakPolarHBondContact O-CB 3.29Å; L229-L233 PolarHBondContact O-N 3.33Å; S230-L233 PolarHBondContact O-N 3.02Å; L233-T235 VanDerWaalsContact C-N 3.33Å; L233-T235 PolarHBondContact O-N 3.03Å; L233-C236 PolarHBondContact O-N 3.3Å; L233-W237 PolarHBondContact O-N 3.08Å; L233-F451 HydrophobicContact CD2-CD2 4.2Å; L233-F451 HydrophobicContact CD2-CE2 4.43Å; L233-F451 HydrophobicContact CG-CD2 4.01Å; L233-F451 HydrophobicContact CG-CE2 4.38Å; L233-L455 HydrophobicContact CD2-CD2 4.43Å; L233-V458 HydrophobicContact CD2-CG1 4.05Å
234	L	98.7	Very high	98	Very high	61 Å²	61	43.8 Å²	43.8	32%	0.319	23%	0.233	S	C	.	.	H	α-helix	trans	-59.2	-44.6	175.7	-179.3	62.1	0	0	0	111.6	S230 L231 C232 W237 I238 F451	S230-L234 WeakPolarHBondContact O-CB 3.24Å; S230-L234 PolarHBondContact O-N 2.97Å; L231-L234 PolarHBondContact O-N 3.38Å; C232-L234 PolarHBondContact O-N 3.34Å; L234-W237 PolarHBondContact O-N 2.94Å; L234-I238 HydrophobicContact CD1-CD1 4.45Å; L234-I238 HydrophobicContact CG-CD1 4.1Å; L234-I238 WeakPolarHBondContact O-CG1 3.06Å; L234-I238 PolarHBondContact O-N 2.77Å; L234-F451 HydrophobicContact CB-CD2 4.12Å; L234-F451 HydrophobicContact CB-CE2 3.66Å; L234-F451 HydrophobicContact CB-CZ 4.18Å; L234-F451 HydrophobicContact CD1-CD1 4.3Å; L234-F451 HydrophobicContact CD1-CD2 4.16Å; L234-F451 HydrophobicContact CD1-CE1 4.24Å; L234-F451 HydrophobicContact CD1-CE2 4.12Å; L234-F451 HydrophobicContact CD1-CG 4.26Å; L234-F451 HydrophobicContact CD1-CZ 4.15Å; L234-F451 HydrophobicContact CG-CE2 4.44Å
235	T	98.8	Very high	98.1	Very high	54 Å²	54	40.2 Å²	40.2	33%	0.331	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-45.1	179	-57.8	0	0	0	0	111.2	L161 L231 C232 L233 W237 I238 I239	L161-T235 HydrophobicContact CD2-CG2 3.79Å; L231-T235 WeakPolarHBondContact O-CB 3.45Å; L231-T235 PolarHBondContact O-N 2.94Å; L231-T235 PolarHBondContact O-OG1 3.31Å; C232-T235 PolarHBondContact O-N 3.33Å; L233-T235 VanDerWaalsContact C-N 3.33Å; L233-T235 PolarHBondContact O-N 3.03Å; T235-W237 VanDerWaalsContact C-N 3.32Å; T235-W237 PolarHBondContact O-N 3.47Å; T235-I238 PolarHBondContact O-N 3.43Å; T235-I239 HydrophobicContact CG2-CD1 4.23Å; T235-I239 WeakPolarHBondContact O-CG1 3.49Å; T235-I239 PolarHBondContact O-N 3.32Å
236	C	98.8	Very high	97.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-40.8	175.6	-65.8	0	0	0	0	111.9	Q154 C232 L233 I238 I239 C240	Q154-C236 HydrophobicContact CG-CB 4.47Å; C232-C236 PolarHBondContact O-N 3.5Å; C232-C236 PolarHBondContact O-SG 3.3Å; L233-C236 PolarHBondContact O-N 3.3Å; C236-I238 PolarHBondContact O-N 3.44Å; C236-I239 PolarHBondContact O-N 3.22Å; C236-C240 PolarHBondContact O-N 3.47Å; C236-C240 PolarHBondContact O-SG 3.02Å; C236-C240 VanDerWaalsContact O-SG 3.33Å
237	W	98.7	Very high	97.8	Very high	6 Å²	6	43.2 Å²	43.2	2%	0.023	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-37.2	175.2	-85	115.7	0	0	0	113.6	V150 Q154 L233 L234 T235 C240 A241 L416 C447 D450 F451	V150-W237 HydrophobicContact CG1-CH2 3.39Å; V150-W237 HydrophobicContact CG1-CZ2 4.1Å; V150-W237 HydrophobicContact CG1-CZ3 4.36Å; Q154-W237 HydrophobicContact CB-CZ2 4.17Å; Q154-W237 HydrophobicContact CG-CD2 4.34Å; Q154-W237 HydrophobicContact CG-CZ2 4.07Å; L233-W237 PolarHBondContact O-N 3.08Å; L234-W237 PolarHBondContact O-N 2.94Å; T235-W237 VanDerWaalsContact C-N 3.32Å; T235-W237 PolarHBondContact O-N 3.47Å; W237-C240 HydrophobicContact CE3-CB 4.23Å; W237-C240 PolarHBondContact O-N 3.21Å; W237-A241 VanDerWaalsContact O-CB 3.32Å; W237-A241 WeakPolarHBondContact O-CB 3.04Å; W237-A241 PolarHBondContact O-N 2.93Å; W237-L416 HydrophobicContact CH2-CD1 4.44Å; W237-L416 HydrophobicContact CZ3-CD1 4.06Å; W237-L416 HydrophobicContact CZ3-CD2 3.98Å; W237-C447 HydrophobicContact CE3-CB 3.74Å; W237-C447 HydrophobicContact CZ3-CB 4.13Å; W237-D450 HydrophobicContact CH2-CB 3.16Å; W237-D450 HydrophobicContact CZ2-CB 3.22Å; W237-D450 HydrophobicContact CZ3-CB 3.88Å; W237-F451 HydrophobicContact CB-CB 4.37Å; W237-F451 AromaticContact CD1-CD2 3.99Å; W237-F451 HydrophobicContact CG-CB 3.9Å
238	I	98.7	Very high	97.7	Very high	89 Å²	89	34.4 Å²	34.4	46%	0.456	18%	0.182	S	C	.	.	H	α-helix	trans	-62	-45.3	172.6	-69.2	165.3	0	0	0	110.1	L234 T235 C236 A241 L242	L234-I238 HydrophobicContact CD1-CD1 4.45Å; L234-I238 HydrophobicContact CG-CD1 4.1Å; L234-I238 WeakPolarHBondContact O-CG1 3.06Å; L234-I238 PolarHBondContact O-N 2.77Å; T235-I238 PolarHBondContact O-N 3.43Å; C236-I238 PolarHBondContact O-N 3.44Å; I238-A241 PolarHBondContact O-N 2.98Å; I238-L242 HydrophobicContact CG2-CD1 4.11Å; I238-L242 VanDerWaalsContact O-CG 3.29Å; I238-L242 WeakPolarHBondContact O-CG 3.31Å; I238-L242 PolarHBondContact O-N 3.06Å
239	I	98.6	Very high	97.5	Very high	59 Å²	59	37.8 Å²	37.8	30%	0.303	20%	0.197	S	C	.	.	H	α-helix	trans	-61	-46.6	176.7	-65.7	166.1	0	0	0	110.6	T235 C236 L242 A243 L409 F413	T235-I239 HydrophobicContact CG2-CD1 4.23Å; T235-I239 WeakPolarHBondContact O-CG1 3.49Å; T235-I239 PolarHBondContact O-N 3.32Å; C236-I239 PolarHBondContact O-N 3.22Å; I239-L242 PolarHBondContact O-N 3.13Å; I239-A243 WeakPolarHBondContact O-CB 3.37Å; I239-A243 PolarHBondContact O-N 2.95Å; I239-L409 HydrophobicContact CG2-CD1 4Å; I239-L409 HydrophobicContact CG2-CD2 4.19Å; I239-F413 HydrophobicContact CG2-CE1 4.26Å; I239-F413 HydrophobicContact CG2-CZ 4.04Å
240	C	98.5	Very high	97.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-47.8	176.1	-70.9	0	0	0	0	112.1	Q154 C236 W237 L242 A243 V244 F413 L416	Q154-C240 PolarHBondContact OE1-SG 2.92Å; C236-C240 PolarHBondContact O-N 3.47Å; C236-C240 PolarHBondContact O-SG 3.02Å; C236-C240 VanDerWaalsContact O-SG 3.33Å; W237-C240 HydrophobicContact CE3-CB 4.23Å; W237-C240 PolarHBondContact O-N 3.21Å; C240-L242 VanDerWaalsContact C-N 3.33Å; C240-L242 PolarHBondContact O-N 2.78Å; C240-A243 PolarHBondContact O-N 3.11Å; C240-A243 VanDerWaalsContact O-N 3.16Å; C240-V244 WeakPolarHBondContact O-CG2 3.37Å; C240-V244 PolarHBondContact O-N 2.92Å; C240-F413 HydrophobicContact CB-CD1 4.24Å; C240-F413 HydrophobicContact CB-CE1 4.2Å; C240-L416 HydrophobicContact CB-CD2 3.94Å
241	A	98.4	Very high	97.3	Very high	13 Å²	13	37.5 Å²	37.5	11%	0.107	20%	0.195	C	C	.	.	H	α-helix	trans	-57.4	-46.1	178	0	0	0	0	0	111.2	W237 I238 V244 I245 C447	W237-A241 VanDerWaalsContact O-CB 3.32Å; W237-A241 WeakPolarHBondContact O-CB 3.04Å; W237-A241 PolarHBondContact O-N 2.93Å; I238-A241 PolarHBondContact O-N 2.98Å; A241-V244 PolarHBondContact O-N 3.08Å; A241-I245 WeakPolarHBondContact O-CA 3.3Å; A241-I245 VanDerWaalsContact O-CB 3.24Å; A241-I245 WeakPolarHBondContact O-CB 3.22Å; A241-I245 PolarHBondContact O-N 3.11Å; A241-C447 HydrophobicContact CB-CB 4.05Å
242	L	98	Very high	97.2	Very high	112 Å²	112	33 Å²	33	59%	0.586	17%	0.171	S	C	*	.	H	α-helix	trans	-64	-40	177.1	-68.6	173.6	0	0	0	112.5	I238 I239 C240 I245	I238-L242 HydrophobicContact CG2-CD1 4.11Å; I238-L242 VanDerWaalsContact O-CG 3.29Å; I238-L242 WeakPolarHBondContact O-CG 3.31Å; I238-L242 PolarHBondContact O-N 3.06Å; I239-L242 PolarHBondContact O-N 3.13Å; C240-L242 VanDerWaalsContact C-N 3.33Å; C240-L242 PolarHBondContact O-N 2.78Å; L242-I245 VanDerWaalsContact O-CG2 3.27Å; L242-I245 WeakPolarHBondContact O-CG2 3.36Å
243	A	98	Very high	97.1	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-37.6	179.6	0	0	0	0	0	112.5	I239 C240 S250 L251 V254 F413	I239-A243 WeakPolarHBondContact O-CB 3.37Å; I239-A243 PolarHBondContact O-N 2.95Å; C240-A243 PolarHBondContact O-N 3.11Å; C240-A243 VanDerWaalsContact O-N 3.16Å; A243-S250 CarbonylContact O-C 3.11Å; A243-S250 VanDerWaalsContact O-C 3.27Å; A243-S250 WeakPolarHBondContact O-CB 3.39Å; A243-S250 PolarHBondContact O-OG 3.36Å; A243-L251 PolarHBondContact O-N 3.31Å; A243-L251 VanDerWaalsContact O-N 3.08Å; A243-V254 HydrophobicContact CB-CG1 4.46Å; A243-V254 HydrophobicContact CB-CG2 4.24Å; A243-F413 HydrophobicContact CB-CD1 3.73Å; A243-F413 HydrophobicContact CB-CD2 4.02Å; A243-F413 HydrophobicContact CB-CE1 3.58Å; A243-F413 HydrophobicContact CB-CE2 3.87Å; A243-F413 HydrophobicContact CB-CG 3.95Å; A243-F413 HydrophobicContact CB-CZ 3.63Å
244	V	96.9	Very high	97	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-102.2	5.3	-177.5	-50.2	0	0	0	0	114	C240 A241 K246 G247 F413 L416 L420 R443	C240-V244 WeakPolarHBondContact O-CG2 3.37Å; C240-V244 PolarHBondContact O-N 2.92Å; A241-V244 PolarHBondContact O-N 3.08Å; V244-K246 VanDerWaalsContact C-N 3.25Å; V244-K246 PolarHBondContact O-N 2.75Å; V244-G247 WeakPolarHBondContact O-CA 3.42Å; V244-G247 PolarHBondContact O-N 2.95Å; V244-F413 HydrophobicContact CG1-CB 4.17Å; V244-L416 HydrophobicContact CG1-CD2 4.27Å; V244-L416 HydrophobicContact CG2-CD2 3.75Å; V244-L416 HydrophobicContact CG2-CG 4.26Å; V244-L420 HydrophobicContact CB-CD1 4.42Å; V244-L420 HydrophobicContact CG2-CD1 3.64Å; V244-R443 PolarHBondContact O-NH1 3.11Å
245	I	96.6	Very high	96.9	Very high	39 Å²	39	38.2 Å²	38.2	20%	0.2	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.5	-171.9	-162.8	168.4	0	0	0	113.1	A241 L242 M440 I444	A241-I245 WeakPolarHBondContact O-CA 3.3Å; A241-I245 VanDerWaalsContact O-CB 3.24Å; A241-I245 WeakPolarHBondContact O-CB 3.22Å; A241-I245 PolarHBondContact O-N 3.11Å; L242-I245 VanDerWaalsContact O-CG2 3.27Å; L242-I245 WeakPolarHBondContact O-CG2 3.36Å; I245-M440 HydrophobicContact CG1-CB 4.1Å; I245-M440 HydrophobicContact CG1-CG 4.01Å; I245-M440 HydrophobicContact CG1-SD 4.34Å; I245-M440 WeakPolarHBondContact O-CG 3.04Å; I245-I444 HydrophobicContact CD1-CD1 4.18Å
246	K	94	Very high	96.8	Very high	132 Å²	132	39.7 Å²	39.7	57%	0.574	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	20	175.3	-63.4	178.8	179.8	179.7	0	112.4	V244 Q249 S250	V244-K246 VanDerWaalsContact C-N 3.25Å; V244-K246 PolarHBondContact O-N 2.75Å; K246-Q249 HydrophobicContact CB-CB 4.37Å; K246-S250 PolarHBondContact N-OG 3.38Å
247	G	93.8	Very high	96.7	Very high	2 Å²	2	44.8 Å²	44.8	2%	0.021	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	-140.9	-172.9	0	0	0	0	0	112.1	V244 Q249 S250 L251	V244-G247 WeakPolarHBondContact O-CA 3.42Å; V244-G247 PolarHBondContact O-N 2.95Å; G247-Q249 PolarHBondContact O-N 3.12Å; G247-Q249 VanDerWaalsContact O-N 3.08Å; G247-S250 PolarHBondContact O-N 3.11Å; G247-S250 VanDerWaalsContact O-N 3.15Å; G247-S250 PolarHBondContact O-OG 3.44Å; G247-L251 PolarHBondContact O-N 2.88Å; G247-L251 VanDerWaalsContact O-N 3.07Å
248	V	94.4	Very high	96.6	Very high	6 Å²	6	44.8 Å²	44.8	4%	0.036	22%	0.217	C	C	.	.	H	α-helix	trans	-57.7	-24.5	-178.3	-67.1	0	0	0	0	114.9	W60 G252 Y324 E417	W60-V248 HydrophobicContact CD2-CB 4.42Å; W60-V248 HydrophobicContact CE3-CB 3.9Å; W60-V248 HydrophobicContact CE3-CG1 4.48Å; W60-V248 HydrophobicContact CH2-CB 3.91Å; W60-V248 HydrophobicContact CH2-CG1 3.63Å; W60-V248 HydrophobicContact CZ2-CB 4.44Å; W60-V248 HydrophobicContact CZ2-CG1 4.01Å; W60-V248 HydrophobicContact CZ3-CB 3.63Å; W60-V248 HydrophobicContact CZ3-CG1 3.91Å; V248-G252 PolarHBondContact O-N 3.37Å; V248-Y324 HydrophobicContact CB-CD2 4.48Å; V248-Y324 HydrophobicContact CG1-CD1 4.23Å; V248-Y324 HydrophobicContact CG1-CD2 3.33Å; V248-Y324 HydrophobicContact CG1-CE1 4.17Å; V248-Y324 HydrophobicContact CG1-CE2 3.29Å; V248-Y324 HydrophobicContact CG1-CG 3.79Å; V248-Y324 HydrophobicContact CG2-CD1 4.05Å; V248-Y324 HydrophobicContact CG2-CE1 4.16Å; V248-Y324 HydrophobicContact CG2-CG 4.21Å; V248-E417 HydrophobicContact CG1-CG 4.42Å
249	Q	93.6	Very high	96.3	Very high	88 Å²	88	40.7 Å²	40.7	41%	0.411	20%	0.197	S	C	.	.	H	α-helix	trans	-70.9	-29.9	179.4	-65.8	-177.3	-11.8	0	0	114	K246 G247 K253	K246-Q249 HydrophobicContact CB-CB 4.37Å; G247-Q249 PolarHBondContact O-N 3.12Å; G247-Q249 VanDerWaalsContact O-N 3.08Å; Q249-K253 WeakPolarHBondContact O-CD 3.15Å; Q249-K253 WeakPolarHBondContact O-CE 3.44Å; Q249-K253 WeakPolarHBondContact O-CG 3.4Å
250	S	95.5	Very high	96.2	Very high	15 Å²	15	41.7 Å²	41.7	11%	0.105	20%	0.202	C	C	.	.	H	α-helix	trans	-91.1	-39.4	172.2	51.6	0	0	0	0	110.9	A243 K246 G247 G252 K253 V254	A243-S250 CarbonylContact O-C 3.11Å; A243-S250 VanDerWaalsContact O-C 3.27Å; A243-S250 WeakPolarHBondContact O-CB 3.39Å; A243-S250 PolarHBondContact O-OG 3.36Å; K246-S250 PolarHBondContact N-OG 3.38Å; G247-S250 PolarHBondContact O-N 3.11Å; G247-S250 VanDerWaalsContact O-N 3.15Å; G247-S250 PolarHBondContact O-OG 3.44Å; S250-G252 PolarHBondContact O-N 2.98Å; S250-K253 PolarHBondContact O-N 2.91Å; S250-V254 PolarHBondContact O-N 3.33Å; S250-V254 VanDerWaalsContact O-N 3.16Å
251	L	96.9	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.4	-52.2	177.7	172.7	52.4	0	0	0	111.2	T69 A243 G247 K253 V254 S255 M321 F413 E417	T69-L251 HydrophobicContact CG2-CD1 4.23Å; T69-L251 HydrophobicContact CG2-CD2 3.86Å; T69-L251 HydrophobicContact CG2-CG 3.86Å; A243-L251 PolarHBondContact O-N 3.31Å; A243-L251 VanDerWaalsContact O-N 3.08Å; G247-L251 PolarHBondContact O-N 2.88Å; G247-L251 VanDerWaalsContact O-N 3.07Å; L251-K253 PolarHBondContact O-N 2.77Å; L251-K253 VanDerWaalsContact O-N 3.1Å; L251-V254 PolarHBondContact O-N 2.74Å; L251-S255 PolarHBondContact O-N 3.43Å; L251-S255 PolarHBondContact O-OG 2.92Å; L251-M321 HydrophobicContact CD2-SD 4.45Å; L251-F413 HydrophobicContact CD1-CB 3.41Å; L251-F413 VanDerWaalsContact CD1-CB 3.41Å; L251-F413 HydrophobicContact CD1-CD2 4.06Å; L251-F413 HydrophobicContact CD1-CG 4.15Å; L251-E417 HydrophobicContact CD2-CB 4.11Å; L251-E417 HydrophobicContact CD2-CG 4.31Å
252	G	96	Very high	95.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-54.9	-33.7	179.8	0	0	0	0	0	114.1	V248 S250 Y256	V248-G252 PolarHBondContact O-N 3.37Å; S250-G252 PolarHBondContact O-N 2.98Å; G252-Y256 WeakPolarHBondContact O-CD2 3.43Å
253	K	96.6	Very high	95.8	Very high	131 Å²	131	41 Å²	41	57%	0.57	19%	0.191	S	C	*	.	H	α-helix	trans	-73.2	-43.2	178.1	-64.7	178	-176.1	179.6	0	112.2	Q249 S250 L251 S255	Q249-K253 WeakPolarHBondContact O-CD 3.15Å; Q249-K253 WeakPolarHBondContact O-CE 3.44Å; Q249-K253 WeakPolarHBondContact O-CG 3.4Å; S250-K253 PolarHBondContact O-N 2.91Å; L251-K253 PolarHBondContact O-N 2.77Å; L251-K253 VanDerWaalsContact O-N 3.1Å; K253-S255 VanDerWaalsContact C-N 3.27Å; K253-S255 PolarHBondContact O-N 3.47Å
254	V	97.2	Very high	95.8	Very high	51 Å²	51	44.1 Å²	44.1	31%	0.309	21%	0.209	S	C	.	.	H	α-helix	trans	-67.6	-33.7	176.9	179.6	0	0	0	0	110.5	A243 S250 L251 Y256 F257 T258 F413	A243-V254 HydrophobicContact CB-CG1 4.46Å; A243-V254 HydrophobicContact CB-CG2 4.24Å; S250-V254 PolarHBondContact O-N 3.33Å; S250-V254 VanDerWaalsContact O-N 3.16Å; L251-V254 PolarHBondContact O-N 2.74Å; V254-Y256 PolarHBondContact O-N 3.39Å; V254-Y256 VanDerWaalsContact O-N 3.16Å; V254-F257 PolarHBondContact O-N 2.91Å; V254-T258 HydrophobicContact CG1-CG2 4.11Å; V254-T258 PolarHBondContact O-N 3.46Å; V254-F413 HydrophobicContact CG1-CD2 4.24Å; V254-F413 HydrophobicContact CG1-CE2 3.53Å; V254-F413 HydrophobicContact CG1-CZ 4.28Å
255	S	96.6	Very high	95.8	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-26.9	179.9	-63.9	0	0	0	0	114.5	T69 L251 K253 F257 T258 G259	T69-S255 WeakPolarHBondContact CA-OG 3.47Å; T69-S255 WeakPolarHBondContact CB-OG 3.32Å; T69-S255 VanDerWaalsContact OG1-CB 3.27Å; T69-S255 WeakPolarHBondContact OG1-CB 3.34Å; T69-S255 PolarHBondContact OG1-OG 2.7Å; L251-S255 PolarHBondContact O-N 3.43Å; L251-S255 PolarHBondContact O-OG 2.92Å; K253-S255 VanDerWaalsContact C-N 3.27Å; K253-S255 PolarHBondContact O-N 3.47Å; S255-F257 VanDerWaalsContact C-N 3.29Å; S255-F257 PolarHBondContact O-N 3.49Å; S255-T258 WeakPolarHBondContact CA-OG1 3.34Å; S255-T258 PolarHBondContact O-N 2.73Å; S255-G259 WeakPolarHBondContact O-CA 3.43Å; S255-G259 PolarHBondContact O-N 2.93Å
256	Y	96.5	Very high	95.7	Very high	84 Å²	84	42.9 Å²	42.9	33%	0.329	20%	0.203	S	C	.	.	H	α-helix	trans	-57.4	-44.1	173	-79.5	-83.1	0	0	0	112.3	L64 E65 M68 G252 V254 I260	L64-Y256 HydrophobicContact CB-CE1 4.27Å; L64-Y256 HydrophobicContact CD2-CD1 4.49Å; L64-Y256 HydrophobicContact CD2-CE1 3.48Å; L64-Y256 VanDerWaalsContact CD2-CE1 3.48Å; L64-Y256 HydrophobicContact CG-CD1 4.49Å; L64-Y256 HydrophobicContact CG-CE1 3.55Å; E65-Y256 HydrophobicContact CG-CE2 3.64Å; M68-Y256 HydrophobicContact CG-CD1 4.28Å; G252-Y256 WeakPolarHBondContact O-CD2 3.43Å; V254-Y256 PolarHBondContact O-N 3.39Å; V254-Y256 VanDerWaalsContact O-N 3.16Å; Y256-I260 WeakPolarHBondContact O-CB 3.45Å; Y256-I260 WeakPolarHBondContact O-CD1 3.43Å; Y256-I260 VanDerWaalsContact O-CG1 3.26Å; Y256-I260 WeakPolarHBondContact O-CG1 3.29Å; Y256-I260 PolarHBondContact O-N 3.04Å
257	F	97.1	Very high	95.8	Very high	107 Å²	107	39.2 Å²	39.2	47%	0.469	19%	0.192	S	C	.	.	H	α-helix	trans	-72.4	-51.1	177	177.8	-101.4	0	0	0	110.1	V254 S255 G259 I260 F261 T406	V254-F257 PolarHBondContact O-N 2.91Å; S255-F257 VanDerWaalsContact C-N 3.29Å; S255-F257 PolarHBondContact O-N 3.49Å; F257-G259 VanDerWaalsContact C-N 3.29Å; F257-G259 PolarHBondContact O-N 2.89Å; F257-I260 PolarHBondContact O-N 3.42Å; F257-F261 HydrophobicContact CD2-CB 3.96Å; F257-F261 HydrophobicContact CD2-CG 4.28Å; F257-F261 HydrophobicContact CE1-CB 4.35Å; F257-F261 HydrophobicContact CE1-CD1 4.12Å; F257-F261 HydrophobicContact CE1-CG 4.29Å; F257-F261 HydrophobicContact CE2-CB 3.7Å; F257-F261 HydrophobicContact CE2-CD1 4.05Å; F257-F261 AromaticContact CE2-CD2 3.63Å; F257-F261 HydrophobicContact CE2-CD2 3.63Å; F257-F261 HydrophobicContact CE2-CE2 4.23Å; F257-F261 AromaticContact CE2-CG 3.52Å; F257-F261 HydrophobicContact CE2-CG 3.52Å; F257-F261 HydrophobicContact CG-CB 4.4Å; F257-F261 HydrophobicContact CZ-CB 3.91Å; F257-F261 AromaticContact CZ-CD1 3.53Å; F257-F261 HydrophobicContact CZ-CD1 3.53Å; F257-F261 AromaticContact CZ-CD2 3.95Å; F257-F261 HydrophobicContact CZ-CD2 3.95Å; F257-F261 AromaticContact CZ-CE1 3.96Å; F257-F261 HydrophobicContact CZ-CE1 3.96Å; F257-F261 HydrophobicContact CZ-CE2 4.33Å; F257-F261 AromaticContact CZ-CG 3.52Å; F257-F261 HydrophobicContact CZ-CG 3.52Å; F257-F261 HydrophobicContact CZ-CZ 4.34Å; F257-F261 WeakPolarHBondContact O-CB 3.27Å; F257-F261 PolarHBondContact O-N 3.4Å; F257-T406 HydrophobicContact CD1-CG2 4.12Å; F257-T406 HydrophobicContact CE1-CG2 3.84Å
258	T	96.3	Very high	96	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.043	21%	0.207	C	C	.	.	H	α-helix	trans	-69.4	-25	-173.3	62.7	0	0	0	0	114.1	V254 S255 P262 T406 F413	V254-T258 HydrophobicContact CG1-CG2 4.11Å; V254-T258 PolarHBondContact O-N 3.46Å; S255-T258 WeakPolarHBondContact CA-OG1 3.34Å; S255-T258 PolarHBondContact O-N 2.73Å; T258-P262 WeakPolarHBondContact O-CD 3.35Å; T258-P262 WeakPolarHBondContact O-CG 3.41Å; T258-T406 HydrophobicContact CG2-CG2 4Å; T258-F413 HydrophobicContact CG2-CE2 4.01Å
259	G	93.7	Very high	95.9	Very high	3 Å²	3	42.4 Å²	42.4	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-83.6	-29	176.7	0	0	0	0	0	114	S255 F257 Y263	S255-G259 WeakPolarHBondContact O-CA 3.43Å; S255-G259 PolarHBondContact O-N 2.93Å; F257-G259 VanDerWaalsContact C-N 3.29Å; F257-G259 PolarHBondContact O-N 2.89Å; G259-Y263 VanDerWaalsContact O-CD2 3.22Å; G259-Y263 WeakPolarHBondContact O-CD2 3.35Å; G259-Y263 WeakPolarHBondContact O-CE2 3.49Å
260	I	95.3	Very high	96	Very high	80 Å²	80	39.6 Å²	39.6	41%	0.41	20%	0.195	S	C	.	.	H	α-helix	trans	-99	-46	-174.8	-61.7	173.9	0	0	0	111.7	M68 Y256 F257 P262 Y263 V264	M68-I260 HydrophobicContact CE-CD1 4.11Å; M68-I260 HydrophobicContact CE-CG1 4.08Å; M68-I260 HydrophobicContact SD-CD1 4.18Å; M68-I260 HydrophobicContact SD-CG1 3.75Å; Y256-I260 WeakPolarHBondContact O-CB 3.45Å; Y256-I260 WeakPolarHBondContact O-CD1 3.43Å; Y256-I260 VanDerWaalsContact O-CG1 3.26Å; Y256-I260 WeakPolarHBondContact O-CG1 3.29Å; Y256-I260 PolarHBondContact O-N 3.04Å; F257-I260 PolarHBondContact O-N 3.42Å; I260-P262 VanDerWaalsContact C-CD 3.48Å; I260-P262 VanDerWaalsContact C-N 3.35Å; I260-Y263 PolarHBondContact O-N 2.96Å; I260-V264 HydrophobicContact CG2-CG2 4.47Å; I260-V264 PolarHBondContact O-N 3.42Å
261	F	96.2	Very high	96.1	Very high	43 Å²	43	43.6 Å²	43.6	19%	0.189	21%	0.214	C	C	.	.	H	α-helix	trans	-57.4	-39.3	-171.6	-177.7	-105.6	0	0	0	113.7	F257 Y263 V264 M265 I402 T406	F257-F261 HydrophobicContact CD2-CB 3.96Å; F257-F261 HydrophobicContact CD2-CG 4.28Å; F257-F261 HydrophobicContact CE1-CB 4.35Å; F257-F261 HydrophobicContact CE1-CD1 4.12Å; F257-F261 HydrophobicContact CE1-CG 4.29Å; F257-F261 HydrophobicContact CE2-CB 3.7Å; F257-F261 HydrophobicContact CE2-CD1 4.05Å; F257-F261 AromaticContact CE2-CD2 3.63Å; F257-F261 HydrophobicContact CE2-CD2 3.63Å; F257-F261 HydrophobicContact CE2-CE2 4.23Å; F257-F261 AromaticContact CE2-CG 3.52Å; F257-F261 HydrophobicContact CE2-CG 3.52Å; F257-F261 HydrophobicContact CG-CB 4.4Å; F257-F261 HydrophobicContact CZ-CB 3.91Å; F257-F261 AromaticContact CZ-CD1 3.53Å; F257-F261 HydrophobicContact CZ-CD1 3.53Å; F257-F261 AromaticContact CZ-CD2 3.95Å; F257-F261 HydrophobicContact CZ-CD2 3.95Å; F257-F261 AromaticContact CZ-CE1 3.96Å; F257-F261 HydrophobicContact CZ-CE1 3.96Å; F257-F261 HydrophobicContact CZ-CE2 4.33Å; F257-F261 AromaticContact CZ-CG 3.52Å; F257-F261 HydrophobicContact CZ-CG 3.52Å; F257-F261 HydrophobicContact CZ-CZ 4.34Å; F257-F261 WeakPolarHBondContact O-CB 3.27Å; F257-F261 PolarHBondContact O-N 3.4Å; F261-Y263 VanDerWaalsContact C-N 3.27Å; F261-Y263 PolarHBondContact O-N 2.88Å; F261-V264 WeakPolarHBondContact O-CB 3.19Å; F261-V264 PolarHBondContact O-N 3.46Å; F261-M265 HydrophobicContact CD1-CG 4.09Å; F261-M265 HydrophobicContact CD2-CE 4.41Å; F261-M265 HydrophobicContact CE1-CG 3.66Å; F261-M265 HydrophobicContact CE1-SD 4.23Å; F261-M265 HydrophobicContact CE2-CE 3.72Å; F261-M265 HydrophobicContact CE2-CG 4.19Å; F261-M265 HydrophobicContact CE2-SD 4.14Å; F261-M265 HydrophobicContact CZ-CE 3.93Å; F261-M265 HydrophobicContact CZ-CG 3.71Å; F261-M265 HydrophobicContact CZ-SD 3.7Å; F261-M265 WeakPolarHBondContact O-CG 3.36Å; F261-M265 PolarHBondContact O-N 2.73Å; F261-I402 HydrophobicContact CE1-CB 4.47Å; F261-I402 HydrophobicContact CE1-CD1 4.17Å; F261-I402 HydrophobicContact CE1-CG1 3.97Å; F261-I402 HydrophobicContact CE1-CG2 3.87Å; F261-I402 HydrophobicContact CZ-CD1 4.11Å; F261-I402 HydrophobicContact CZ-CG1 4.39Å; F261-I402 HydrophobicContact CZ-CG2 4.02Å; F261-T406 HydrophobicContact CB-CG2 4.47Å; F261-T406 HydrophobicContact CD1-CG2 4.11Å
262	P	95.5	Very high	96	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-32.8	175.6	-27.9	38.2	0	0	0	114.4	T258 I260 M265 L266 M403 T406 L407	T258-P262 WeakPolarHBondContact O-CD 3.35Å; T258-P262 WeakPolarHBondContact O-CG 3.41Å; I260-P262 VanDerWaalsContact C-CD 3.48Å; I260-P262 VanDerWaalsContact C-N 3.35Å; P262-M265 PolarHBondContact O-N 2.97Å; P262-L266 VanDerWaalsContact O-CB 3.3Å; P262-L266 WeakPolarHBondContact O-CB 3.15Å; P262-L266 VanDerWaalsContact O-CG 3.27Å; P262-L266 WeakPolarHBondContact O-CG 3.18Å; P262-L266 PolarHBondContact O-N 3.4Å; P262-M403 HydrophobicContact CB-CG 4.26Å; P262-T406 HydrophobicContact CG-CG2 3.83Å; P262-L407 HydrophobicContact CB-CD1 4.24Å; P262-L407 HydrophobicContact CB-CD2 3.44Å; P262-L407 VanDerWaalsContact CB-CD2 3.44Å; P262-L407 HydrophobicContact CB-CG 3.66Å; P262-L407 HydrophobicContact CG-CD2 3.58Å; P262-L407 HydrophobicContact CG-CG 3.76Å
263	Y	96.1	Very high	95.9	Very high	64 Å²	64	46.5 Å²	46.5	25%	0.251	23%	0.226	S	C	.	.	H	α-helix	trans	-69.4	-40.7	176.2	-70.7	-72.8	0	0	0	112.1	I71 G259 I260 F261 M265 L266 T267 I341 T345	I71-Y263 HydrophobicContact CG2-CE2 3.97Å; G259-Y263 VanDerWaalsContact O-CD2 3.22Å; G259-Y263 WeakPolarHBondContact O-CD2 3.35Å; G259-Y263 WeakPolarHBondContact O-CE2 3.49Å; I260-Y263 PolarHBondContact O-N 2.96Å; F261-Y263 VanDerWaalsContact C-N 3.27Å; F261-Y263 PolarHBondContact O-N 2.88Å; Y263-M265 VanDerWaalsContact C-N 3.26Å; Y263-M265 PolarHBondContact O-N 3.02Å; Y263-L266 PolarHBondContact O-N 3.37Å; Y263-T267 WeakPolarHBondContact O-CB 3.4Å; Y263-T267 PolarHBondContact O-N 3.12Å; Y263-T267 PolarHBondContact O-OG1 3.42Å; Y263-I341 WeakPolarHBondContact OH-CG2 3.47Å; Y263-T345 HydrophobicContact CE1-CG2 3.81Å; Y263-T345 WeakPolarHBondContact CE1-OG1 3.12Å; Y263-T345 PolarHBondContact OH-OG1 3.06Å
264	V	97.2	Very high	95.9	Very high	70 Å²	70	43.7 Å²	43.7	42%	0.424	22%	0.22	S	C	.	.	H	α-helix	trans	-57.3	-46.4	173.8	-176.1	0	0	0	0	109.6	I260 F261 T267 I268	I260-V264 HydrophobicContact CG2-CG2 4.47Å; I260-V264 PolarHBondContact O-N 3.42Å; F261-V264 WeakPolarHBondContact O-CB 3.19Å; F261-V264 PolarHBondContact O-N 3.46Å; V264-T267 PolarHBondContact O-N 3.22Å; V264-I268 HydrophobicContact CG1-CD1 4.11Å; V264-I268 VanDerWaalsContact O-CG1 3.31Å; V264-I268 WeakPolarHBondContact O-CG1 3.35Å; V264-I268 PolarHBondContact O-N 3.29Å
265	M	96	Very high	95.8	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.059	24%	0.236	C	C	.	.	H	α-helix	trans	-68.3	-46.2	179.6	-64.1	-59.7	99.7	0	0	112.6	F261 P262 Y263 T267 I268 L269 L399 I402 M403	F261-M265 HydrophobicContact CD1-CG 4.09Å; F261-M265 HydrophobicContact CD2-CE 4.41Å; F261-M265 HydrophobicContact CE1-CG 3.66Å; F261-M265 HydrophobicContact CE1-SD 4.23Å; F261-M265 HydrophobicContact CE2-CE 3.72Å; F261-M265 HydrophobicContact CE2-CG 4.19Å; F261-M265 HydrophobicContact CE2-SD 4.14Å; F261-M265 HydrophobicContact CZ-CE 3.93Å; F261-M265 HydrophobicContact CZ-CG 3.71Å; F261-M265 HydrophobicContact CZ-SD 3.7Å; F261-M265 WeakPolarHBondContact O-CG 3.36Å; F261-M265 PolarHBondContact O-N 2.73Å; P262-M265 PolarHBondContact O-N 2.97Å; Y263-M265 VanDerWaalsContact C-N 3.26Å; Y263-M265 PolarHBondContact O-N 3.02Å; M265-T267 VanDerWaalsContact C-N 3.26Å; M265-T267 PolarHBondContact O-N 3.36Å; M265-I268 HydrophobicContact CE-CD1 3.71Å; M265-I268 PolarHBondContact O-N 3.45Å; M265-L269 WeakPolarHBondContact O-CB 3.39Å; M265-L269 WeakPolarHBondContact O-CG 3.38Å; M265-L269 PolarHBondContact O-N 3.12Å; M265-L399 HydrophobicContact CE-CD2 4.48Å; M265-L399 HydrophobicContact SD-CB 4.34Å; M265-L399 HydrophobicContact SD-CD2 3.65Å; M265-I402 HydrophobicContact SD-CG2 4.45Å; M265-M403 HydrophobicContact CB-CB 3.65Å; M265-M403 HydrophobicContact CB-CG 3.75Å; M265-M403 HydrophobicContact CB-SD 3.87Å; M265-M403 HydrophobicContact CG-CB 3.98Å; M265-M403 HydrophobicContact CG-CG 4.48Å
266	L	95	Very high	95.7	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-40.6	176.3	-79	172.8	0	0	0	111.3	V80 P262 Y263 L270 T345 Y348 A349 V352 M403	V80-L266 HydrophobicContact CG2-CD2 4.5Å; P262-L266 VanDerWaalsContact O-CB 3.3Å; P262-L266 WeakPolarHBondContact O-CB 3.15Å; P262-L266 VanDerWaalsContact O-CG 3.27Å; P262-L266 WeakPolarHBondContact O-CG 3.18Å; P262-L266 PolarHBondContact O-N 3.4Å; Y263-L266 PolarHBondContact O-N 3.37Å; L266-L270 VanDerWaalsContact O-CB 3.31Å; L266-L270 WeakPolarHBondContact O-CB 3.47Å; L266-L270 PolarHBondContact O-N 3.17Å; L266-T345 HydrophobicContact CD1-CG2 4.01Å; L266-Y348 HydrophobicContact CB-CD1 4.2Å; L266-Y348 HydrophobicContact CB-CE1 3.86Å; L266-Y348 HydrophobicContact CD1-CD1 4.46Å; L266-A349 HydrophobicContact CD2-CB 4.18Å; L266-V352 HydrophobicContact CD2-CG2 4.3Å; L266-M403 HydrophobicContact CB-SD 4.41Å; L266-M403 HydrophobicContact CD2-CE 4.15Å; L266-M403 HydrophobicContact CD2-SD 3.58Å; L266-M403 VanDerWaalsContact CD2-SD 3.58Å; L266-M403 HydrophobicContact CG-SD 3.59Å; L266-M403 VanDerWaalsContact CG-SD 3.59Å
267	T	97.1	Very high	95.7	Very high	56 Å²	56	47.4 Å²	47.4	34%	0.344	25%	0.246	S	C	.	.	H	α-helix	trans	-68.5	-43.3	177.6	-61.9	0	0	0	0	112.4	Y263 V264 M265 L269 L270 I271 Y348	Y263-T267 WeakPolarHBondContact O-CB 3.4Å; Y263-T267 PolarHBondContact O-N 3.12Å; Y263-T267 PolarHBondContact O-OG1 3.42Å; V264-T267 PolarHBondContact O-N 3.22Å; M265-T267 VanDerWaalsContact C-N 3.26Å; M265-T267 PolarHBondContact O-N 3.36Å; T267-L269 VanDerWaalsContact C-N 3.34Å; T267-L269 PolarHBondContact O-N 3.49Å; T267-L270 PolarHBondContact O-N 2.86Å; T267-I271 HydrophobicContact CG2-CD1 4.03Å; T267-I271 WeakPolarHBondContact O-CG1 3.44Å; T267-I271 PolarHBondContact O-N 3.26Å; T267-Y348 WeakPolarHBondContact CA-OH 3.47Å; T267-Y348 PolarHBondContact OG1-OH 3.26Å
268	I	96.3	Very high	95.6	Very high	66 Å²	66	43 Å²	43	34%	0.338	23%	0.231	S	C	.	.	H	α-helix	trans	-59.7	-47.4	174.7	-70.6	169.4	0	0	0	110.5	V264 M265 L270 I271 R272 W396 L399	V264-I268 HydrophobicContact CG1-CD1 4.11Å; V264-I268 VanDerWaalsContact O-CG1 3.31Å; V264-I268 WeakPolarHBondContact O-CG1 3.35Å; V264-I268 PolarHBondContact O-N 3.29Å; M265-I268 HydrophobicContact CE-CD1 3.71Å; M265-I268 PolarHBondContact O-N 3.45Å; I268-L270 VanDerWaalsContact C-N 3.35Å; I268-L270 PolarHBondContact O-N 2.89Å; I268-I271 PolarHBondContact O-N 3.1Å; I268-R272 PolarHBondContact O-N 3.45Å; I268-R272 VanDerWaalsContact O-N 3.07Å; I268-W396 HydrophobicContact CG2-CZ3 4.24Å; I268-L399 HydrophobicContact CG2-CD1 4.18Å
269	L	93.9	Very high	95.6	Very high	9 Å²	9	42.9 Å²	42.9	5%	0.047	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-40.9	177.7	-69.4	173.7	0	0	0	111	M265 T267 R272 S273 V352 W396 F400 M403	M265-L269 WeakPolarHBondContact O-CB 3.39Å; M265-L269 WeakPolarHBondContact O-CG 3.38Å; M265-L269 PolarHBondContact O-N 3.12Å; T267-L269 VanDerWaalsContact C-N 3.34Å; T267-L269 PolarHBondContact O-N 3.49Å; L269-R272 PolarHBondContact O-N 3.18Å; L269-S273 VanDerWaalsContact O-CB 3.24Å; L269-S273 WeakPolarHBondContact O-CB 3.29Å; L269-S273 PolarHBondContact O-N 3.09Å; L269-S273 PolarHBondContact O-OG 2.92Å; L269-V352 HydrophobicContact CB-CG1 3.71Å; L269-W396 HydrophobicContact CD2-CE3 4.18Å; L269-F400 HydrophobicContact CD1-CB 4.41Å; L269-F400 HydrophobicContact CD1-CD2 4.13Å; L269-M403 HydrophobicContact CD1-CE 3.88Å; L269-M403 HydrophobicContact CD1-SD 3.88Å
270	L	95.6	Very high	95.8	Very high	29 Å²	29	50.8 Å²	50.8	15%	0.152	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-53.3	177.1	-176.8	63.9	0	0	0	111.1	L266 T267 I268 R272 S273 V274 Y348 F351 V352	L266-L270 VanDerWaalsContact O-CB 3.31Å; L266-L270 WeakPolarHBondContact O-CB 3.47Å; L266-L270 PolarHBondContact O-N 3.17Å; T267-L270 PolarHBondContact O-N 2.86Å; I268-L270 VanDerWaalsContact C-N 3.35Å; I268-L270 PolarHBondContact O-N 2.89Å; L270-R272 PolarHBondContact O-N 3.48Å; L270-S273 PolarHBondContact O-N 3.18Å; L270-V274 HydrophobicContact CD1-CG1 3.7Å; L270-V274 HydrophobicContact CG-CG1 4.2Å; L270-V274 WeakPolarHBondContact O-CG1 3.49Å; L270-V274 WeakPolarHBondContact O-CG2 3.42Å; L270-V274 PolarHBondContact O-N 3.46Å; L270-Y348 HydrophobicContact CD2-CD2 4.23Å; L270-Y348 HydrophobicContact CD2-CE1 4.34Å; L270-Y348 HydrophobicContact CD2-CE2 3.36Å; L270-Y348 VanDerWaalsContact CD2-CZ 3.43Å; L270-Y348 WeakPolarHBondContact CD2-OH 3.46Å; L270-F351 HydrophobicContact CD1-CB 3.72Å; L270-V352 HydrophobicContact CB-CG2 3.76Å; L270-V352 HydrophobicContact CD1-CG2 3.95Å; L270-V352 HydrophobicContact CG-CG2 4.43Å
271	I	96.9	Very high	95.8	Very high	98 Å²	98	51.3 Å²	51.3	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-55.2	-45.6	-179.5	-67.5	166.2	0	0	0	109.6	T267 I268 V274 L275	T267-I271 HydrophobicContact CG2-CD1 4.03Å; T267-I271 WeakPolarHBondContact O-CG1 3.44Å; T267-I271 PolarHBondContact O-N 3.26Å; I268-I271 PolarHBondContact O-N 3.1Å; I271-V274 WeakPolarHBondContact O-CG2 3.39Å; I271-L275 HydrophobicContact CG2-CD1 4.09Å; I271-L275 WeakPolarHBondContact O-CD1 3.5Å; I271-L275 WeakPolarHBondContact O-CG 3.48Å
272	R	94.4	Very high	95.8	Very high	59 Å²	59	49.2 Å²	49.2	22%	0.223	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-48.1	176.7	179.2	59.6	-175.1	147.8	3.2	111.9	I268 L269 L270 V274 L275 L276 W396	I268-R272 PolarHBondContact O-N 3.45Å; I268-R272 VanDerWaalsContact O-N 3.07Å; L269-R272 PolarHBondContact O-N 3.18Å; L270-R272 PolarHBondContact O-N 3.48Å; R272-V274 PolarHBondContact O-N 3.39Å; R272-L275 PolarHBondContact O-N 3.43Å; R272-L276 VanDerWaalsContact NH2-CD2 3.3Å; R272-L276 PolarHBondContact O-N 3.42Å; R272-W396 HydrophobicContact CB-CE3 4.29Å; R272-W396 HydrophobicContact CB-CH2 3.69Å; R272-W396 HydrophobicContact CB-CZ2 4.33Å; R272-W396 HydrophobicContact CB-CZ3 3.65Å; R272-W396 VanDerWaalsContact CD-CZ2 3.47Å; R272-W396 HydrophobicContact CG-CD2 4.16Å; R272-W396 HydrophobicContact CG-CE3 4.03Å; R272-W396 HydrophobicContact CG-CH2 3.45Å; R272-W396 VanDerWaalsContact CG-CH2 3.45Å; R272-W396 HydrophobicContact CG-CZ2 3.58Å; R272-W396 HydrophobicContact CG-CZ3 3.68Å
273	S	94.5	Very high	95.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-41.3	-171.7	-52.4	0	0	0	0	112	L269 L270 L275 L276 A279 N356	L269-S273 VanDerWaalsContact O-CB 3.24Å; L269-S273 WeakPolarHBondContact O-CB 3.29Å; L269-S273 PolarHBondContact O-N 3.09Å; L269-S273 PolarHBondContact O-OG 2.92Å; L270-S273 PolarHBondContact O-N 3.18Å; S273-L275 VanDerWaalsContact C-N 3.26Å; S273-L275 PolarHBondContact O-N 2.92Å; S273-L276 WeakPolarHBondContact O-CB 3.26Å; S273-L276 PolarHBondContact O-N 2.87Å; S273-A279 VanDerWaalsContact O-CB 3.23Å; S273-A279 WeakPolarHBondContact O-CB 3.36Å; S273-N356 WeakPolarHBondContact CB-OD1 3.04Å; S273-N356 PolarHBondContact OG-ND2 2.92Å; S273-N356 PolarHBondContact OG-OD1 3.17Å
274	V	96.5	Very high	95.9	Very high	73 Å²	73	52.5 Å²	52.5	44%	0.442	28%	0.281	S	S	.	.	H	α-helix	trans	-72.2	-19.9	179.6	-59	0	0	0	0	113.3	L270 I271 R272 L276	L270-V274 HydrophobicContact CD1-CG1 3.7Å; L270-V274 HydrophobicContact CG-CG1 4.2Å; L270-V274 WeakPolarHBondContact O-CG1 3.49Å; L270-V274 WeakPolarHBondContact O-CG2 3.42Å; L270-V274 PolarHBondContact O-N 3.46Å; I271-V274 WeakPolarHBondContact O-CG2 3.39Å; R272-V274 PolarHBondContact O-N 3.39Å; V274-L276 VanDerWaalsContact C-N 3.32Å
275	L	96.2	Very high	95.7	Very high	126 Å²	126	52.9 Å²	52.9	66%	0.66	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-4.3	176.1	-67.6	174.5	0	0	0	112.9	I271 R272 S273	I271-L275 HydrophobicContact CG2-CD1 4.09Å; I271-L275 WeakPolarHBondContact O-CD1 3.5Å; I271-L275 WeakPolarHBondContact O-CG 3.48Å; R272-L275 PolarHBondContact O-N 3.43Å; S273-L275 VanDerWaalsContact C-N 3.26Å; S273-L275 PolarHBondContact O-N 2.92Å
276	L	94.7	Very high	95.7	Very high	10 Å²	10	52.3 Å²	52.3	5%	0.052	27%	0.273	C	S	.	.	S	Bend	trans	-78.1	146.6	176.3	-66.5	171	0	0	0	111.2	R272 S273 V274 A279 N356 F359 M390	R272-L276 VanDerWaalsContact NH2-CD2 3.3Å; R272-L276 PolarHBondContact O-N 3.42Å; S273-L276 WeakPolarHBondContact O-CB 3.26Å; S273-L276 PolarHBondContact O-N 2.87Å; V274-L276 VanDerWaalsContact C-N 3.32Å; L276-A279 WeakPolarHBondContact O-CB 3.07Å; L276-A279 PolarHBondContact O-N 2.88Å; L276-N356 WeakPolarHBondContact CD1-OD1 3.23Å; L276-F359 HydrophobicContact CB-CB 3.84Å; L276-F359 HydrophobicContact CB-CD2 3.87Å; L276-F359 HydrophobicContact CB-CG 3.86Å; L276-F359 HydrophobicContact CD1-CB 4.01Å; L276-F359 HydrophobicContact CD1-CD1 3.84Å; L276-F359 HydrophobicContact CD1-CD2 4.47Å; L276-F359 HydrophobicContact CD1-CE1 4.46Å; L276-F359 HydrophobicContact CD1-CG 3.83Å; L276-F359 HydrophobicContact CD2-CD2 4.34Å; L276-F359 HydrophobicContact CD2-CE2 4.36Å; L276-F359 HydrophobicContact CD2-CG 4.47Å; L276-F359 HydrophobicContact CG-CD2 4.45Å; L276-F359 HydrophobicContact CG-CG 4.27Å; L276-M390 HydrophobicContact CD1-CE 3.66Å; L276-M390 HydrophobicContact CD1-CG 4.24Å; L276-M390 HydrophobicContact CD1-SD 3.97Å
277	P	96.1	Very high	95.7	Very high	78 Å²	78	55.8 Å²	55.8	51%	0.506	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	143.2	174.4	28.8	-34.2	0	0	0	110.3	A279 F359 L362	P277-A279 PolarHBondContact O-N 2.55Å; P277-F359 HydrophobicContact CG-CD2 3.83Å; P277-F359 HydrophobicContact CG-CE2 3.9Å; P277-F359 VanDerWaalsContact O-CA 3.28Å; P277-F359 WeakPolarHBondContact O-CA 3.26Å; P277-F359 WeakPolarHBondContact O-CD2 3.2Å; P277-L362 HydrophobicContact CB-CD2 3.79Å; P277-L362 HydrophobicContact CG-CD2 4.41Å
278	G	95.1	Very high	95.7	Very high	15 Å²	15	56.7 Å²	56.7	16%	0.155	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-8.7	-176.9	0	0	0	0	0	115.2	K280 D281 G282 G358	G278-K280 PolarHBondContact O-N 3.45Å; G278-K280 VanDerWaalsContact O-N 3.15Å; G278-D281 PolarHBondContact O-N 2.78Å; G278-G282 PolarHBondContact O-N 2.96Å; G278-G358 CarbonylContact O-C 3.36Å; G278-G358 WeakPolarHBondContact O-CA 3.1Å
279	A	96.4	Very high	95.7	Very high	4 Å²	4	56.1 Å²	56.1	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-55.5	-35.5	177.9	0	0	0	0	0	113	S273 L276 P277 D281 G282 V283 S355	S273-A279 VanDerWaalsContact O-CB 3.23Å; S273-A279 WeakPolarHBondContact O-CB 3.36Å; L276-A279 WeakPolarHBondContact O-CB 3.07Å; L276-A279 PolarHBondContact O-N 2.88Å; P277-A279 PolarHBondContact O-N 2.55Å; A279-D281 VanDerWaalsContact C-N 3.31Å; A279-D281 PolarHBondContact O-N 3.2Å; A279-G282 PolarHBondContact O-N 2.94Å; A279-V283 WeakPolarHBondContact O-CG2 3.42Å; A279-V283 PolarHBondContact O-N 3.38Å; A279-S355 WeakPolarHBondContact CA-O 3.42Å
280	K	97	Very high	95.8	Very high	170 Å²	170	59.1 Å²	59.1	74%	0.739	31%	0.313	S	S	*	.	H	α-helix	trans	-57.6	-40.7	175.7	-175.6	-177.7	175.7	-174.3	0	112.6	G278 G282 V283 L284	G278-K280 PolarHBondContact O-N 3.45Å; G278-K280 VanDerWaalsContact O-N 3.15Å; K280-G282 VanDerWaalsContact C-N 3.32Å; K280-V283 PolarHBondContact O-N 3.44Å; K280-L284 WeakPolarHBondContact O-CB 3.45Å; K280-L284 PolarHBondContact O-N 2.88Å
281	D	95.8	Very high	95.9	Very high	90 Å²	90	63.6 Å²	63.6	48%	0.481	33%	0.332	S	S	.	.	H	α-helix	trans	-68.4	-37.1	-178.9	-60.2	-35.6	0	0	0	110.8	G278 A279 Y285	G278-D281 PolarHBondContact O-N 2.78Å; A279-D281 VanDerWaalsContact C-N 3.31Å; A279-D281 PolarHBondContact O-N 3.2Å; D281-Y285 VanDerWaalsContact O-CB 3.29Å; D281-Y285 WeakPolarHBondContact O-CB 3.41Å; D281-Y285 PolarHBondContact O-N 2.9Å
282	G	95.4	Very high	95.9	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-49.3	171.3	0	0	0	0	0	113.2	G278 A279 K280 L284 Y285 Y286 F354	G278-G282 PolarHBondContact O-N 2.96Å; A279-G282 PolarHBondContact O-N 2.94Å; K280-G282 VanDerWaalsContact C-N 3.32Å; G282-L284 VanDerWaalsContact C-N 3.33Å; G282-L284 PolarHBondContact O-N 3.44Å; G282-Y285 PolarHBondContact O-N 3.23Å; G282-Y286 PolarHBondContact O-N 3.17Å; G282-F354 VanDerWaalsContact CA-O 3.23Å; G282-F354 WeakPolarHBondContact CA-O 3.29Å
283	V	96.8	Very high	95.9	Very high	33 Å²	33	62.6 Å²	62.6	20%	0.2	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-40.4	176.9	173.4	0	0	0	0	111.7	A279 K280 Y286 L287 F351 S355	A279-V283 WeakPolarHBondContact O-CG2 3.42Å; A279-V283 PolarHBondContact O-N 3.38Å; K280-V283 PolarHBondContact O-N 3.44Å; V283-Y286 WeakPolarHBondContact O-CB 3.48Å; V283-Y286 PolarHBondContact O-N 2.89Å; V283-L287 HydrophobicContact CG1-CD1 3.98Å; V283-L287 WeakPolarHBondContact O-CG 3.35Å; V283-L287 PolarHBondContact O-N 3.39Å; V283-L287 VanDerWaalsContact O-N 3.12Å; V283-F351 HydrophobicContact CG1-CD1 4Å; V283-F351 HydrophobicContact CG1-CE1 3.82Å; V283-F351 HydrophobicContact CG2-CD1 4.25Å; V283-S355 VanDerWaalsContact CG2-OG 3.31Å; V283-S355 WeakPolarHBondContact CG2-OG 3.38Å
284	L	97	Very high	95.9	Very high	101 Å²	101	64.3 Å²	64.3	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-47.7	176.2	-176	61.9	0	0	0	110.3	K280 G282 Y286 L287 T288	K280-L284 WeakPolarHBondContact O-CB 3.45Å; K280-L284 PolarHBondContact O-N 2.88Å; G282-L284 VanDerWaalsContact C-N 3.33Å; G282-L284 PolarHBondContact O-N 3.44Å; L284-Y286 VanDerWaalsContact C-N 3.27Å; L284-Y286 PolarHBondContact O-N 3.11Å; L284-L287 PolarHBondContact O-N 3.44Å; L284-L287 VanDerWaalsContact O-N 3.12Å; L284-T288 WeakPolarHBondContact O-CB 3.4Å; L284-T288 PolarHBondContact O-N 2.88Å; L284-T288 PolarHBondContact O-OG1 3.39Å
285	Y	94.1	Very high	95.9	Very high	78 Å²	78	69.7 Å²	69.7	31%	0.306	36%	0.359	S	S	.	.	H	α-helix	trans	-57.6	-39.5	176.1	-177	-92.5	0	0	0	112.7	H88 D281 G282 L287 F354 V368 A369	H88-Y285 PolarHBondContact CE1-OH 3.39Å; H88-Y285 VanDerWaalsContact CE1-OH 3.24Å; H88-Y285 AromaticContact ND1-CE1 3.54Å; H88-Y285 AromaticContact ND1-CZ 3.65Å; H88-Y285 PolarHBondContact ND1-OH 3.36Å; D281-Y285 VanDerWaalsContact O-CB 3.29Å; D281-Y285 WeakPolarHBondContact O-CB 3.41Å; D281-Y285 PolarHBondContact O-N 2.9Å; G282-Y285 PolarHBondContact O-N 3.23Å; Y285-L287 PolarHBondContact O-N 3.35Å; Y285-F354 HydrophobicContact CD1-CD1 4.02Å; Y285-F354 AromaticContact CD1-CE1 3.63Å; Y285-F354 HydrophobicContact CD1-CE1 3.63Å; Y285-F354 AromaticContact CE1-CE1 3.91Å; Y285-F354 HydrophobicContact CE1-CE1 3.91Å; Y285-V368 HydrophobicContact CD1-CB 4.08Å; Y285-V368 HydrophobicContact CD1-CG1 3.48Å; Y285-V368 VanDerWaalsContact CD1-CG1 3.48Å; Y285-V368 HydrophobicContact CD2-CB 4.29Å; Y285-V368 HydrophobicContact CE1-CG1 4.09Å; Y285-V368 HydrophobicContact CG-CB 3.89Å; Y285-V368 HydrophobicContact CG-CG1 3.75Å; Y285-A369 HydrophobicContact CE2-CB 3.94Å; Y285-A369 WeakPolarHBondContact OH-CB 3.24Å
286	Y	95.2	Very high	95.6	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-41.4	176	177.6	-136.1	0	0	0	113	F83 C87 G92 G93 G282 V283 L284 F351 F354	F83-Y286 WeakPolarHBondContact CE1-OH 3.33Å; C87-Y286 HydrophobicContact CB-CD2 4.12Å; C87-Y286 HydrophobicContact CB-CE2 3.78Å; G92-Y286 CarbonylContact C-O 3.6Å; G93-Y286 PolarHBondContact N-O 2.86Å; G282-Y286 PolarHBondContact O-N 3.17Å; V283-Y286 WeakPolarHBondContact O-CB 3.48Å; V283-Y286 PolarHBondContact O-N 2.89Å; L284-Y286 VanDerWaalsContact C-N 3.27Å; L284-Y286 PolarHBondContact O-N 3.11Å; Y286-F351 HydrophobicContact CE1-CD2 4.22Å; Y286-F351 HydrophobicContact CE1-CE2 4.21Å; Y286-F351 HydrophobicContact CE1-CG 4.46Å; Y286-F351 HydrophobicContact CE1-CZ 4.46Å; Y286-F354 HydrophobicContact CD1-CD2 4.34Å; Y286-F354 AromaticContact CD2-CD2 3.36Å; Y286-F354 HydrophobicContact CD2-CD2 3.36Å; Y286-F354 AromaticContact CD2-CE2 3.31Å; Y286-F354 HydrophobicContact CD2-CE2 3.31Å; Y286-F354 HydrophobicContact CD2-CG 4.14Å; Y286-F354 HydrophobicContact CD2-CZ 4.07Å; Y286-F354 HydrophobicContact CE2-CD2 4.09Å; Y286-F354 AromaticContact CE2-CE2 3.94Å; Y286-F354 HydrophobicContact CE2-CE2 3.94Å; Y286-F354 HydrophobicContact CG-CB 4.24Å; Y286-F354 AromaticContact CG-CD2 3.53Å; Y286-F354 HydrophobicContact CG-CD2 3.53Å; Y286-F354 AromaticContact CG-CE2 3.98Å; Y286-F354 HydrophobicContact CG-CE2 3.98Å; Y286-F354 AromaticContact CG-CG 3.93Å; Y286-F354 HydrophobicContact CG-CG 3.93Å
287	L	95.5	Very high	95.3	Very high	75 Å²	75	68.1 Å²	68.1	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-94	-23.4	-171.7	-65	178.1	0	0	0	114.1	V283 L284 Y285 P289 F351	V283-L287 HydrophobicContact CG1-CD1 3.98Å; V283-L287 WeakPolarHBondContact O-CG 3.35Å; V283-L287 PolarHBondContact O-N 3.39Å; V283-L287 VanDerWaalsContact O-N 3.12Å; L284-L287 PolarHBondContact O-N 3.44Å; L284-L287 VanDerWaalsContact O-N 3.12Å; Y285-L287 PolarHBondContact O-N 3.35Å; L287-P289 VanDerWaalsContact O-CD 3.25Å; L287-P289 WeakPolarHBondContact O-CD 3.21Å; L287-F351 HydrophobicContact CD1-CE1 4.02Å; L287-F351 HydrophobicContact CD1-CZ 4.18Å; L287-F351 HydrophobicContact CD2-CZ 4.14Å
288	T	96.7	Very high	94.9	Very high	75 Å²	75	67.5 Å²	67.5	46%	0.46	34%	0.344	S	S	.	.			trans	-64.6	117.9	179.4	-65.8	0	0	0	0	109.9	G93 L284	G93-T288 PolarHBondContact N-O 3.02Å; L284-T288 WeakPolarHBondContact O-CB 3.4Å; L284-T288 PolarHBondContact O-N 2.88Å; L284-T288 PolarHBondContact O-OG1 3.39Å
289	P	96.5	Very high	94.8	Very high	54 Å²	54	66.8 Å²	66.8	35%	0.351	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-84.8	127.9	-177.4	32.1	-32.1	0	0	0	111.6	A94 L287 F291	A94-P289 HydrophobicContact CB-CB 4Å; L287-P289 VanDerWaalsContact O-CD 3.25Å; L287-P289 WeakPolarHBondContact O-CD 3.21Å; P289-F291 HydrophobicContact CB-CD2 4.36Å; P289-F291 HydrophobicContact CB-CE1 4.21Å; P289-F291 HydrophobicContact CB-CE2 3.92Å; P289-F291 HydrophobicContact CB-CZ 3.83Å; P289-F291 HydrophobicContact CG-CD2 4.33Å; P289-F291 HydrophobicContact CG-CE2 3.56Å; P289-F291 HydrophobicContact CG-CZ 3.68Å
290	D	95.5	Very high	94.6	Very high	72 Å²	72	70.5 Å²	70.5	39%	0.385	35%	0.35	S	S	.	.			trans	-95.3	92.1	161.5	179.7	8.1	0	0	0	110.1	G91 A94 S292 R293	G91-D290 PolarHBondContact O-N 3.01Å; A94-D290 WeakPolarHBondContact CB-O 3.44Å; D290-S292 VanDerWaalsContact CG-OG 3.23Å; D290-S292 PolarHBondContact O-N 3.31Å; D290-S292 VanDerWaalsContact O-N 3.14Å; D290-S292 VanDerWaalsContact OD1-CB 3.24Å; D290-S292 WeakPolarHBondContact OD1-CB 3.45Å; D290-S292 PolarHBondContact OD1-N 3.39Å; D290-S292 PolarHBondContact OD1-OG 3.41Å; D290-S292 PolarHBondContact OD2-OG 3.28Å; D290-R293 HydrophobicContact CB-CG 4.34Å; D290-R293 PolarHBondContact O-N 2.83Å
291	F	97.3	Very high	94.3	Very high	123 Å²	123	62.7 Å²	62.7	54%	0.539	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-63.6	-16.9	-179.5	-65.9	-72.9	0	0	0	113.8	I97 P289 R293 L294	I97-F291 HydrophobicContact CD1-CD1 4.41Å; I97-F291 HydrophobicContact CD1-CE1 3.83Å; P289-F291 HydrophobicContact CB-CD2 4.36Å; P289-F291 HydrophobicContact CB-CE1 4.21Å; P289-F291 HydrophobicContact CB-CE2 3.92Å; P289-F291 HydrophobicContact CB-CZ 3.83Å; P289-F291 HydrophobicContact CG-CD2 4.33Å; P289-F291 HydrophobicContact CG-CE2 3.56Å; P289-F291 HydrophobicContact CG-CZ 3.68Å; F291-R293 PolarHBondContact O-N 3.32Å; F291-L294 HydrophobicContact CD1-CD1 3.89Å; F291-L294 WeakPolarHBondContact O-CB 3.24Å; F291-L294 PolarHBondContact O-N 2.98Å
292	S	97.4	Very high	94	Very high	70 Å²	70	59.2 Å²	59.2	49%	0.49	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-64.4	-31.1	177.8	77.1	0	0	0	0	111.8	D290 L294 K295	D290-S292 VanDerWaalsContact CG-OG 3.23Å; D290-S292 PolarHBondContact O-N 3.31Å; D290-S292 VanDerWaalsContact O-N 3.14Å; D290-S292 VanDerWaalsContact OD1-CB 3.24Å; D290-S292 WeakPolarHBondContact OD1-CB 3.45Å; D290-S292 PolarHBondContact OD1-N 3.39Å; D290-S292 PolarHBondContact OD1-OG 3.41Å; D290-S292 PolarHBondContact OD2-OG 3.28Å; S292-L294 PolarHBondContact O-N 2.94Å; S292-K295 PolarHBondContact O-N 3.39Å
293	R	94.3	Very high	94	Very high	65 Å²	65	59.2 Å²	59.2	25%	0.245	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-64.1	-25.4	177	-65.3	-67.8	-66.9	131.6	6.7	112.8	K89 N90 D290 F291 K295 D296 V299	K89-R293 PolarHBondContact O-NE 3.19Å; K89-R293 PolarHBondContact O-NH2 3.02Å; N90-R293 PolarHBondContact OD1-NH2 3.34Å; D290-R293 HydrophobicContact CB-CG 4.34Å; D290-R293 PolarHBondContact O-N 2.83Å; F291-R293 PolarHBondContact O-N 3.32Å; R293-K295 PolarHBondContact O-N 3.06Å; R293-K295 VanDerWaalsContact O-N 3.1Å; R293-D296 IonicContact CZ-OD2 2.97Å; R293-D296 IonicContact NH1-OD2 2.68Å; R293-D296 PolarHBondContact NH1-OD2 2.95Å; R293-D296 IonicContact NH2-OD2 3.92Å; R293-D296 PolarHBondContact NH2-OD2 3.45Å; R293-D296 WeakPolarHBondContact O-CB 3.46Å; R293-D296 PolarHBondContact O-N 3.11Å; R293-V299 HydrophobicContact CB-CG2 4.22Å; R293-V299 VanDerWaalsContact O-CG2 3.29Å; R293-V299 WeakPolarHBondContact O-CG2 3.33Å
294	L	95.5	Very high	93.8	Very high	38 Å²	38	57.6 Å²	57.6	20%	0.199	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-65.4	-15.7	180	-62.9	-177.9	0	0	0	114.2	A94 I97 P98 F291 S292 D296 V299 W300	A94-L294 HydrophobicContact CB-CD2 4.39Å; A94-L294 HydrophobicContact CB-CG 4.46Å; I97-L294 HydrophobicContact CD1-CD1 4.16Å; P98-L294 HydrophobicContact CG-CD2 4.21Å; F291-L294 HydrophobicContact CD1-CD1 3.89Å; F291-L294 WeakPolarHBondContact O-CB 3.24Å; F291-L294 PolarHBondContact O-N 2.98Å; S292-L294 PolarHBondContact O-N 2.94Å; L294-D296 VanDerWaalsContact C-N 3.28Å; L294-V299 HydrophobicContact CD2-CG1 4.37Å; L294-W300 PolarHBondContact O-NE1 3.11Å
295	K	95	Very high	93.4	Very high	187 Å²	187	54 Å²	54	81%	0.813	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-75.7	-17.6	174.1	-63.7	178.2	-178.1	176.2	0	113	S292 R293 P297	S292-K295 PolarHBondContact O-N 3.39Å; R293-K295 PolarHBondContact O-N 3.06Å; R293-K295 VanDerWaalsContact O-N 3.1Å; K295-P297 WeakPolarHBondContact O-CD 3.46Å
296	D	90.6	Very high	93.4	Very high	51 Å²	51	50.2 Å²	50.2	27%	0.273	26%	0.256	S	S	.	.			trans	-84	116.1	-179.7	-178.7	-5.3	0	0	0	109.9	R293 L294 Q298 V299	R293-D296 IonicContact CZ-OD2 2.97Å; R293-D296 IonicContact NH1-OD2 2.68Å; R293-D296 PolarHBondContact NH1-OD2 2.95Å; R293-D296 IonicContact NH2-OD2 3.92Å; R293-D296 PolarHBondContact NH2-OD2 3.45Å; R293-D296 WeakPolarHBondContact O-CB 3.46Å; R293-D296 PolarHBondContact O-N 3.11Å; L294-D296 VanDerWaalsContact C-N 3.28Å; D296-Q298 PolarHBondContact O-N 3.5Å; D296-Q298 VanDerWaalsContact O-N 3.14Å; D296-Q298 VanDerWaalsContact OD1-CB 3.26Å; D296-Q298 WeakPolarHBondContact OD1-CB 3.31Å; D296-Q298 PolarHBondContact OD1-N 3.02Å; D296-V299 HydrophobicContact CB-CG2 4.04Å; D296-V299 WeakPolarHBondContact O-CB 3.5Å; D296-V299 PolarHBondContact O-N 3.29Å; D296-V299 VanDerWaalsContact O-N 3.09Å
297	P	89.1	Confident	93.4	Very high	51 Å²	51	50.2 Å²	50.2	33%	0.331	26%	0.256	S	S	.	.	H	α-helix	trans	-57.2	-26.7	177.8	-24.6	35.2	0	0	0	113.7	K295 V299 W300 A301 Y536	K295-P297 WeakPolarHBondContact O-CD 3.46Å; P297-V299 PolarHBondContact O-N 3.2Å; P297-W300 PolarHBondContact O-N 3.15Å; P297-A301 PolarHBondContact O-N 2.9Å; P297-A301 VanDerWaalsContact O-N 3.12Å; P297-Y536 HydrophobicContact CB-CD2 4.47Å; P297-Y536 HydrophobicContact CB-CE2 4.17Å; P297-Y536 HydrophobicContact CG-CE2 4.21Å
298	Q	87.9	Confident	93.2	Very high	66 Å²	66	47.1 Å²	47.1	31%	0.308	24%	0.239	S	C	.	.	H	α-helix	trans	-63.7	-31.7	178.7	-170.8	61.1	36.9	0	0	112	D296 W300 A301 D302	D296-Q298 PolarHBondContact O-N 3.5Å; D296-Q298 VanDerWaalsContact O-N 3.14Å; D296-Q298 VanDerWaalsContact OD1-CB 3.26Å; D296-Q298 WeakPolarHBondContact OD1-CB 3.31Å; D296-Q298 PolarHBondContact OD1-N 3.02Å; Q298-W300 VanDerWaalsContact C-N 3.26Å; Q298-W300 PolarHBondContact O-N 2.91Å; Q298-A301 PolarHBondContact O-N 3.32Å; Q298-D302 PolarHBondContact NE2-OD1 3.08Å; Q298-D302 WeakPolarHBondContact O-CB 3.5Å; Q298-D302 PolarHBondContact O-N 3.02Å
299	V	92.4	Very high	92.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-38.7	177.3	170.3	0	0	0	0	111.1	N90 F95 P98 R293 L294 D296 P297 A303	N90-V299 HydrophobicContact CB-CB 4.49Å; N90-V299 HydrophobicContact CB-CG1 4.1Å; N90-V299 HydrophobicContact CB-CG2 3.98Å; F95-V299 HydrophobicContact CD2-CG1 4.19Å; P98-V299 HydrophobicContact CG-CG1 3.91Å; R293-V299 HydrophobicContact CB-CG2 4.22Å; R293-V299 VanDerWaalsContact O-CG2 3.29Å; R293-V299 WeakPolarHBondContact O-CG2 3.33Å; L294-V299 HydrophobicContact CD2-CG1 4.37Å; D296-V299 HydrophobicContact CB-CG2 4.04Å; D296-V299 WeakPolarHBondContact O-CB 3.5Å; D296-V299 PolarHBondContact O-N 3.29Å; D296-V299 VanDerWaalsContact O-N 3.09Å; P297-V299 PolarHBondContact O-N 3.2Å; V299-A303 WeakPolarHBondContact O-CB 3.28Å; V299-A303 PolarHBondContact O-N 3.46Å; V299-A303 VanDerWaalsContact O-N 3.16Å
300	W	92.5	Very high	92.6	Very high	82 Å²	82	43.3 Å²	43.3	31%	0.311	21%	0.211	S	C	.	.	H	α-helix	trans	-74.5	-38.3	177.8	-63.5	86.5	0	0	0	112.1	P98 L101 M102 L294 P297 Q298 A303 A304	P98-W300 HydrophobicContact CB-CD2 3.8Å; P98-W300 HydrophobicContact CB-CE3 3.48Å; P98-W300 VanDerWaalsContact CB-CE3 3.48Å; P98-W300 HydrophobicContact CB-CG 4.43Å; P98-W300 HydrophobicContact CB-CH2 4.25Å; P98-W300 HydrophobicContact CB-CZ3 3.74Å; L101-W300 HydrophobicContact CD1-CH2 3.85Å; L101-W300 HydrophobicContact CD1-CZ3 3.79Å; M102-W300 HydrophobicContact CE-CB 4.47Å; M102-W300 HydrophobicContact CE-CE3 4.04Å; L294-W300 PolarHBondContact O-NE1 3.11Å; P297-W300 PolarHBondContact O-N 3.15Å; Q298-W300 VanDerWaalsContact C-N 3.26Å; Q298-W300 PolarHBondContact O-N 2.91Å; W300-A303 PolarHBondContact O-N 2.99Å; W300-A304 PolarHBondContact O-N 2.68Å
301	A	89	Confident	92.6	Very high	5 Å²	5	39.9 Å²	39.9	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-42.7	175.2	0	0	0	0	0	112.3	P297 Q298 A303 A304 T305 L529	P297-A301 PolarHBondContact O-N 2.9Å; P297-A301 VanDerWaalsContact O-N 3.12Å; Q298-A301 PolarHBondContact O-N 3.32Å; A301-A303 VanDerWaalsContact C-N 3.34Å; A301-A303 PolarHBondContact O-N 2.89Å; A301-A304 PolarHBondContact O-N 3.11Å; A301-T305 WeakPolarHBondContact O-CB 3.3Å; A301-T305 PolarHBondContact O-N 3.37Å; A301-T305 PolarHBondContact O-OG1 3.45Å; A301-L529 HydrophobicContact CB-CD2 4.1Å
302	D	90.8	Very high	92.4	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-42.3	175.4	-79.1	0.4	0	0	0	111	L86 K89 N90 F95 Q298 T305 Q306	L86-D302 HydrophobicContact CD2-CB 4.13Å; K89-D302 IonicContact NZ-OD1 2.75Å; K89-D302 IonicContact NZ-OD2 3.17Å; K89-D302 PolarHBondContact NZ-OD2 2.82Å; N90-D302 WeakPolarHBondContact ND2-CB 3.19Å; N90-D302 PolarHBondContact ND2-OD2 3.36Å; F95-D302 HydrophobicContact CE2-CB 4.14Å; Q298-D302 PolarHBondContact NE2-OD1 3.08Å; Q298-D302 WeakPolarHBondContact O-CB 3.5Å; Q298-D302 PolarHBondContact O-N 3.02Å; D302-T305 PolarHBondContact O-N 3.05Å; D302-Q306 WeakPolarHBondContact O-CB 3.36Å; D302-Q306 PolarHBondContact O-N 3.18Å
303	A	94.8	Very high	92.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-46.5	176.3	0	0	0	0	0	112.2	F95 P98 M102 V299 W300 A301 Q306 I307	F95-A303 HydrophobicContact CD2-CB 4.5Å; F95-A303 HydrophobicContact CE2-CB 3.72Å; F95-A303 HydrophobicContact CZ-CB 3.94Å; P98-A303 HydrophobicContact CB-CB 3.85Å; P98-A303 HydrophobicContact CG-CB 4.24Å; M102-A303 HydrophobicContact CG-CB 4.28Å; V299-A303 WeakPolarHBondContact O-CB 3.28Å; V299-A303 PolarHBondContact O-N 3.46Å; V299-A303 VanDerWaalsContact O-N 3.16Å; W300-A303 PolarHBondContact O-N 2.99Å; A301-A303 VanDerWaalsContact C-N 3.34Å; A301-A303 PolarHBondContact O-N 2.89Å; A303-Q306 PolarHBondContact O-N 3.37Å; A303-I307 WeakPolarHBondContact O-CG1 3.14Å; A303-I307 PolarHBondContact O-N 3.49Å; A303-I307 VanDerWaalsContact O-N 3.08Å
304	A	92.8	Very high	92.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-46.1	177.8	0	0	0	0	0	111.8	M102 L106 W300 A301 Q306 I307 F308 L529	M102-A304 HydrophobicContact CE-CB 4.37Å; M102-A304 HydrophobicContact CG-CB 3.99Å; M102-A304 HydrophobicContact SD-CB 3.82Å; L106-A304 HydrophobicContact CD2-CB 3.91Å; W300-A304 PolarHBondContact O-N 2.68Å; A301-A304 PolarHBondContact O-N 3.11Å; A304-Q306 VanDerWaalsContact C-N 3.32Å; A304-Q306 PolarHBondContact O-N 3.36Å; A304-I307 PolarHBondContact O-N 2.82Å; A304-I307 VanDerWaalsContact O-N 3.14Å; A304-F308 WeakPolarHBondContact O-CD2 3.4Å; A304-F308 PolarHBondContact O-N 2.97Å; A304-L529 HydrophobicContact CB-CD1 3.38Å; A304-L529 HydrophobicContact CB-CD2 4.01Å; A304-L529 HydrophobicContact CB-CG 4.35Å
305	T	89	Confident	92.2	Very high	24 Å²	24	26.7 Å²	26.7	15%	0.147	13%	0.129	C	C	.	.	H	α-helix	trans	-61.4	-41.6	179.1	-54.5	0	0	0	0	111.2	A301 D302 I307 F308 F309 S474	A301-T305 WeakPolarHBondContact O-CB 3.3Å; A301-T305 PolarHBondContact O-N 3.37Å; A301-T305 PolarHBondContact O-OG1 3.45Å; D302-T305 PolarHBondContact O-N 3.05Å; T305-I307 VanDerWaalsContact C-N 3.35Å; T305-I307 PolarHBondContact O-N 2.85Å; T305-F308 PolarHBondContact O-N 3.11Å; T305-F309 WeakPolarHBondContact O-CB 3.3Å; T305-F309 PolarHBondContact O-N 2.83Å; T305-S474 WeakPolarHBondContact CG2-O 3.34Å
306	Q	93.3	Very high	92.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.3	-40.9	174.8	-178.1	62.2	24.9	0	0	112.1	G78 R82 F83 L86 Y99 D302 A303 A304 S310	G78-Q306 PolarHBondContact O-NE2 3.08Å; R82-Q306 VanDerWaalsContact CD-OE1 3.24Å; F83-Q306 HydrophobicContact CD2-CG 4.29Å; L86-Q306 HydrophobicContact CD1-CB 3.69Å; L86-Q306 HydrophobicContact CD1-CG 3.99Å; Y99-Q306 HydrophobicContact CD2-CG 4.39Å; Y99-Q306 HydrophobicContact CE2-CB 4.46Å; Y99-Q306 HydrophobicContact CE2-CG 3.85Å; D302-Q306 WeakPolarHBondContact O-CB 3.36Å; D302-Q306 PolarHBondContact O-N 3.18Å; A303-Q306 PolarHBondContact O-N 3.37Å; A304-Q306 VanDerWaalsContact C-N 3.32Å; A304-Q306 PolarHBondContact O-N 3.36Å; Q306-S310 WeakPolarHBondContact O-CB 3.46Å; Q306-S310 PolarHBondContact O-N 3.17Å
307	I	95.2	Very high	92.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.7	-47.3	176.8	-71.6	-67.3	0	0	0	111.1	Y99 M102 L103 G107 A303 A304 T305 L311	Y99-I307 HydrophobicContact CD2-CD1 3.83Å; Y99-I307 HydrophobicContact CD2-CG1 4Å; Y99-I307 HydrophobicContact CE1-CD1 4.15Å; Y99-I307 HydrophobicContact CE2-CD1 3.37Å; Y99-I307 HydrophobicContact CE2-CG1 3.89Å; Y99-I307 HydrophobicContact CG-CD1 4.39Å; M102-I307 HydrophobicContact CB-CG1 4Å; L103-I307 HydrophobicContact CB-CD1 3.89Å; L103-I307 HydrophobicContact CD1-CD1 4.26Å; G107-I307 VanDerWaalsContact CA-CG2 3.47Å; A303-I307 WeakPolarHBondContact O-CG1 3.14Å; A303-I307 PolarHBondContact O-N 3.49Å; A303-I307 VanDerWaalsContact O-N 3.08Å; A304-I307 PolarHBondContact O-N 2.82Å; A304-I307 VanDerWaalsContact O-N 3.14Å; T305-I307 VanDerWaalsContact C-N 3.35Å; T305-I307 PolarHBondContact O-N 2.85Å; I307-L311 HydrophobicContact CG2-CD1 3.87Å; I307-L311 WeakPolarHBondContact O-CB 3.47Å; I307-L311 PolarHBondContact O-N 3.41Å
308	F	90.9	Very high	92.9	Very high	10 Å²	10	13 Å²	13	4%	0.044	6%	0.062	C	C	.	.	H	α-helix	trans	-56.7	-52.5	176.5	-97.7	-84.4	0	0	0	111.9	L106 L110 A304 T305 G312 C313 C314 P478 L479 A482	L106-F308 HydrophobicContact CD1-CE2 3.78Å; L106-F308 HydrophobicContact CD1-CZ 4.02Å; L106-F308 HydrophobicContact CD2-CD2 3.88Å; L106-F308 HydrophobicContact CD2-CE2 3.38Å; L106-F308 HydrophobicContact CD2-CZ 4.41Å; L106-F308 HydrophobicContact CG-CD2 4.35Å; L106-F308 HydrophobicContact CG-CE2 3.62Å; L106-F308 HydrophobicContact CG-CZ 4.24Å; L110-F308 HydrophobicContact CD1-CE1 3.67Å; L110-F308 HydrophobicContact CD1-CE2 4.24Å; L110-F308 HydrophobicContact CD1-CZ 3.4Å; A304-F308 WeakPolarHBondContact O-CD2 3.4Å; A304-F308 PolarHBondContact O-N 2.97Å; T305-F308 PolarHBondContact O-N 3.11Å; F308-G312 PolarHBondContact O-N 3.09Å; F308-G312 VanDerWaalsContact O-N 3.09Å; F308-C313 HydrophobicContact CD1-CB 3.91Å; F308-C313 HydrophobicContact CE1-CB 4.22Å; F308-C313 PolarHBondContact O-N 2.95Å; F308-C313 VanDerWaalsContact O-N 3.13Å; F308-C314 HydrophobicContact CE1-CB 4.27Å; F308-P478 HydrophobicContact CD1-CB 4.42Å; F308-L479 HydrophobicContact CD2-CD2 3.84Å; F308-L479 HydrophobicContact CE1-CD2 4.46Å; F308-L479 HydrophobicContact CE2-CD2 3.37Å; F308-L479 HydrophobicContact CZ-CD2 3.74Å; F308-A482 HydrophobicContact CE1-CB 3.69Å; F308-A482 HydrophobicContact CZ-CB 3.66Å
309	F	87.9	Confident	93.3	Very high	43 Å²	43	9.8 Å²	9.8	19%	0.189	5%	0.047	C	C	.	.	H	α-helix	trans	-65.4	-45.2	-177.8	-176.8	-101.4	0	0	0	111.9	L149 Y152 Y153 T305 G312 I473	L149-F309 HydrophobicContact CD1-CE2 4.09Å; Y152-F309 WeakPolarHBondContact OH-CE2 3.41Å; Y152-F309 WeakPolarHBondContact OH-CZ 3.45Å; Y153-F309 HydrophobicContact CD2-CZ 4.38Å; Y153-F309 HydrophobicContact CE2-CZ 4.32Å; T305-F309 WeakPolarHBondContact O-CB 3.3Å; T305-F309 PolarHBondContact O-N 2.83Å; F309-G312 PolarHBondContact O-N 3.45Å; F309-I473 HydrophobicContact CD2-CG2 4.06Å; F309-I473 HydrophobicContact CE2-CG2 4.13Å
310	S	94.2	Very high	93.5	Very high	5 Å²	5	9.8 Å²	9.8	4%	0.035	5%	0.047	C	C	.	.	H	α-helix	trans	-73.3	-35.6	-175.2	-172.3	0	0	0	0	113.1	A74 N79 Q306 G312 N342	A74-S310 CarbonylContact C-O 3.56Å; A74-S310 WeakPolarHBondContact CA-O 3.44Å; N79-S310 PolarHBondContact ND2-OG 2.97Å; Q306-S310 WeakPolarHBondContact O-CB 3.46Å; Q306-S310 PolarHBondContact O-N 3.17Å; S310-G312 VanDerWaalsContact C-N 3.29Å; S310-N342 VanDerWaalsContact OG-CG 3.27Å; S310-N342 PolarHBondContact OG-ND2 2.74Å; S310-N342 PolarHBondContact OG-OD1 3.35Å
311	L	94.9	Very high	93.7	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-81.7	-13.8	176	-69.3	178.5	0	0	0	112.6	L103 F111 I307 A339 N342	L103-L311 HydrophobicContact CD1-CD1 4.06Å; F111-L311 HydrophobicContact CD2-CB 3.9Å; F111-L311 HydrophobicContact CD2-CD1 4.19Å; F111-L311 HydrophobicContact CD2-CD2 3.95Å; F111-L311 HydrophobicContact CD2-CG 4.23Å; F111-L311 HydrophobicContact CE2-CB 4.19Å; F111-L311 HydrophobicContact CE2-CD2 3.98Å; I307-L311 HydrophobicContact CG2-CD1 3.87Å; I307-L311 WeakPolarHBondContact O-CB 3.47Å; I307-L311 PolarHBondContact O-N 3.41Å; L311-A339 HydrophobicContact CD2-CB 4.08Å; L311-N342 HydrophobicContact CD2-CB 3.82Å; L311-N342 WeakPolarHBondContact CD2-ND2 3.45Å
312	G	92.1	Very high	94.1	Very high	4 Å²	4	5.7 Å²	5.7	4%	0.041	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	36.9	-176	0	0	0	0	0	112.7	Y73 F308 F309 S310 N315	Y73-G312 WeakPolarHBondContact OH-CA 3.38Å; Y73-G312 PolarHBondContact OH-O 3.43Å; F308-G312 PolarHBondContact O-N 3.09Å; F308-G312 VanDerWaalsContact O-N 3.09Å; F309-G312 PolarHBondContact O-N 3.45Å; S310-G312 VanDerWaalsContact C-N 3.29Å; G312-N315 PolarHBondContact O-ND2 2.72Å; G312-N315 PolarHBondContact O-OD1 3.12Å; G312-N315 VanDerWaalsContact O-OD1 3.11Å
313	C	94.2	Very high	94.3	Very high	3 Å²	3	5 Å²	5	2%	0.02	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	143.5	-179.6	-64.6	0	0	0	0	111.9	L110 E114 F308 N315	L110-C313 HydrophobicContact CB-CB 4.4Å; E114-C313 WeakPolarHBondContact OE2-CA 3.13Å; F308-C313 HydrophobicContact CD1-CB 3.91Å; F308-C313 HydrophobicContact CE1-CB 4.22Å; F308-C313 PolarHBondContact O-N 2.95Å; F308-C313 VanDerWaalsContact O-N 3.13Å; C313-N315 PolarHBondContact O-N 2.72Å
314	C	94.5	Very high	94.3	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	23.4	169.5	-55.3	0	0	0	0	115.2	E114 F308 I481 A482 E485	E114-C314 VanDerWaalsContact CD-N 3.34Å; E114-C314 WeakPolarHBondContact OE1-CA 3.23Å; E114-C314 PolarHBondContact OE1-N 3.07Å; E114-C314 PolarHBondContact OE2-N 3.39Å; F308-C314 HydrophobicContact CE1-CB 4.27Å; C314-I481 HydrophobicContact CB-CB 4.39Å; C314-I481 HydrophobicContact CB-CG2 4.01Å; C314-I481 WeakPolarHBondContact O-CG2 3.34Å; C314-A482 HydrophobicContact CB-CB 4.17Å; C314-A482 VanDerWaalsContact SG-CA 3.56Å; C314-A482 WeakPolarHBondContact SG-CB 3.24Å; C314-E485 PolarHBondContact SG-OE2 3.26Å
315	N	94.3	Very high	94.4	Very high	12 Å²	12	6.4 Å²	6.4	6%	0.064	3%	0.033	C	C	.	.	S	Bend	trans	-110.2	2.6	168.4	64.5	29.2	0	0	0	111.9	Y73 M142 L145 S146 G312 C313 G317	Y73-N315 VanDerWaalsContact OH-CG 3.31Å; Y73-N315 PolarHBondContact OH-ND2 2.97Å; Y73-N315 PolarHBondContact OH-OD1 3.38Å; M142-N315 CarbonylContact C-O 3.54Å; M142-N315 VanDerWaalsContact O-O 3.05Å; L145-N315 HydrophobicContact CD2-CB 4.24Å; S146-N315 PolarHBondContact OG-O 3.3Å; G312-N315 PolarHBondContact O-ND2 2.72Å; G312-N315 PolarHBondContact O-OD1 3.12Å; G312-N315 VanDerWaalsContact O-OD1 3.11Å; C313-N315 PolarHBondContact O-N 2.72Å; N315-G317 VanDerWaalsContact C-N 3.33Å; N315-G317 PolarHBondContact OD1-N 2.85Å
316	G	95.9	Very high	94.6	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	85.4	-4.4	179.3	0	0	0	0	0	115.2	T320	G316-T320 WeakPolarHBondContact O-CB 3.33Å; G316-T320 PolarHBondContact O-N 3.41Å; G316-T320 PolarHBondContact O-OG1 3.39Å
317	G	96.5	Very high	94.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-65.7	-43.3	178.8	0	0	0	0	0	113.3	N315 T320 M321 T418	N315-G317 VanDerWaalsContact C-N 3.33Å; N315-G317 PolarHBondContact OD1-N 2.85Å; G317-T320 WeakPolarHBondContact O-CB 3.36Å; G317-T320 PolarHBondContact O-N 3.49Å; G317-M321 WeakPolarHBondContact O-CG 3.37Å; G317-M321 PolarHBondContact O-N 3.01Å; G317-T418 VanDerWaalsContact CA-OG1 3.27Å; G317-T418 WeakPolarHBondContact CA-OG1 3.38Å
318	L	97.4	Very high	94.6	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-65.1	-41.4	177.4	-63.5	-175.6	0	0	0	112.2	Y73 F111 E114 F115 T320 S322	Y73-L318 HydrophobicContact CD1-CD2 3.85Å; Y73-L318 HydrophobicContact CE1-CD2 3.55Å; Y73-L318 HydrophobicContact CE1-CG 4.04Å; F111-L318 HydrophobicContact CB-CD1 4.18Å; F111-L318 HydrophobicContact CD1-CD1 4.02Å; F111-L318 HydrophobicContact CD1-CD2 4.39Å; F111-L318 HydrophobicContact CD2-CD1 3.59Å; F111-L318 HydrophobicContact CD2-CD2 4.22Å; F111-L318 HydrophobicContact CE1-CD1 4.29Å; F111-L318 HydrophobicContact CE1-CD2 3.84Å; F111-L318 HydrophobicContact CE2-CD1 3.87Å; F111-L318 HydrophobicContact CE2-CD2 3.63Å; F111-L318 HydrophobicContact CE2-CG 4.45Å; F111-L318 HydrophobicContact CG-CD1 3.66Å; F111-L318 HydrophobicContact CZ-CD1 4.22Å; F111-L318 HydrophobicContact CZ-CD2 3.42Å; F111-L318 VanDerWaalsContact CZ-CD2 3.42Å; F111-L318 HydrophobicContact CZ-CG 4.49Å; E114-L318 HydrophobicContact CB-CB 3.8Å; E114-L318 HydrophobicContact CB-CD1 4.5Å; E114-L318 WeakPolarHBondContact OE2-CD1 3.47Å; F115-L318 HydrophobicContact CD1-CB 3.93Å; F115-L318 HydrophobicContact CD1-CD2 4.39Å; F115-L318 HydrophobicContact CE1-CB 4.01Å; F115-L318 HydrophobicContact CE1-CD2 3.77Å; F115-L318 HydrophobicContact CE1-CG 4.45Å; L318-T320 VanDerWaalsContact C-N 3.33Å; L318-T320 PolarHBondContact O-N 2.89Å; L318-S322 VanDerWaalsContact O-CB 3.32Å; L318-S322 WeakPolarHBondContact O-CB 3.49Å; L318-S322 PolarHBondContact O-N 3.31Å; L318-S322 PolarHBondContact O-OG 3.46Å
319	I	97.2	Very high	94.8	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.5	-46.9	172.6	-60	177.4	0	0	0	109.7	E114 F117 V128 M142 S322 S323	E114-I319 HydrophobicContact CB-CG1 3.82Å; E114-I319 HydrophobicContact CG-CD1 4.25Å; E114-I319 HydrophobicContact CG-CG1 3.92Å; F117-I319 HydrophobicContact CD1-CD1 3.9Å; F117-I319 HydrophobicContact CE1-CD1 4.37Å; V128-I319 HydrophobicContact CB-CG2 4.41Å; V128-I319 HydrophobicContact CG1-CD1 4.39Å; V128-I319 HydrophobicContact CG1-CG2 4.07Å; M142-I319 HydrophobicContact CE-CD1 3.94Å; M142-I319 HydrophobicContact SD-CD1 3.82Å; I319-S322 PolarHBondContact O-OG 3.09Å; I319-S322 VanDerWaalsContact O-OG 3.07Å; I319-S323 WeakPolarHBondContact O-CB 3.41Å; I319-S323 PolarHBondContact O-N 3.45Å; I319-S323 PolarHBondContact O-OG 3.39Å; I319-S323 VanDerWaalsContact O-OG 3.13Å
320	T	96.9	Very high	95.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.7	-53.2	179.9	-59.9	0	0	0	0	111.5	P125 G316 G317 L318 S322 S323 Y324 E417 T418 S421	P125-T320 WeakPolarHBondContact CD-OG1 3.4Å; G316-T320 WeakPolarHBondContact O-CB 3.33Å; G316-T320 PolarHBondContact O-N 3.41Å; G316-T320 PolarHBondContact O-OG1 3.39Å; G317-T320 WeakPolarHBondContact O-CB 3.36Å; G317-T320 PolarHBondContact O-N 3.49Å; L318-T320 VanDerWaalsContact C-N 3.33Å; L318-T320 PolarHBondContact O-N 2.89Å; T320-S322 PolarHBondContact O-N 3.15Å; T320-S323 PolarHBondContact O-N 3.29Å; T320-S323 PolarHBondContact O-OG 3.35Å; T320-Y324 HydrophobicContact CG2-CD2 4.47Å; T320-Y324 HydrophobicContact CG2-CE2 3.76Å; T320-Y324 WeakPolarHBondContact O-CD2 3.47Å; T320-E417 HydrophobicContact CG2-CG 4.35Å; T320-T418 WeakPolarHBondContact OG1-CG2 3.43Å; T320-S421 VanDerWaalsContact CG2-OG 3.31Å; T320-S421 WeakPolarHBondContact CG2-OG 3.34Å
321	M	96.8	Very high	95.3	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65	-39.1	-175.6	-62.3	-52.5	130	0	0	112.6	W60 F66 T69 L251 G317 S414 E417	W60-M321 HydrophobicContact CH2-SD 3.97Å; W60-M321 HydrophobicContact CZ2-CB 4.46Å; W60-M321 HydrophobicContact CZ2-SD 4.04Å; W60-M321 PolarHBondContact NE1-O 3.29Å; F66-M321 HydrophobicContact CE2-CB 4.41Å; T69-M321 HydrophobicContact CG2-SD 3.85Å; L251-M321 HydrophobicContact CD2-SD 4.45Å; G317-M321 WeakPolarHBondContact O-CG 3.37Å; G317-M321 PolarHBondContact O-N 3.01Å; M321-S414 WeakPolarHBondContact CE-O 3.35Å; M321-E417 HydrophobicContact CE-CB 4.09Å; M321-E417 HydrophobicContact CE-CG 4.1Å
322	S	96.4	Very high	95.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-72.6	-30.7	178.6	60.5	0	0	0	0	113.3	F115 L318 I319 T320 Y324 N325	F115-S322 WeakPolarHBondContact O-CB 3.47Å; F115-S322 PolarHBondContact O-OG 2.82Å; L318-S322 VanDerWaalsContact O-CB 3.32Å; L318-S322 WeakPolarHBondContact O-CB 3.49Å; L318-S322 PolarHBondContact O-N 3.31Å; L318-S322 PolarHBondContact O-OG 3.46Å; I319-S322 PolarHBondContact O-OG 3.09Å; I319-S322 VanDerWaalsContact O-OG 3.07Å; T320-S322 PolarHBondContact O-N 3.15Å; S322-Y324 PolarHBondContact O-N 3.42Å; S322-Y324 VanDerWaalsContact O-N 3.11Å; S322-N325 VanDerWaalsContact O-CB 3.23Å; S322-N325 WeakPolarHBondContact O-CB 3.43Å; S322-N325 PolarHBondContact O-N 3.25Å
323	S	94.8	Very high	95.7	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.014	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-11	179.9	67.6	0	0	0	0	115.1	R57 G118 S122 L123 I319 T320	R57-S323 PolarHBondContact NH1-OG 2.83Å; R57-S323 PolarHBondContact NH2-OG 3.47Å; G118-S323 VanDerWaalsContact O-CA 3.3Å; G118-S323 WeakPolarHBondContact O-CA 3.38Å; G118-S323 VanDerWaalsContact O-CB 3.28Å; G118-S323 WeakPolarHBondContact O-CB 3.21Å; S122-S323 WeakPolarHBondContact CA-O 3.47Å; S122-S323 WeakPolarHBondContact CB-O 3.47Å; L123-S323 WeakPolarHBondContact O-CB 3.34Å; I319-S323 WeakPolarHBondContact O-CB 3.41Å; I319-S323 PolarHBondContact O-N 3.45Å; I319-S323 PolarHBondContact O-OG 3.39Å; I319-S323 VanDerWaalsContact O-OG 3.13Å; T320-S323 PolarHBondContact O-N 3.29Å; T320-S323 PolarHBondContact O-OG 3.35Å
324	Y	94.9	Very high	95.8	Very high	16 Å²	16	22.7 Å²	22.7	6%	0.063	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-2.3	173.6	-65.8	-64.2	0	0	0	113.5	R57 G58 G59 W60 V248 T320 S322 E417 S421	R57-Y324 HydrophobicContact CG-CD1 3.87Å; R57-Y324 HydrophobicContact CG-CE1 3.55Å; R57-Y324 VanDerWaalsContact NH2-CZ 3.31Å; R57-Y324 PolarHBondContact NH2-OH 2.7Å; G58-Y324 WeakPolarHBondContact O-CD1 3.38Å; G58-Y324 WeakPolarHBondContact O-CE1 3.36Å; G59-Y324 WeakPolarHBondContact CA-O 3.48Å; W60-Y324 HydrophobicContact CZ2-CD2 4.38Å; V248-Y324 HydrophobicContact CB-CD2 4.48Å; V248-Y324 HydrophobicContact CG1-CD1 4.23Å; V248-Y324 HydrophobicContact CG1-CD2 3.33Å; V248-Y324 HydrophobicContact CG1-CE1 4.17Å; V248-Y324 HydrophobicContact CG1-CE2 3.29Å; V248-Y324 HydrophobicContact CG1-CG 3.79Å; V248-Y324 HydrophobicContact CG2-CD1 4.05Å; V248-Y324 HydrophobicContact CG2-CE1 4.16Å; V248-Y324 HydrophobicContact CG2-CG 4.21Å; T320-Y324 HydrophobicContact CG2-CD2 4.47Å; T320-Y324 HydrophobicContact CG2-CE2 3.76Å; T320-Y324 WeakPolarHBondContact O-CD2 3.47Å; S322-Y324 PolarHBondContact O-N 3.42Å; S322-Y324 VanDerWaalsContact O-N 3.11Å; Y324-E417 HydrophobicContact CE2-CG 4.48Å; Y324-E417 PolarHBondContact OH-OE1 2.91Å; Y324-S421 WeakPolarHBondContact OH-CB 3.11Å
325	N	94.7	Very high	96	Very high	14 Å²	14	22.7 Å²	22.7	8%	0.075	10%	0.102	C	C	.	.	S	Bend	trans	-74.9	157.6	175.7	-69.7	-19.6	0	0	0	111.7	W60 F66 Q119 S322 N329	W60-N325 PolarHBondContact NE1-OD1 3.03Å; W60-N325 VanDerWaalsContact NE1-OD1 3.15Å; F66-N325 WeakPolarHBondContact CD2-OD1 3.41Å; F66-N325 WeakPolarHBondContact CE1-ND2 3.46Å; F66-N325 VanDerWaalsContact CE2-ND2 3.34Å; F66-N325 WeakPolarHBondContact CE2-ND2 3.38Å; F66-N325 WeakPolarHBondContact CE2-OD1 3.41Å; F66-N325 VanDerWaalsContact CG-OD1 3.23Å; F66-N325 WeakPolarHBondContact CG-OD1 3.5Å; F66-N325 WeakPolarHBondContact CZ-ND2 3.37Å; Q119-N325 HydrophobicContact CG-CB 4.09Å; Q119-N325 PolarHBondContact OE1-ND2 3.13Å; S322-N325 VanDerWaalsContact O-CB 3.23Å; S322-N325 WeakPolarHBondContact O-CB 3.43Å; S322-N325 PolarHBondContact O-N 3.25Å; N325-N329 HydrophobicContact CB-CB 4.12Å; N325-N329 PolarHBondContact ND2-ND2 3.25Å
326	K	93.1	Very high	96.1	Very high	174 Å²	174	24.2 Å²	24.2	76%	0.757	11%	0.112	S	C	*	.			trans	-61.1	143.5	163.6	-62.3	-175	177.2	-172.5	0	109.5	K328 N329	K326-K328 VanDerWaalsContact C-N 3.26Å; K326-K328 PolarHBondContact O-N 3.33Å; K326-N329 VanDerWaalsContact O-CB 3.32Å; K326-N329 WeakPolarHBondContact O-CB 3.28Å; K326-N329 PolarHBondContact O-N 2.73Å
327	F	93.1	Very high	96.2	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.009	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-42.2	-176.1	-174.9	-99.3	0	0	0	113.4	Q119 F120 N329 L504 M505 P595 Y600	Q119-F327 PolarHBondContact NE2-O 2.83Å; F120-F327 AromaticContact CD2-CE2 3.86Å; F120-F327 HydrophobicContact CD2-CE2 3.86Å; F120-F327 HydrophobicContact CD2-CZ 4.1Å; F120-F327 HydrophobicContact CE2-CE2 4.25Å; F120-F327 HydrophobicContact CE2-CZ 4.19Å; F120-F327 WeakPolarHBondContact O-CE2 3.39Å; F327-N329 VanDerWaalsContact C-N 3.31Å; F327-N329 PolarHBondContact O-N 2.7Å; F327-L504 HydrophobicContact CE1-CG 4.04Å; F327-L504 HydrophobicContact CZ-CD2 4.18Å; F327-L504 HydrophobicContact CZ-CG 4.01Å; F327-M505 HydrophobicContact CD1-CG 4.41Å; F327-M505 HydrophobicContact CD2-CG 4.16Å; F327-M505 HydrophobicContact CE1-CB 4.46Å; F327-M505 HydrophobicContact CE1-CG 3.95Å; F327-M505 HydrophobicContact CE2-CG 3.65Å; F327-M505 HydrophobicContact CE2-SD 4.47Å; F327-M505 HydrophobicContact CZ-CB 4.48Å; F327-M505 HydrophobicContact CZ-CG 3.53Å; F327-P595 HydrophobicContact CD2-CB 4.14Å; F327-P595 HydrophobicContact CE2-CB 3.6Å; F327-P595 HydrophobicContact CE2-CG 3.62Å; F327-P595 HydrophobicContact CZ-CB 4.02Å; F327-P595 HydrophobicContact CZ-CG 3.67Å; F327-Y600 HydrophobicContact CB-CD2 3.66Å; F327-Y600 HydrophobicContact CB-CE2 3.61Å; F327-Y600 AromaticContact CD1-CD1 3.87Å; F327-Y600 HydrophobicContact CD1-CD1 3.87Å; F327-Y600 AromaticContact CD1-CD2 3.16Å; F327-Y600 HydrophobicContact CD1-CD2 3.16Å; F327-Y600 HydrophobicContact CD1-CE1 4.2Å; F327-Y600 AromaticContact CD1-CE2 3.54Å; F327-Y600 HydrophobicContact CD1-CE2 3.54Å; F327-Y600 AromaticContact CD1-CG 3.35Å; F327-Y600 HydrophobicContact CD1-CG 3.35Å; F327-Y600 HydrophobicContact CD2-CD2 4.26Å; F327-Y600 AromaticContact CE1-CD1 3.93Å; F327-Y600 HydrophobicContact CE1-CD1 3.93Å; F327-Y600 AromaticContact CE1-CD2 3.81Å; F327-Y600 HydrophobicContact CE1-CD2 3.81Å; F327-Y600 HydrophobicContact CE1-CE2 4.49Å; F327-Y600 AromaticContact CE1-CG 3.49Å; F327-Y600 HydrophobicContact CE1-CG 3.49Å; F327-Y600 VanDerWaalsContact CE1-CG 3.49Å; F327-Y600 AromaticContact CG-CD2 3.43Å; F327-Y600 HydrophobicContact CG-CD2 3.43Å; F327-Y600 VanDerWaalsContact CG-CD2 3.43Å; F327-Y600 AromaticContact CG-CE2 3.83Å; F327-Y600 HydrophobicContact CG-CE2 3.83Å; F327-Y600 HydrophobicContact CG-CG 4.03Å; F327-Y600 HydrophobicContact CZ-CG 4.27Å
328	K	95	Very high	96.2	Very high	71 Å²	71	27.9 Å²	27.9	31%	0.309	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	11.1	179.2	-66.5	-66.3	-161.9	172.8	0	115.8	K326 N330 L504 M505 D507 Y600	K326-K328 VanDerWaalsContact C-N 3.26Å; K326-K328 PolarHBondContact O-N 3.33Å; K328-N330 PolarHBondContact O-N 3.02Å; K328-L504 WeakPolarHBondContact CE-O 3.3Å; K328-L504 PolarHBondContact NZ-O 3.07Å; K328-M505 VanDerWaalsContact CA-O 3.26Å; K328-M505 WeakPolarHBondContact CA-O 3.43Å; K328-M505 WeakPolarHBondContact CD-O 3.42Å; K328-D507 IonicContact NZ-OD1 2.76Å; K328-D507 PolarHBondContact NZ-OD1 2.91Å; K328-D507 IonicContact NZ-OD2 3.34Å; K328-Y600 HydrophobicContact CD-CE1 4.39Å; K328-Y600 HydrophobicContact CG-CE1 4.18Å
329	N	95.2	Very high	96.2	Very high	23 Å²	23	28 Å²	28	12%	0.123	13%	0.131	C	C	.	.	S	Bend	trans	-69.1	132.9	177.1	-178.8	64.3	0	0	0	110.6	Q119 N325 K326 F327 C331 D334 I506	Q119-N329 PolarHBondContact NE2-O 3.4Å; N325-N329 HydrophobicContact CB-CB 4.12Å; N325-N329 PolarHBondContact ND2-ND2 3.25Å; K326-N329 VanDerWaalsContact O-CB 3.32Å; K326-N329 WeakPolarHBondContact O-CB 3.28Å; K326-N329 PolarHBondContact O-N 2.73Å; F327-N329 VanDerWaalsContact C-N 3.31Å; F327-N329 PolarHBondContact O-N 2.7Å; N329-C331 VanDerWaalsContact C-N 3.31Å; N329-C331 PolarHBondContact O-N 3.29Å; N329-D334 PolarHBondContact ND2-OD2 3.03Å; N329-I506 WeakPolarHBondContact O-CG2 3.26Å
330	N	96.9	Very high	96.2	Very high	38 Å²	38	32.9 Å²	32.9	20%	0.203	16%	0.157	C	C	.	.			trans	-72.5	85.7	179.4	-171.7	-29.5	0	0	0	111.4	K328 C332 R333 D334	K328-N330 PolarHBondContact O-N 3.02Å; N330-C332 VanDerWaalsContact C-N 3.33Å; N330-C332 PolarHBondContact O-N 2.65Å; N330-C332 PolarHBondContact OD1-N 3.03Å; N330-R333 HydrophobicContact CB-CB 4.41Å; N330-R333 WeakPolarHBondContact OD1-CB 3.32Å; N330-R333 PolarHBondContact OD1-N 3.43Å; N330-D334 PolarHBondContact O-N 3.13Å
331	C	96.7	Very high	96.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-72.2	-23	-177.1	60.9	0	0	0	0	113.5	F115 N329 A335	F115-C331 HydrophobicContact CB-CB 4.23Å; F115-C331 HydrophobicContact CD2-CB 4.27Å; N329-C331 VanDerWaalsContact C-N 3.31Å; N329-C331 PolarHBondContact O-N 3.29Å; C331-A335 VanDerWaalsContact O-CB 3.26Å; C331-A335 WeakPolarHBondContact O-CB 3.48Å; C331-A335 PolarHBondContact O-N 3.38Å
332	C	97.9	Very high	96.1	Very high	20 Å²	20	35.1 Å²	35.1	14%	0.135	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-52.6	173.4	-177.7	0	0	0	0	111.3	F112 N330 D334 A335 V336 I506	F112-C332 HydrophobicContact CD2-CB 4.04Å; F112-C332 HydrophobicContact CE1-CB 4.16Å; F112-C332 VanDerWaalsContact CE2-CA 3.41Å; F112-C332 HydrophobicContact CE2-CB 3.47Å; F112-C332 VanDerWaalsContact CE2-CB 3.47Å; F112-C332 HydrophobicContact CZ-CB 3.52Å; N330-C332 VanDerWaalsContact C-N 3.33Å; N330-C332 PolarHBondContact O-N 2.65Å; N330-C332 PolarHBondContact OD1-N 3.03Å; C332-D334 VanDerWaalsContact C-N 3.29Å; C332-D334 PolarHBondContact O-N 3.09Å; C332-A335 PolarHBondContact O-N 3.3Å; C332-V336 WeakPolarHBondContact O-CG2 3.44Å; C332-V336 PolarHBondContact O-N 3.43Å; C332-I506 HydrophobicContact CB-CD1 3.65Å
333	R	97.5	Very high	96.1	Very high	99 Å²	99	35.7 Å²	35.7	37%	0.374	17%	0.172	S	C	.	.	H	α-helix	trans	-58	-45.9	176.6	-177.8	-164	62.5	-132.5	-20.3	110.5	N330 V336 I337	N330-R333 HydrophobicContact CB-CB 4.41Å; N330-R333 WeakPolarHBondContact OD1-CB 3.32Å; N330-R333 PolarHBondContact OD1-N 3.43Å; R333-V336 PolarHBondContact O-N 3.41Å; R333-I337 HydrophobicContact CG-CD1 3.69Å; R333-I337 HydrophobicContact CG-CG1 4.35Å; R333-I337 WeakPolarHBondContact O-CB 3.28Å; R333-I337 VanDerWaalsContact O-CG1 3.3Å; R333-I337 WeakPolarHBondContact O-CG1 3.46Å; R333-I337 PolarHBondContact O-N 3.18Å
334	D	97.2	Very high	96.2	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-41.3	-176.8	-62.3	-7.8	0	0	0	110.8	F66 F115 N329 N330 C332 V336 I337 F338	F66-D334 HydrophobicContact CE1-CB 4.22Å; F66-D334 WeakPolarHBondContact CE1-OD2 3.41Å; F115-D334 HydrophobicContact CE2-CB 4.26Å; N329-D334 PolarHBondContact ND2-OD2 3.03Å; N330-D334 PolarHBondContact O-N 3.13Å; C332-D334 VanDerWaalsContact C-N 3.29Å; C332-D334 PolarHBondContact O-N 3.09Å; D334-V336 PolarHBondContact O-N 3.17Å; D334-I337 PolarHBondContact O-N 3.43Å; D334-F338 HydrophobicContact CB-CD2 4.45Å; D334-F338 HydrophobicContact CB-CE2 3.85Å; D334-F338 HydrophobicContact CB-CZ 4.12Å; D334-F338 WeakPolarHBondContact O-CB 3.25Å; D334-F338 WeakPolarHBondContact O-CD2 3.46Å; D334-F338 WeakPolarHBondContact O-CG 3.41Å; D334-F338 PolarHBondContact O-N 2.62Å
335	A	97.4	Very high	96.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59	-45.9	173.4	0	0	0	0	0	112.7	F111 F112 F115 C331 C332 A339	F111-A335 HydrophobicContact CD1-CB 3.59Å; F111-A335 HydrophobicContact CE1-CB 4.18Å; F111-A335 HydrophobicContact CG-CB 4.46Å; F112-A335 HydrophobicContact CB-CB 3.94Å; F112-A335 HydrophobicContact CD2-CB 4.45Å; F115-A335 HydrophobicContact CD2-CB 4.2Å; C331-A335 VanDerWaalsContact O-CB 3.26Å; C331-A335 WeakPolarHBondContact O-CB 3.48Å; C331-A335 PolarHBondContact O-N 3.38Å; C332-A335 PolarHBondContact O-N 3.3Å; A335-A339 VanDerWaalsContact O-CB 3.23Å; A335-A339 WeakPolarHBondContact O-CB 2.89Å; A335-A339 PolarHBondContact O-N 3.07Å
336	V	97.9	Very high	96.4	Very high	44 Å²	44	37 Å²	37	27%	0.267	19%	0.188	S	C	.	.	H	α-helix	trans	-62.3	-47.7	177.1	173.7	0	0	0	0	111.3	L108 C332 R333 D334 I340 W514	L108-V336 HydrophobicContact CD1-CB 4.37Å; L108-V336 HydrophobicContact CD1-CG2 3.92Å; L108-V336 HydrophobicContact CD2-CG2 4.28Å; C332-V336 WeakPolarHBondContact O-CG2 3.44Å; C332-V336 PolarHBondContact O-N 3.43Å; R333-V336 PolarHBondContact O-N 3.41Å; D334-V336 PolarHBondContact O-N 3.17Å; V336-I340 HydrophobicContact CG1-CD1 3.75Å; V336-I340 WeakPolarHBondContact O-CB 3.29Å; V336-I340 VanDerWaalsContact O-CG1 3.28Å; V336-I340 WeakPolarHBondContact O-CG1 3.26Å; V336-I340 PolarHBondContact O-N 2.92Å; V336-W514 HydrophobicContact CG2-CH2 4.19Å; V336-W514 HydrophobicContact CG2-CZ2 4.17Å
337	I	97.5	Very high	96.6	Very high	73 Å²	73	30.8 Å²	30.8	37%	0.374	16%	0.164	S	C	.	.	H	α-helix	trans	-61.2	-49.6	-179.4	-71.5	173.6	0	0	0	110.5	R333 D334 A339 I340 I341	R333-I337 HydrophobicContact CG-CD1 3.69Å; R333-I337 HydrophobicContact CG-CG1 4.35Å; R333-I337 WeakPolarHBondContact O-CB 3.28Å; R333-I337 VanDerWaalsContact O-CG1 3.3Å; R333-I337 WeakPolarHBondContact O-CG1 3.46Å; R333-I337 PolarHBondContact O-N 3.18Å; D334-I337 PolarHBondContact O-N 3.43Å; I337-A339 PolarHBondContact O-N 3.03Å; I337-I340 PolarHBondContact O-N 2.85Å; I337-I341 HydrophobicContact CG2-CD1 3.58Å; I337-I341 HydrophobicContact CG2-CG1 4.29Å; I337-I341 WeakPolarHBondContact O-CB 3.42Å; I337-I341 VanDerWaalsContact O-CG1 3.27Å; I337-I341 WeakPolarHBondContact O-CG1 3.17Å; I337-I341 PolarHBondContact O-N 3.39Å
338	F	96.7	Very high	96.8	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.022	18%	0.176	C	C	.	.	H	α-helix	trans	-67.4	-38.5	-176.9	-58.5	-27.1	0	0	0	112.4	F66 V67 C70 I71 F111 F115 D334 I340 I341 N342	F66-F338 AromaticContact CE1-CE2 3.83Å; F66-F338 HydrophobicContact CE1-CE2 3.83Å; F66-F338 HydrophobicContact CE1-CZ 4.09Å; F66-F338 AromaticContact CZ-CE2 3.95Å; F66-F338 HydrophobicContact CZ-CE2 3.95Å; V67-F338 HydrophobicContact CB-CE1 4.28Å; V67-F338 HydrophobicContact CB-CZ 4.19Å; V67-F338 HydrophobicContact CG1-CE1 3.95Å; V67-F338 HydrophobicContact CG1-CZ 4.36Å; V67-F338 HydrophobicContact CG2-CE1 4.23Å; V67-F338 HydrophobicContact CG2-CZ 3.92Å; C70-F338 HydrophobicContact CB-CD1 4.43Å; C70-F338 HydrophobicContact CB-CD2 3.45Å; C70-F338 VanDerWaalsContact CB-CD2 3.45Å; C70-F338 HydrophobicContact CB-CE1 4.36Å; C70-F338 HydrophobicContact CB-CE2 3.31Å; C70-F338 HydrophobicContact CB-CG 4.04Å; C70-F338 HydrophobicContact CB-CZ 3.83Å; I71-F338 HydrophobicContact CG1-CD1 4.16Å; I71-F338 HydrophobicContact CG1-CE1 4.39Å; F111-F338 HydrophobicContact CE1-CB 4.41Å; F111-F338 HydrophobicContact CE1-CD2 4.34Å; F111-F338 HydrophobicContact CZ-CB 3.94Å; F111-F338 HydrophobicContact CZ-CD2 4.34Å; F115-F338 AromaticContact CE2-CD2 3.9Å; F115-F338 HydrophobicContact CE2-CD2 3.9Å; F115-F338 AromaticContact CE2-CE2 3.9Å; F115-F338 HydrophobicContact CE2-CE2 3.9Å; F115-F338 AromaticContact CZ-CD2 3.96Å; F115-F338 HydrophobicContact CZ-CD2 3.96Å; F115-F338 HydrophobicContact CZ-CE2 4.09Å; D334-F338 HydrophobicContact CB-CD2 4.45Å; D334-F338 HydrophobicContact CB-CE2 3.85Å; D334-F338 HydrophobicContact CB-CZ 4.12Å; D334-F338 WeakPolarHBondContact O-CB 3.25Å; D334-F338 WeakPolarHBondContact O-CD2 3.46Å; D334-F338 WeakPolarHBondContact O-CG 3.41Å; D334-F338 PolarHBondContact O-N 2.62Å; F338-I340 PolarHBondContact O-N 3.38Å; F338-I341 PolarHBondContact O-N 2.87Å; F338-N342 VanDerWaalsContact O-CB 3.31Å; F338-N342 WeakPolarHBondContact O-CB 3.28Å; F338-N342 PolarHBondContact O-N 2.93Å
339	A	96.5	Very high	96.8	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-40.8	175.7	0	0	0	0	0	112.1	L103 L108 L311 A335 I337 C343	L103-A339 HydrophobicContact CD1-CB 4.11Å; L108-A339 HydrophobicContact CD1-CB 3.95Å; L311-A339 HydrophobicContact CD2-CB 4.08Å; A335-A339 VanDerWaalsContact O-CB 3.23Å; A335-A339 WeakPolarHBondContact O-CB 2.89Å; A335-A339 PolarHBondContact O-N 3.07Å; I337-A339 PolarHBondContact O-N 3.03Å; A339-C343 PolarHBondContact O-N 3.49Å; A339-C343 VanDerWaalsContact O-N 3.14Å; A339-C343 PolarHBondContact O-SG 2.89Å; A339-C343 VanDerWaalsContact O-SG 3.36Å
340	I	96.3	Very high	96.8	Very high	103 Å²	103	29.4 Å²	29.4	53%	0.528	16%	0.156	S	C	.	.	H	α-helix	trans	-66.5	-46.8	175	-69.6	170.6	0	0	0	110.8	V336 I337 F338 N342 C343 A344	V336-I340 HydrophobicContact CG1-CD1 3.75Å; V336-I340 WeakPolarHBondContact O-CB 3.29Å; V336-I340 VanDerWaalsContact O-CG1 3.28Å; V336-I340 WeakPolarHBondContact O-CG1 3.26Å; V336-I340 PolarHBondContact O-N 2.92Å; I337-I340 PolarHBondContact O-N 2.85Å; F338-I340 PolarHBondContact O-N 3.38Å; I340-N342 VanDerWaalsContact C-N 3.31Å; I340-N342 PolarHBondContact O-N 3.41Å; I340-C343 PolarHBondContact O-N 3.21Å; I340-A344 WeakPolarHBondContact O-CB 3.48Å; I340-A344 PolarHBondContact O-N 3.42Å
341	I	97.2	Very high	96.8	Very high	48 Å²	48	30.4 Å²	30.4	25%	0.246	16%	0.158	C	C	.	.	H	α-helix	trans	-56.9	-46.8	177.8	-72.7	172	0	0	0	110.2	I71 V75 Y263 I337 F338 C343 A344 T345	I71-I341 HydrophobicContact CD1-CD1 4.04Å; I71-I341 HydrophobicContact CG1-CD1 4.31Å; I71-I341 HydrophobicContact CG1-CG2 4.41Å; I71-I341 HydrophobicContact CG2-CG2 4.46Å; V75-I341 HydrophobicContact CG2-CG2 4.32Å; Y263-I341 WeakPolarHBondContact OH-CG2 3.47Å; I337-I341 HydrophobicContact CG2-CD1 3.58Å; I337-I341 HydrophobicContact CG2-CG1 4.29Å; I337-I341 WeakPolarHBondContact O-CB 3.42Å; I337-I341 VanDerWaalsContact O-CG1 3.27Å; I337-I341 WeakPolarHBondContact O-CG1 3.17Å; I337-I341 PolarHBondContact O-N 3.39Å; F338-I341 PolarHBondContact O-N 2.87Å; I341-C343 PolarHBondContact O-N 3.02Å; I341-A344 PolarHBondContact O-N 2.97Å; I341-T345 VanDerWaalsContact O-CB 3.26Å; I341-T345 WeakPolarHBondContact O-CB 3.36Å; I341-T345 PolarHBondContact O-N 3.17Å; I341-T345 PolarHBondContact O-OG1 3.42Å
342	N	96.3	Very high	96.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57	-51.3	178	177.8	60.5	0	0	0	112.5	A74 N79 S310 L311 F338 I340 T345 S346	A74-N342 HydrophobicContact CB-CB 4.13Å; A74-N342 PolarHBondContact O-OD1 3.41Å; N79-N342 PolarHBondContact ND2-O 2.89Å; N79-N342 PolarHBondContact ND2-OD1 3.41Å; S310-N342 VanDerWaalsContact OG-CG 3.27Å; S310-N342 PolarHBondContact OG-ND2 2.74Å; S310-N342 PolarHBondContact OG-OD1 3.35Å; L311-N342 HydrophobicContact CD2-CB 3.82Å; L311-N342 WeakPolarHBondContact CD2-ND2 3.45Å; F338-N342 VanDerWaalsContact O-CB 3.31Å; F338-N342 WeakPolarHBondContact O-CB 3.28Å; F338-N342 PolarHBondContact O-N 2.93Å; I340-N342 VanDerWaalsContact C-N 3.31Å; I340-N342 PolarHBondContact O-N 3.41Å; N342-T345 PolarHBondContact O-N 3.49Å; N342-S346 PolarHBondContact O-N 3Å; N342-S346 PolarHBondContact O-OG 2.86Å
343	C	96.5	Very high	96.4	Very high	11 Å²	11	29.7 Å²	29.7	7%	0.074	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-42.5	-178.6	-69	0	0	0	0	112.6	Y99 L103 A339 I340 I341 T345 S346 V347	Y99-C343 HydrophobicContact CE1-CB 3.9Å; Y99-C343 PolarHBondContact OH-SG 3.35Å; L103-C343 VanDerWaalsContact CD1-SG 3.56Å; L103-C343 HydrophobicContact CD2-CB 3.99Å; L103-C343 VanDerWaalsContact CD2-SG 3.54Å; A339-C343 PolarHBondContact O-N 3.49Å; A339-C343 VanDerWaalsContact O-N 3.14Å; A339-C343 PolarHBondContact O-SG 2.89Å; A339-C343 VanDerWaalsContact O-SG 3.36Å; I340-C343 PolarHBondContact O-N 3.21Å; I341-C343 PolarHBondContact O-N 3.02Å; C343-T345 VanDerWaalsContact C-N 3.29Å; C343-T345 PolarHBondContact O-N 3.22Å; C343-S346 WeakPolarHBondContact O-CB 3.48Å; C343-S346 PolarHBondContact O-N 3.42Å; C343-V347 PolarHBondContact O-N 3.22Å; C343-V347 VanDerWaalsContact O-N 3.11Å
344	A	96.6	Very high	96.2	Very high	54 Å²	54	25.1 Å²	25.1	45%	0.446	14%	0.136	S	C	.	.	H	α-helix	trans	-62	-39.4	175.1	0	0	0	0	0	111.3	I340 I341 S346 V347 Y348	I340-A344 WeakPolarHBondContact O-CB 3.48Å; I340-A344 PolarHBondContact O-N 3.42Å; I341-A344 PolarHBondContact O-N 2.97Å; A344-S346 VanDerWaalsContact C-N 3.33Å; A344-S346 PolarHBondContact O-N 3.27Å; A344-V347 PolarHBondContact O-N 3.4Å; A344-Y348 VanDerWaalsContact O-CB 3.27Å; A344-Y348 WeakPolarHBondContact O-CB 3.28Å; A344-Y348 PolarHBondContact O-N 2.66Å
345	T	97	Very high	96.1	Very high	6 Å²	6	24.9 Å²	24.9	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-65.5	-37.7	176.8	-53.8	0	0	0	0	111.7	V75 Y263 L266 I341 N342 C343 Y348 A349	V75-T345 HydrophobicContact CG1-CG2 3.55Å; Y263-T345 HydrophobicContact CE1-CG2 3.81Å; Y263-T345 WeakPolarHBondContact CE1-OG1 3.12Å; Y263-T345 PolarHBondContact OH-OG1 3.06Å; L266-T345 HydrophobicContact CD1-CG2 4.01Å; I341-T345 VanDerWaalsContact O-CB 3.26Å; I341-T345 WeakPolarHBondContact O-CB 3.36Å; I341-T345 PolarHBondContact O-N 3.17Å; I341-T345 PolarHBondContact O-OG1 3.42Å; N342-T345 PolarHBondContact O-N 3.49Å; C343-T345 VanDerWaalsContact C-N 3.29Å; C343-T345 PolarHBondContact O-N 3.22Å; T345-Y348 PolarHBondContact O-N 2.65Å; T345-A349 WeakPolarHBondContact O-CB 3.38Å; T345-A349 PolarHBondContact O-N 3.28Å
346	S	96.8	Very high	95.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.7	-47.7	174.7	-49.5	0	0	0	0	111.8	N79 F83 N342 C343 A344 A349 G350	N79-S346 PolarHBondContact ND2-OG 3.17Å; F83-S346 VanDerWaalsContact CD1-O 3.23Å; F83-S346 WeakPolarHBondContact CD1-O 3.49Å; F83-S346 VanDerWaalsContact CE1-C 3.49Å; F83-S346 WeakPolarHBondContact CE1-O 3.4Å; N342-S346 PolarHBondContact O-N 3Å; N342-S346 PolarHBondContact O-OG 2.86Å; C343-S346 WeakPolarHBondContact O-CB 3.48Å; C343-S346 PolarHBondContact O-N 3.42Å; A344-S346 VanDerWaalsContact C-N 3.33Å; A344-S346 PolarHBondContact O-N 3.27Å; S346-A349 PolarHBondContact O-N 3.09Å; S346-G350 PolarHBondContact O-N 3.34Å
347	V	96.6	Very high	95.5	Very high	43 Å²	43	23.4 Å²	23.4	26%	0.261	13%	0.125	S	C	.	.	H	α-helix	trans	-64.2	-44	177	175	0	0	0	0	110.9	F83 L96 C343 A344 A349 G350 F351	F83-V347 HydrophobicContact CE1-CG2 4.21Å; F83-V347 HydrophobicContact CZ-CG2 3.9Å; L96-V347 HydrophobicContact CD2-CG2 4.21Å; C343-V347 PolarHBondContact O-N 3.22Å; C343-V347 VanDerWaalsContact O-N 3.11Å; A344-V347 PolarHBondContact O-N 3.4Å; V347-A349 PolarHBondContact O-N 3.3Å; V347-G350 WeakPolarHBondContact O-CA 3.44Å; V347-G350 PolarHBondContact O-N 2.89Å; V347-G350 VanDerWaalsContact O-N 3.12Å; V347-F351 HydrophobicContact CG1-CD2 4.39Å; V347-F351 HydrophobicContact CG1-CE2 3.89Å; V347-F351 VanDerWaalsContact O-CD2 3.26Å; V347-F351 WeakPolarHBondContact O-CD2 3.27Å; V347-F351 PolarHBondContact O-N 3.32Å
348	Y	96.8	Very high	95.4	Very high	68 Å²	68	20 Å²	20	27%	0.267	11%	0.108	S	C	.	.	H	α-helix	trans	-60.5	-45.6	177.8	-171.8	-103.3	0	0	0	112.3	L266 T267 L270 A344 T345 G350 F351 V352	L266-Y348 HydrophobicContact CB-CD1 4.2Å; L266-Y348 HydrophobicContact CB-CE1 3.86Å; L266-Y348 HydrophobicContact CD1-CD1 4.46Å; T267-Y348 WeakPolarHBondContact CA-OH 3.47Å; T267-Y348 PolarHBondContact OG1-OH 3.26Å; L270-Y348 HydrophobicContact CD2-CD2 4.23Å; L270-Y348 HydrophobicContact CD2-CE1 4.34Å; L270-Y348 HydrophobicContact CD2-CE2 3.36Å; L270-Y348 VanDerWaalsContact CD2-CZ 3.43Å; L270-Y348 WeakPolarHBondContact CD2-OH 3.46Å; A344-Y348 VanDerWaalsContact O-CB 3.27Å; A344-Y348 WeakPolarHBondContact O-CB 3.28Å; A344-Y348 PolarHBondContact O-N 2.66Å; T345-Y348 PolarHBondContact O-N 2.65Å; Y348-G350 VanDerWaalsContact C-N 3.28Å; Y348-G350 PolarHBondContact O-N 3.43Å; Y348-F351 WeakPolarHBondContact O-CB 3.4Å; Y348-F351 PolarHBondContact O-N 3.49Å; Y348-F351 VanDerWaalsContact O-N 3.16Å; Y348-V352 PolarHBondContact O-N 2.92Å
349	A	95.4	Very high	95.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.3	-35.9	174.3	0	0	0	0	0	111.6	V80 L266 T345 S346 V347 F351 V352 I353	V80-A349 HydrophobicContact CG2-CB 4.24Å; L266-A349 HydrophobicContact CD2-CB 4.18Å; T345-A349 WeakPolarHBondContact O-CB 3.38Å; T345-A349 PolarHBondContact O-N 3.28Å; S346-A349 PolarHBondContact O-N 3.09Å; V347-A349 PolarHBondContact O-N 3.3Å; A349-F351 VanDerWaalsContact C-N 3.28Å; A349-F351 PolarHBondContact O-N 3.32Å; A349-V352 WeakPolarHBondContact O-CB 3.48Å; A349-V352 PolarHBondContact O-N 3.33Å; A349-V352 VanDerWaalsContact O-N 3.07Å; A349-I353 WeakPolarHBondContact O-CB 3.01Å; A349-I353 VanDerWaalsContact O-CG1 3.25Å; A349-I353 WeakPolarHBondContact O-CG1 3.14Å; A349-I353 PolarHBondContact O-N 3.29Å
350	G	94.7	Very high	94.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-52.1	-42	170.6	0	0	0	0	0	113.5	S346 V347 Y348 I353 F354	S346-G350 PolarHBondContact O-N 3.34Å; V347-G350 WeakPolarHBondContact O-CA 3.44Å; V347-G350 PolarHBondContact O-N 2.89Å; V347-G350 VanDerWaalsContact O-N 3.12Å; Y348-G350 VanDerWaalsContact C-N 3.28Å; Y348-G350 PolarHBondContact O-N 3.43Å; G350-I353 PolarHBondContact O-N 3.3Å; G350-F354 WeakPolarHBondContact O-CB 3.3Å; G350-F354 WeakPolarHBondContact O-CD2 3.32Å; G350-F354 PolarHBondContact O-N 2.89Å
351	F	96.5	Very high	94.6	Very high	59 Å²	59	16.2 Å²	16.2	26%	0.259	9%	0.089	S	C	.	.	H	α-helix	trans	-64.2	-42.9	174.6	-75.3	-82.3	0	0	0	113	L270 V283 Y286 L287 V347 Y348 A349 I353 S355	L270-F351 HydrophobicContact CD1-CB 3.72Å; V283-F351 HydrophobicContact CG1-CD1 4Å; V283-F351 HydrophobicContact CG1-CE1 3.82Å; V283-F351 HydrophobicContact CG2-CD1 4.25Å; Y286-F351 HydrophobicContact CE1-CD2 4.22Å; Y286-F351 HydrophobicContact CE1-CE2 4.21Å; Y286-F351 HydrophobicContact CE1-CG 4.46Å; Y286-F351 HydrophobicContact CE1-CZ 4.46Å; L287-F351 HydrophobicContact CD1-CE1 4.02Å; L287-F351 HydrophobicContact CD1-CZ 4.18Å; L287-F351 HydrophobicContact CD2-CZ 4.14Å; V347-F351 HydrophobicContact CG1-CD2 4.39Å; V347-F351 HydrophobicContact CG1-CE2 3.89Å; V347-F351 VanDerWaalsContact O-CD2 3.26Å; V347-F351 WeakPolarHBondContact O-CD2 3.27Å; V347-F351 PolarHBondContact O-N 3.32Å; Y348-F351 WeakPolarHBondContact O-CB 3.4Å; Y348-F351 PolarHBondContact O-N 3.49Å; Y348-F351 VanDerWaalsContact O-N 3.16Å; A349-F351 VanDerWaalsContact C-N 3.28Å; A349-F351 PolarHBondContact O-N 3.32Å; F351-I353 VanDerWaalsContact C-N 3.32Å; F351-I353 PolarHBondContact O-N 2.9Å; F351-S355 WeakPolarHBondContact O-CB 3.45Å; F351-S355 PolarHBondContact O-N 3.45Å; F351-S355 VanDerWaalsContact O-N 3.09Å; F351-S355 PolarHBondContact O-OG 3.38Å
352	V	94.1	Very high	94.4	Very high	3 Å²	3	18.2 Å²	18.2	2%	0.018	10%	0.099	C	C	.	.	H	α-helix	trans	-58.4	-49.6	176	-179.1	0	0	0	0	110	L266 L269 L270 Y348 A349 N356	L266-V352 HydrophobicContact CD2-CG2 4.3Å; L269-V352 HydrophobicContact CB-CG1 3.71Å; L270-V352 HydrophobicContact CB-CG2 3.76Å; L270-V352 HydrophobicContact CD1-CG2 3.95Å; L270-V352 HydrophobicContact CG-CG2 4.43Å; Y348-V352 PolarHBondContact O-N 2.92Å; A349-V352 WeakPolarHBondContact O-CB 3.48Å; A349-V352 PolarHBondContact O-N 3.33Å; A349-V352 VanDerWaalsContact O-N 3.07Å; V352-N356 PolarHBondContact O-N 3.15Å; V352-N356 PolarHBondContact O-ND2 3.36Å
353	I	92.5	Very high	94	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-60.4	-178.1	-73.6	-11.7	0	0	0	111.3	V80 P84 A349 G350 F351 S355 N356 L357 Y383	V80-I353 HydrophobicContact CG1-CD1 4Å; V80-I353 WeakPolarHBondContact O-CG1 3.4Å; P84-I353 HydrophobicContact CB-CB 4.13Å; P84-I353 HydrophobicContact CB-CG1 4.23Å; P84-I353 HydrophobicContact CB-CG2 3.55Å; P84-I353 HydrophobicContact CG-CB 4.2Å; P84-I353 HydrophobicContact CG-CG1 3.88Å; P84-I353 HydrophobicContact CG-CG2 4.17Å; A349-I353 WeakPolarHBondContact O-CB 3.01Å; A349-I353 VanDerWaalsContact O-CG1 3.25Å; A349-I353 WeakPolarHBondContact O-CG1 3.14Å; A349-I353 PolarHBondContact O-N 3.29Å; G350-I353 PolarHBondContact O-N 3.3Å; F351-I353 VanDerWaalsContact C-N 3.32Å; F351-I353 PolarHBondContact O-N 2.9Å; I353-S355 VanDerWaalsContact C-N 3.3Å; I353-S355 PolarHBondContact O-N 2.78Å; I353-N356 WeakPolarHBondContact O-CB 3.49Å; I353-N356 PolarHBondContact O-N 2.99Å; I353-N356 VanDerWaalsContact O-N 3.08Å; I353-L357 HydrophobicContact CG2-CD1 4.11Å; I353-L357 WeakPolarHBondContact O-CG 3.46Å; I353-L357 PolarHBondContact O-N 2.68Å; I353-Y383 HydrophobicContact CB-CE1 4.06Å; I353-Y383 VanDerWaalsContact CB-OH 3.24Å; I353-Y383 WeakPolarHBondContact CB-OH 3.46Å; I353-Y383 HydrophobicContact CD1-CD1 4.43Å; I353-Y383 HydrophobicContact CD1-CE1 3.65Å; I353-Y383 HydrophobicContact CD1-CE2 3.8Å; I353-Y383 WeakPolarHBondContact CD1-OH 3.34Å; I353-Y383 HydrophobicContact CG1-CE1 4.06Å; I353-Y383 HydrophobicContact CG1-CE2 4.26Å; I353-Y383 WeakPolarHBondContact CG1-OH 3.47Å; I353-Y383 HydrophobicContact CG2-CE1 4Å; I353-Y383 WeakPolarHBondContact CG2-OH 3.43Å
354	F	93.7	Very high	93.4	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-71.4	-28.4	-170.9	-84.3	-84.3	0	0	0	112.1	P84 C87 H88 G282 Y285 Y286 G350 N356 L357 G358 V368	P84-F354 HydrophobicContact CB-CD2 4.31Å; P84-F354 HydrophobicContact CB-CE2 3.83Å; P84-F354 WeakPolarHBondContact O-CE2 3.48Å; P84-F354 WeakPolarHBondContact O-CZ 3.26Å; C87-F354 HydrophobicContact CB-CE2 4.48Å; H88-F354 HydrophobicContact CB-CE1 4.4Å; H88-F354 HydrophobicContact CB-CZ 3.93Å; G282-F354 VanDerWaalsContact CA-O 3.23Å; G282-F354 WeakPolarHBondContact CA-O 3.29Å; Y285-F354 HydrophobicContact CD1-CD1 4.02Å; Y285-F354 AromaticContact CD1-CE1 3.63Å; Y285-F354 HydrophobicContact CD1-CE1 3.63Å; Y285-F354 AromaticContact CE1-CE1 3.91Å; Y285-F354 HydrophobicContact CE1-CE1 3.91Å; Y286-F354 HydrophobicContact CD1-CD2 4.34Å; Y286-F354 AromaticContact CD2-CD2 3.36Å; Y286-F354 HydrophobicContact CD2-CD2 3.36Å; Y286-F354 AromaticContact CD2-CE2 3.31Å; Y286-F354 HydrophobicContact CD2-CE2 3.31Å; Y286-F354 HydrophobicContact CD2-CG 4.14Å; Y286-F354 HydrophobicContact CD2-CZ 4.07Å; Y286-F354 HydrophobicContact CE2-CD2 4.09Å; Y286-F354 AromaticContact CE2-CE2 3.94Å; Y286-F354 HydrophobicContact CE2-CE2 3.94Å; Y286-F354 HydrophobicContact CG-CB 4.24Å; Y286-F354 AromaticContact CG-CD2 3.53Å; Y286-F354 HydrophobicContact CG-CD2 3.53Å; Y286-F354 AromaticContact CG-CE2 3.98Å; Y286-F354 HydrophobicContact CG-CE2 3.98Å; Y286-F354 AromaticContact CG-CG 3.93Å; Y286-F354 HydrophobicContact CG-CG 3.93Å; G350-F354 WeakPolarHBondContact O-CB 3.3Å; G350-F354 WeakPolarHBondContact O-CD2 3.32Å; G350-F354 PolarHBondContact O-N 2.89Å; F354-N356 VanDerWaalsContact C-N 3.3Å; F354-N356 PolarHBondContact O-N 3.31Å; F354-L357 HydrophobicContact CD1-CD1 4.04Å; F354-L357 HydrophobicContact CE1-CD1 4.22Å; F354-L357 HydrophobicContact CG-CD1 4.5Å; F354-L357 PolarHBondContact O-N 2.99Å; F354-G358 PolarHBondContact O-N 3.11Å; F354-V368 HydrophobicContact CD1-CG1 4.11Å; F354-V368 HydrophobicContact CE1-CG1 4.42Å
355	S	95.3	Very high	92.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-42.8	170.2	-61.6	0	0	0	0	111.5	A279 V283 F351 I353 G358 F359	A279-S355 WeakPolarHBondContact CA-O 3.42Å; V283-S355 VanDerWaalsContact CG2-OG 3.31Å; V283-S355 WeakPolarHBondContact CG2-OG 3.38Å; F351-S355 WeakPolarHBondContact O-CB 3.45Å; F351-S355 PolarHBondContact O-N 3.45Å; F351-S355 VanDerWaalsContact O-N 3.09Å; F351-S355 PolarHBondContact O-OG 3.38Å; I353-S355 VanDerWaalsContact C-N 3.3Å; I353-S355 PolarHBondContact O-N 2.78Å; S355-G358 PolarHBondContact O-N 3.36Å; S355-F359 PolarHBondContact O-N 2.88Å; S355-F359 VanDerWaalsContact O-N 3.16Å
356	N	92	Very high	92.4	Very high	11 Å²	11	32.3 Å²	32.3	6%	0.059	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-37.7	175.6	-73.1	-44.5	0	0	0	112.8	S273 L276 V352 I353 F354 G358 F359 M360 A386 M390	S273-N356 WeakPolarHBondContact CB-OD1 3.04Å; S273-N356 PolarHBondContact OG-ND2 2.92Å; S273-N356 PolarHBondContact OG-OD1 3.17Å; L276-N356 WeakPolarHBondContact CD1-OD1 3.23Å; V352-N356 PolarHBondContact O-N 3.15Å; V352-N356 PolarHBondContact O-ND2 3.36Å; I353-N356 WeakPolarHBondContact O-CB 3.49Å; I353-N356 PolarHBondContact O-N 2.99Å; I353-N356 VanDerWaalsContact O-N 3.08Å; F354-N356 VanDerWaalsContact C-N 3.3Å; F354-N356 PolarHBondContact O-N 3.31Å; N356-G358 VanDerWaalsContact C-N 3.32Å; N356-G358 PolarHBondContact O-N 3.44Å; N356-F359 PolarHBondContact O-N 3.28Å; N356-M360 WeakPolarHBondContact O-CB 3.43Å; N356-M360 PolarHBondContact O-N 3.33Å; N356-A386 HydrophobicContact CB-CB 4.28Å; N356-M390 HydrophobicContact CB-CE 4.42Å; N356-M390 WeakPolarHBondContact OD1-CE 3.43Å
357	L	91.4	Very high	92.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-36.4	175	-61.7	-178.4	0	0	0	112.1	I353 F354 M360 A361 V368 V371 A372 L378 V382 Y383	I353-L357 HydrophobicContact CG2-CD1 4.11Å; I353-L357 WeakPolarHBondContact O-CG 3.46Å; I353-L357 PolarHBondContact O-N 2.68Å; F354-L357 HydrophobicContact CD1-CD1 4.04Å; F354-L357 HydrophobicContact CE1-CD1 4.22Å; F354-L357 HydrophobicContact CG-CD1 4.5Å; F354-L357 PolarHBondContact O-N 2.99Å; L357-M360 PolarHBondContact O-N 3.29Å; L357-A361 VanDerWaalsContact O-CB 3.26Å; L357-A361 WeakPolarHBondContact O-CB 3.32Å; L357-A361 PolarHBondContact O-N 2.93Å; L357-V368 HydrophobicContact CB-CG1 4.17Å; L357-V371 HydrophobicContact CB-CG2 4.24Å; L357-V371 HydrophobicContact CD2-CG2 4.36Å; L357-A372 HydrophobicContact CD1-CB 3.99Å; L357-L378 HydrophobicContact CD1-CD1 4.46Å; L357-V382 HydrophobicContact CD2-CG1 3.27Å; L357-Y383 HydrophobicContact CD2-CE1 4.37Å
358	G	94.3	Very high	91.8	Very high	1 Å²	1	35 Å²	35	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-45.4	172.8	0	0	0	0	0	112.5	G278 F354 S355 N356 A361 L362	G278-G358 CarbonylContact O-C 3.36Å; G278-G358 WeakPolarHBondContact O-CA 3.1Å; F354-G358 PolarHBondContact O-N 3.11Å; S355-G358 PolarHBondContact O-N 3.36Å; N356-G358 VanDerWaalsContact C-N 3.32Å; N356-G358 PolarHBondContact O-N 3.44Å; G358-A361 PolarHBondContact O-N 3Å; G358-L362 PolarHBondContact O-N 3.29Å
359	F	93.3	Very high	91.3	Very high	16 Å²	16	33.3 Å²	33.3	7%	0.07	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-44.8	173.8	169.8	-111.1	0	0	0	113	L276 P277 S355 N356 L362 T363 N389 M390	L276-F359 HydrophobicContact CB-CB 3.84Å; L276-F359 HydrophobicContact CB-CD2 3.87Å; L276-F359 HydrophobicContact CB-CG 3.86Å; L276-F359 HydrophobicContact CD1-CB 4.01Å; L276-F359 HydrophobicContact CD1-CD1 3.84Å; L276-F359 HydrophobicContact CD1-CD2 4.47Å; L276-F359 HydrophobicContact CD1-CE1 4.46Å; L276-F359 HydrophobicContact CD1-CG 3.83Å; L276-F359 HydrophobicContact CD2-CD2 4.34Å; L276-F359 HydrophobicContact CD2-CE2 4.36Å; L276-F359 HydrophobicContact CD2-CG 4.47Å; L276-F359 HydrophobicContact CG-CD2 4.45Å; L276-F359 HydrophobicContact CG-CG 4.27Å; P277-F359 HydrophobicContact CG-CD2 3.83Å; P277-F359 HydrophobicContact CG-CE2 3.9Å; P277-F359 VanDerWaalsContact O-CA 3.28Å; P277-F359 WeakPolarHBondContact O-CA 3.26Å; P277-F359 WeakPolarHBondContact O-CD2 3.2Å; S355-F359 PolarHBondContact O-N 2.88Å; S355-F359 VanDerWaalsContact O-N 3.16Å; N356-F359 PolarHBondContact O-N 3.28Å; F359-L362 PolarHBondContact O-N 3.41Å; F359-T363 WeakPolarHBondContact CE2-OG1 3.45Å; F359-T363 WeakPolarHBondContact O-CB 3.49Å; F359-T363 PolarHBondContact O-N 3.4Å; F359-T363 PolarHBondContact O-OG1 3.28Å; F359-N389 HydrophobicContact CE1-CB 3.68Å; F359-N389 HydrophobicContact CZ-CB 4.1Å; F359-N389 VanDerWaalsContact CZ-O 3.31Å; F359-N389 WeakPolarHBondContact CZ-O 3.43Å; F359-M390 HydrophobicContact CD1-CG 4.45Å; F359-M390 HydrophobicContact CE1-CG 3.93Å
360	M	89.8	Confident	90.7	Very high	11 Å²	11	35.5 Å²	35.5	5%	0.054	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-41.4	177.2	-178.4	177.9	167.1	0	0	111.7	N356 L357 T363 K364 V371 V382 E385 A386	N356-M360 WeakPolarHBondContact O-CB 3.43Å; N356-M360 PolarHBondContact O-N 3.33Å; L357-M360 PolarHBondContact O-N 3.29Å; M360-T363 PolarHBondContact O-N 2.97Å; M360-K364 HydrophobicContact CE-CD 3.95Å; M360-K364 HydrophobicContact CG-CD 4.37Å; M360-K364 WeakPolarHBondContact O-CB 3.13Å; M360-K364 PolarHBondContact O-N 3.44Å; M360-V371 HydrophobicContact CE-CB 4.19Å; M360-V371 HydrophobicContact CE-CG1 3.99Å; M360-V371 HydrophobicContact CG-CG1 4.37Å; M360-V371 HydrophobicContact SD-CB 4.31Å; M360-V371 HydrophobicContact SD-CG1 4.44Å; M360-V382 HydrophobicContact SD-CG1 4.06Å; M360-E385 HydrophobicContact CE-CB 3.92Å; M360-E385 HydrophobicContact CE-CG 3.33Å; M360-E385 HydrophobicContact SD-CB 4.18Å; M360-E385 HydrophobicContact SD-CG 4.03Å; M360-A386 HydrophobicContact CB-CB 4.28Å; M360-A386 HydrophobicContact SD-CB 4.19Å
361	A	90.5	Very high	90.1	Very high	5 Å²	5	36.2 Å²	36.2	4%	0.041	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-45	177	0	0	0	0	0	111.5	L357 G358 N365 T366 V368 V371	L357-A361 VanDerWaalsContact O-CB 3.26Å; L357-A361 WeakPolarHBondContact O-CB 3.32Å; L357-A361 PolarHBondContact O-N 2.93Å; G358-A361 PolarHBondContact O-N 3Å; A361-N365 PolarHBondContact O-N 3.19Å; A361-T366 HydrophobicContact CB-CG2 4.48Å; A361-T366 PolarHBondContact O-N 3.28Å; A361-V368 HydrophobicContact CB-CG2 3.95Å; A361-V371 HydrophobicContact CB-CG2 4.42Å
362	L	91.8	Very high	89.1	Confident	89 Å²	89	33.5 Å²	33.5	47%	0.466	20%	0.195	S	C	.	.	H	α-helix	trans	-62.7	-47.2	175	179.5	64.6	0	0	0	111.8	P277 G358 F359 K364 N365	P277-L362 HydrophobicContact CB-CD2 3.79Å; P277-L362 HydrophobicContact CG-CD2 4.41Å; G358-L362 PolarHBondContact O-N 3.29Å; F359-L362 PolarHBondContact O-N 3.41Å; L362-K364 VanDerWaalsContact C-N 3.32Å; L362-K364 PolarHBondContact O-N 3.37Å; L362-N365 PolarHBondContact O-N 2.84Å; L362-N365 VanDerWaalsContact O-N 3.14Å
363	T	87.3	Confident	87.8	Confident	69 Å²	69	37.8 Å²	37.8	42%	0.423	22%	0.221	S	C	.	.	H	α-helix	trans	-64.5	-37.1	-177.5	-55.7	0	0	0	0	112	F359 M360 N365 N389	F359-T363 WeakPolarHBondContact CE2-OG1 3.45Å; F359-T363 WeakPolarHBondContact O-CB 3.49Å; F359-T363 PolarHBondContact O-N 3.4Å; F359-T363 PolarHBondContact O-OG1 3.28Å; M360-T363 PolarHBondContact O-N 2.97Å; T363-N365 VanDerWaalsContact C-N 3.34Å; T363-N389 HydrophobicContact CG2-CB 4.3Å
364	K	83.8	Confident	86	Confident	80 Å²	80	39.4 Å²	39.4	35%	0.348	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	5.9	176.8	-66.8	-165	173.8	-165.2	0	113.9	M360 L362 T366 E385	M360-K364 HydrophobicContact CE-CD 3.95Å; M360-K364 HydrophobicContact CG-CD 4.37Å; M360-K364 WeakPolarHBondContact O-CB 3.13Å; M360-K364 PolarHBondContact O-N 3.44Å; L362-K364 VanDerWaalsContact C-N 3.32Å; L362-K364 PolarHBondContact O-N 3.37Å; K364-T366 VanDerWaalsContact C-N 3.25Å; K364-T366 HydrophobicContact CB-CG2 3.9Å; K364-T366 PolarHBondContact O-N 3.18Å; K364-E385 WeakPolarHBondContact CE-OE1 3.39Å; K364-E385 IonicContact NZ-OE1 2.78Å; K364-E385 PolarHBondContact NZ-OE1 3.14Å
365	N	86.5	Confident	84.5	Confident	157 Å²	157	40 Å²	40	84%	0.84	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.3	47.5	-176.4	-166.1	33.7	0	0	0	113	A361 L362 T363	A361-N365 PolarHBondContact O-N 3.19Å; L362-N365 PolarHBondContact O-N 2.84Å; L362-N365 VanDerWaalsContact O-N 3.14Å; T363-N365 VanDerWaalsContact C-N 3.34Å
366	T	87.3	Confident	82.5	Confident	61 Å²	61	42.5 Å²	42.5	37%	0.374	26%	0.256	S	S	.	.	S	Bend	trans	-133.1	-176	-177.7	-169.2	0	0	0	0	110.6	A361 K364 V371	A361-T366 HydrophobicContact CB-CG2 4.48Å; A361-T366 PolarHBondContact O-N 3.28Å; K364-T366 VanDerWaalsContact C-N 3.25Å; K364-T366 HydrophobicContact CB-CG2 3.9Å; K364-T366 PolarHBondContact O-N 3.18Å; T366-V371 HydrophobicContact CG2-CG1 3.57Å
367	T	90.8	Very high	81.5	Confident	87 Å²	87	42.2 Å²	42.2	53%	0.534	26%	0.256	S	S	.	.			trans	-94.7	153	178.3	68	0	0	0	0	111.7	A369 A370 V371	T367-A369 PolarHBondContact O-N 3.44Å; T367-A370 PolarHBondContact O-N 3.37Å; T367-A370 VanDerWaalsContact O-N 3.13Å; T367-A370 PolarHBondContact OG1-N 3.1Å; T367-V371 PolarHBondContact O-N 2.86Å
368	V	88.9	Confident	80.7	Confident	12 Å²	12	42.3 Å²	42.3	7%	0.073	26%	0.256	C	S	.	.	H	α-helix	trans	-57.7	-36.9	173.6	-178.4	0	0	0	0	111.2	Y285 F354 L357 A361 A370 V371 A372	Y285-V368 HydrophobicContact CD1-CB 4.08Å; Y285-V368 HydrophobicContact CD1-CG1 3.48Å; Y285-V368 VanDerWaalsContact CD1-CG1 3.48Å; Y285-V368 HydrophobicContact CD2-CB 4.29Å; Y285-V368 HydrophobicContact CE1-CG1 4.09Å; Y285-V368 HydrophobicContact CG-CB 3.89Å; Y285-V368 HydrophobicContact CG-CG1 3.75Å; F354-V368 HydrophobicContact CD1-CG1 4.11Å; F354-V368 HydrophobicContact CE1-CG1 4.42Å; L357-V368 HydrophobicContact CB-CG1 4.17Å; A361-V368 HydrophobicContact CB-CG2 3.95Å; V368-A370 VanDerWaalsContact C-N 3.33Å; V368-A370 PolarHBondContact O-N 2.84Å; V368-V371 VanDerWaalsContact O-CG2 3.24Å; V368-V371 WeakPolarHBondContact O-CG2 3.43Å; V368-V371 PolarHBondContact O-N 3.24Å; V368-A372 WeakPolarHBondContact O-CB 3.44Å; V368-A372 PolarHBondContact O-N 2.93Å
369	A	87.3	Confident	80.4	Confident	33 Å²	33	42.2 Å²	42.2	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-39.9	177.6	0	0	0	0	0	112.6	H88 Y285 T367 T373	H88-A369 PolarHBondContact CE1-O 2.86Å; Y285-A369 HydrophobicContact CE2-CB 3.94Å; Y285-A369 WeakPolarHBondContact OH-CB 3.24Å; T367-A369 PolarHBondContact O-N 3.44Å; A369-T373 WeakPolarHBondContact O-CG2 3.07Å
370	A	83.2	Confident	80.3	Confident	47 Å²	47	41.5 Å²	41.5	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-68.7	-35.1	-178.2	0	0	0	0	0	112.7	T367 V368 T373	T367-A370 PolarHBondContact O-N 3.37Å; T367-A370 VanDerWaalsContact O-N 3.13Å; T367-A370 PolarHBondContact OG1-N 3.1Å; V368-A370 VanDerWaalsContact C-N 3.33Å; V368-A370 PolarHBondContact O-N 2.84Å; A370-T373 WeakPolarHBondContact O-CG2 3.33Å; A370-T373 PolarHBondContact O-OG1 3.41Å
371	V	82.3	Confident	80.4	Confident	14 Å²	14	41.2 Å²	41.2	9%	0.085	25%	0.251	C	S	.	.	H	α-helix	trans	-84.3	-18.6	-178.3	-61.4	0	0	0	0	113.6	L357 M360 A361 T366 T367 V368 T373 V382	L357-V371 HydrophobicContact CB-CG2 4.24Å; L357-V371 HydrophobicContact CD2-CG2 4.36Å; M360-V371 HydrophobicContact CE-CB 4.19Å; M360-V371 HydrophobicContact CE-CG1 3.99Å; M360-V371 HydrophobicContact CG-CG1 4.37Å; M360-V371 HydrophobicContact SD-CB 4.31Å; M360-V371 HydrophobicContact SD-CG1 4.44Å; A361-V371 HydrophobicContact CB-CG2 4.42Å; T366-V371 HydrophobicContact CG2-CG1 3.57Å; T367-V371 PolarHBondContact O-N 2.86Å; V368-V371 VanDerWaalsContact O-CG2 3.24Å; V368-V371 WeakPolarHBondContact O-CG2 3.43Å; V368-V371 PolarHBondContact O-N 3.24Å; V371-T373 VanDerWaalsContact C-N 3.28Å; V371-T373 PolarHBondContact O-N 3.12Å; V371-V382 VanDerWaalsContact O-CG1 3.26Å; V371-V382 WeakPolarHBondContact O-CG1 3.47Å
372	A	75.7	Confident	80.4	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	8	-178.1	0	0	0	0	0	114.5	H88 L357 V368 S374	H88-A372 HydrophobicContact CB-CB 4.3Å; H88-A372 PolarHBondContact CD2-O 3.32Å; H88-A372 VanDerWaalsContact CD2-O 3.27Å; L357-A372 HydrophobicContact CD1-CB 3.99Å; V368-A372 WeakPolarHBondContact O-CB 3.44Å; V368-A372 PolarHBondContact O-N 2.93Å; A372-S374 VanDerWaalsContact C-N 3.32Å; A372-S374 PolarHBondContact O-N 2.83Å; A372-S374 VanDerWaalsContact O-N 3.13Å
373	T	65.5	Low	80.2	Confident	93 Å²	93	37.3 Å²	37.3	57%	0.571	23%	0.23	S	C	*	.			trans	-77.2	5.8	-160.4	41.1	0	0	0	0	117.2	A369 A370 V371	A369-T373 WeakPolarHBondContact O-CG2 3.07Å; A370-T373 WeakPolarHBondContact O-CG2 3.33Å; A370-T373 PolarHBondContact O-OG1 3.41Å; V371-T373 VanDerWaalsContact C-N 3.28Å; V371-T373 PolarHBondContact O-N 3.12Å
374	S	56.1	Low	80.4	Confident	36 Å²	36	34 Å²	34	25%	0.252	21%	0.21	S	C	.	.			trans	-124.2	123	-172.2	-60.6	0	0	0	0	111.6	A372 L378	A372-S374 VanDerWaalsContact C-N 3.32Å; A372-S374 PolarHBondContact O-N 2.83Å; A372-S374 VanDerWaalsContact O-N 3.13Å; S374-L378 WeakPolarHBondContact O-CA 3.32Å; S374-L378 VanDerWaalsContact O-CB 3.23Å; S374-L378 WeakPolarHBondContact O-CB 3.41Å; S374-L378 PolarHBondContact O-N 3.39Å
375	G	60.6	Low	80.8	Confident	15 Å²	15	30.8 Å²	30.8	16%	0.155	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-91.2	-179.4	0	0	0	0	0	113.6	G377 L378	G375-G377 PolarHBondContact O-N 3.07Å; G375-L378 VanDerWaalsContact O-CB 3.22Å; G375-L378 WeakPolarHBondContact O-CB 3.19Å; G375-L378 PolarHBondContact O-N 3.16Å
376	P	55.1	Low	80.9	Confident	52 Å²	52	23.4 Å²	23.4	34%	0.338	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.3	172	23.4	-30.2	0	0	0	112.1	W81 L378 A379	W81-P376 HydrophobicContact CH2-CB 4.17Å; W81-P376 HydrophobicContact CZ3-CB 3.88Å; W81-P376 WeakPolarHBondContact CZ3-O 3.29Å; P376-L378 PolarHBondContact O-N 3.03Å; P376-L378 VanDerWaalsContact O-N 3.13Å; P376-A379 PolarHBondContact O-N 3.4Å
377	G	69.5	Low	81.1	Confident	5 Å²	5	20.8 Å²	20.8	5%	0.052	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-18.2	171.1	0	0	0	0	0	113.6	G375 A379 F380 V381 V382	G375-G377 PolarHBondContact O-N 3.07Å; G377-A379 VanDerWaalsContact C-N 3.3Å; G377-A379 PolarHBondContact O-N 2.89Å; G377-F380 PolarHBondContact O-N 3.38Å; G377-V381 VanDerWaalsContact O-CA 3.3Å; G377-V381 WeakPolarHBondContact O-CA 3.41Å; G377-V381 WeakPolarHBondContact O-CB 3.27Å; G377-V381 PolarHBondContact O-N 2.86Å; G377-V382 PolarHBondContact O-N 2.98Å
378	L	75.6	Confident	81.2	Confident	3 Å²	3	17.8 Å²	17.8	2%	0.016	12%	0.122	C	C	.	.	I	π-helix	trans	-56.6	-45.9	177	-159.8	66.6	0	0	0	111.6	W81 L357 S374 G375 P376 V382 Y383	W81-L378 VanDerWaalsContact O-CD2 3.29Å; W81-L378 WeakPolarHBondContact O-CD2 3.23Å; L357-L378 HydrophobicContact CD1-CD1 4.46Å; S374-L378 WeakPolarHBondContact O-CA 3.32Å; S374-L378 VanDerWaalsContact O-CB 3.23Å; S374-L378 WeakPolarHBondContact O-CB 3.41Å; S374-L378 PolarHBondContact O-N 3.39Å; G375-L378 VanDerWaalsContact O-CB 3.22Å; G375-L378 WeakPolarHBondContact O-CB 3.19Å; G375-L378 PolarHBondContact O-N 3.16Å; P376-L378 PolarHBondContact O-N 3.03Å; P376-L378 VanDerWaalsContact O-N 3.13Å; L378-V382 HydrophobicContact CD1-CB 3.99Å; L378-V382 HydrophobicContact CD1-CG1 4.19Å; L378-V382 HydrophobicContact CD1-CG2 4.11Å; L378-V382 PolarHBondContact O-N 2.87Å; L378-Y383 HydrophobicContact CB-CE2 4.44Å; L378-Y383 HydrophobicContact CD2-CE2 4.22Å; L378-Y383 WeakPolarHBondContact CD2-OH 3.41Å; L378-Y383 HydrophobicContact CG-CE2 3.73Å; L378-Y383 VanDerWaalsContact CG-OH 3.25Å; L378-Y383 WeakPolarHBondContact CG-OH 3.49Å; L378-Y383 WeakPolarHBondContact O-CD2 3.15Å; L378-Y383 VanDerWaalsContact O-CE2 3.31Å; L378-Y383 WeakPolarHBondContact O-CE2 3.48Å; L378-Y383 PolarHBondContact O-N 3.17Å; L378-Y383 VanDerWaalsContact O-N 3.1Å
379	A	87.1	Confident	81.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.133	C	C	.	.	I	π-helix	trans	-75.2	-37.9	-176.3	0	0	0	0	0	114.3	W81 P376 G377 P384 M404	W81-A379 HydrophobicContact CB-CB 4.08Å; W81-A379 HydrophobicContact CD2-CB 3.91Å; W81-A379 HydrophobicContact CE3-CB 3.15Å; W81-A379 HydrophobicContact CG-CB 4.33Å; W81-A379 HydrophobicContact CZ3-CB 3.79Å; P376-A379 PolarHBondContact O-N 3.4Å; G377-A379 VanDerWaalsContact C-N 3.3Å; G377-A379 PolarHBondContact O-N 2.89Å; A379-P384 WeakPolarHBondContact O-CD 3.36Å; A379-M404 HydrophobicContact CB-CE 3.81Å
380	F	92.3	Very high	81.3	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.122	C	C	.	.	I	π-helix	trans	-109	-6.7	-169	-59.3	-71	0	0	0	114.2	W81 V156 H159 F163 Y208 G377 P384 F401	W81-F380 HydrophobicContact CE3-CE2 4.35Å; W81-F380 AromaticContact CH2-CE2 3.83Å; W81-F380 HydrophobicContact CH2-CE2 3.83Å; W81-F380 AromaticContact CZ3-CD2 3.74Å; W81-F380 HydrophobicContact CZ3-CD2 3.74Å; W81-F380 AromaticContact CZ3-CE2 3.43Å; W81-F380 HydrophobicContact CZ3-CE2 3.43Å; W81-F380 VanDerWaalsContact CZ3-CE2 3.43Å; V156-F380 HydrophobicContact CG1-CE2 3.86Å; V156-F380 HydrophobicContact CG1-CZ 3.95Å; H159-F380 HydrophobicContact CB-CD1 4.4Å; H159-F380 HydrophobicContact CB-CE1 3.78Å; H159-F380 HydrophobicContact CB-CE2 4.24Å; H159-F380 HydrophobicContact CB-CZ 3.69Å; F163-F380 AromaticContact CD2-CD1 3.64Å; F163-F380 HydrophobicContact CD2-CD1 3.64Å; F163-F380 HydrophobicContact CD2-CE1 4.19Å; F163-F380 HydrophobicContact CE2-CB 4.07Å; F163-F380 AromaticContact CE2-CD1 3.73Å; F163-F380 HydrophobicContact CE2-CD1 3.73Å; F163-F380 HydrophobicContact CE2-CG 4.25Å; F163-F380 HydrophobicContact CG-CD1 4.21Å; F163-F380 HydrophobicContact CZ-CB 4.07Å; F163-F380 HydrophobicContact CZ-CD1 4.36Å; Y208-F380 HydrophobicContact CD1-CB 4.4Å; Y208-F380 HydrophobicContact CD2-CB 3.56Å; Y208-F380 HydrophobicContact CD2-CG 4.29Å; Y208-F380 HydrophobicContact CE1-CB 4.34Å; Y208-F380 HydrophobicContact CE2-CB 3.47Å; Y208-F380 VanDerWaalsContact CE2-CB 3.47Å; Y208-F380 HydrophobicContact CE2-CD1 4.49Å; Y208-F380 HydrophobicContact CE2-CD2 4Å; Y208-F380 AromaticContact CE2-CG 3.76Å; Y208-F380 HydrophobicContact CE2-CG 3.76Å; Y208-F380 HydrophobicContact CG-CB 4.02Å; Y208-F380 AromaticContact CZ-CD2 3.97Å; G377-F380 PolarHBondContact O-N 3.38Å; F380-P384 WeakPolarHBondContact O-CG 3.42Å; F380-F401 AromaticContact CD1-CE1 3.8Å; F380-F401 HydrophobicContact CD1-CE1 3.8Å; F380-F401 HydrophobicContact CD1-CZ 4.38Å; F380-F401 AromaticContact CE1-CE1 3.88Å; F380-F401 HydrophobicContact CE1-CE1 3.88Å
381	V	91.6	Very high	81.6	Confident	6 Å²	6	20.4 Å²	20.4	4%	0.036	13%	0.128	C	C	.	.	I	π-helix	trans	-118.2	-63.2	175.2	177.3	0	0	0	0	109.3	S204 E205 Y208 F209 G377 P384 E385	S204-V381 WeakPolarHBondContact CB-O 3.29Å; S204-V381 PolarHBondContact OG-O 2.93Å; E205-V381 VanDerWaalsContact CA-CG1 3.49Å; E205-V381 HydrophobicContact CB-CG1 3.55Å; E205-V381 HydrophobicContact CB-CG2 4.48Å; E205-V381 HydrophobicContact CG-CG1 4.06Å; Y208-V381 HydrophobicContact CD1-CG2 3.84Å; Y208-V381 HydrophobicContact CG-CG2 4.12Å; F209-V381 HydrophobicContact CE2-CG2 4.37Å; G377-V381 VanDerWaalsContact O-CA 3.3Å; G377-V381 WeakPolarHBondContact O-CA 3.41Å; G377-V381 WeakPolarHBondContact O-CB 3.27Å; G377-V381 PolarHBondContact O-N 2.86Å; V381-P384 WeakPolarHBondContact O-CD 3.42Å; V381-E385 WeakPolarHBondContact O-CB 3.42Å; V381-E385 PolarHBondContact O-N 2.64Å
382	V	89.5	Confident	82.1	Confident	7 Å²	7	25.6 Å²	25.6	4%	0.042	16%	0.155	C	C	.	.	I	π-helix	trans	-70	-42.4	-168.2	-173.1	0	0	0	0	113.1	L357 M360 V371 G377 L378 E385 A386	L357-V382 HydrophobicContact CD2-CG1 3.27Å; M360-V382 HydrophobicContact SD-CG1 4.06Å; V371-V382 VanDerWaalsContact O-CG1 3.26Å; V371-V382 WeakPolarHBondContact O-CG1 3.47Å; G377-V382 PolarHBondContact O-N 2.98Å; L378-V382 HydrophobicContact CD1-CB 3.99Å; L378-V382 HydrophobicContact CD1-CG1 4.19Å; L378-V382 HydrophobicContact CD1-CG2 4.11Å; L378-V382 PolarHBondContact O-N 2.87Å; V382-E385 WeakPolarHBondContact O-CB 3.11Å; V382-E385 PolarHBondContact O-N 3.1Å; V382-A386 PolarHBondContact O-N 2.94Å
383	Y	88.1	Confident	83	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-73.3	-41.8	175.2	-58.7	-59.8	0	0	0	114.5	I353 L357 L378 E385 A386 M387 F400	I353-Y383 HydrophobicContact CB-CE1 4.06Å; I353-Y383 VanDerWaalsContact CB-OH 3.24Å; I353-Y383 WeakPolarHBondContact CB-OH 3.46Å; I353-Y383 HydrophobicContact CD1-CD1 4.43Å; I353-Y383 HydrophobicContact CD1-CE1 3.65Å; I353-Y383 HydrophobicContact CD1-CE2 3.8Å; I353-Y383 WeakPolarHBondContact CD1-OH 3.34Å; I353-Y383 HydrophobicContact CG1-CE1 4.06Å; I353-Y383 HydrophobicContact CG1-CE2 4.26Å; I353-Y383 WeakPolarHBondContact CG1-OH 3.47Å; I353-Y383 HydrophobicContact CG2-CE1 4Å; I353-Y383 WeakPolarHBondContact CG2-OH 3.43Å; L357-Y383 HydrophobicContact CD2-CE1 4.37Å; L378-Y383 HydrophobicContact CB-CE2 4.44Å; L378-Y383 HydrophobicContact CD2-CE2 4.22Å; L378-Y383 WeakPolarHBondContact CD2-OH 3.41Å; L378-Y383 HydrophobicContact CG-CE2 3.73Å; L378-Y383 VanDerWaalsContact CG-OH 3.25Å; L378-Y383 WeakPolarHBondContact CG-OH 3.49Å; L378-Y383 WeakPolarHBondContact O-CD2 3.15Å; L378-Y383 VanDerWaalsContact O-CE2 3.31Å; L378-Y383 WeakPolarHBondContact O-CE2 3.48Å; L378-Y383 PolarHBondContact O-N 3.17Å; L378-Y383 VanDerWaalsContact O-N 3.1Å; Y383-E385 PolarHBondContact O-N 3.21Å; Y383-A386 PolarHBondContact O-N 3.07Å; Y383-M387 WeakPolarHBondContact O-CB 3.3Å; Y383-M387 WeakPolarHBondContact O-CE 3.21Å; Y383-M387 WeakPolarHBondContact O-CG 3.49Å; Y383-M387 PolarHBondContact O-N 2.93Å; Y383-F400 HydrophobicContact CD2-CE1 4.4Å; Y383-F400 HydrophobicContact CD2-CE2 4.05Å; Y383-F400 AromaticContact CD2-CZ 3.61Å; Y383-F400 HydrophobicContact CD2-CZ 3.61Å; Y383-F400 HydrophobicContact CE2-CZ 4.41Å; Y383-F400 HydrophobicContact CG-CE2 4.37Å; Y383-F400 HydrophobicContact CG-CZ 4.16Å
384	P	92.6	Very high	84.5	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-51.3	-39	170.8	-35.5	43.7	0	0	0	112	F163 W174 A379 F380 V381 M387 T388 F401	F163-P384 HydrophobicContact CD1-CG 4.49Å; F163-P384 HydrophobicContact CE1-CG 4.21Å; W174-P384 HydrophobicContact CD2-CB 4.31Å; W174-P384 HydrophobicContact CG-CB 4.27Å; W174-P384 HydrophobicContact CZ2-CB 4.35Å; W174-P384 PolarHBondContact NE1-O 2.95Å; A379-P384 WeakPolarHBondContact O-CD 3.36Å; F380-P384 WeakPolarHBondContact O-CG 3.42Å; V381-P384 WeakPolarHBondContact O-CD 3.42Å; P384-M387 HydrophobicContact CG-CE 4.4Å; P384-T388 PolarHBondContact O-N 2.92Å; P384-T388 VanDerWaalsContact O-N 3.14Å; P384-T388 PolarHBondContact O-OG1 2.93Å; P384-F401 HydrophobicContact CG-CE2 4.22Å; P384-F401 HydrophobicContact CG-CZ 3.75Å
385	E	90.9	Very high	86.4	Confident	13 Å²	13	25.9 Å²	25.9	6%	0.061	15%	0.153	C	C	.	.	H	α-helix	trans	-63.9	-49.9	171	-166.3	60.1	-165	0	0	113.1	A202 S204 M360 K364 V381 V382 Y383 M387 T388 N389	A202-E385 HydrophobicContact CB-CG 4.25Å; S204-E385 WeakPolarHBondContact OG-CB 3.47Å; S204-E385 PolarHBondContact OG-OE2 3.48Å; M360-E385 HydrophobicContact CE-CB 3.92Å; M360-E385 HydrophobicContact CE-CG 3.33Å; M360-E385 HydrophobicContact SD-CB 4.18Å; M360-E385 HydrophobicContact SD-CG 4.03Å; K364-E385 WeakPolarHBondContact CE-OE1 3.39Å; K364-E385 IonicContact NZ-OE1 2.78Å; K364-E385 PolarHBondContact NZ-OE1 3.14Å; V381-E385 WeakPolarHBondContact O-CB 3.42Å; V381-E385 PolarHBondContact O-N 2.64Å; V382-E385 WeakPolarHBondContact O-CB 3.11Å; V382-E385 PolarHBondContact O-N 3.1Å; Y383-E385 PolarHBondContact O-N 3.21Å; E385-M387 VanDerWaalsContact C-N 3.31Å; E385-M387 PolarHBondContact O-N 3.45Å; E385-T388 WeakPolarHBondContact O-CB 3.3Å; E385-T388 PolarHBondContact O-N 3.27Å; E385-N389 PolarHBondContact O-ND2 3.18Å
386	A	89.8	Confident	88	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-40.6	-179.9	0	0	0	0	0	112.1	N356 M360 V382 Y383 N389	N356-A386 HydrophobicContact CB-CB 4.28Å; M360-A386 HydrophobicContact CB-CB 4.28Å; M360-A386 HydrophobicContact SD-CB 4.19Å; V382-A386 PolarHBondContact O-N 2.94Å; Y383-A386 PolarHBondContact O-N 3.07Å; A386-N389 PolarHBondContact O-N 3.32Å
387	M	91.7	Very high	90	Very high	7 Å²	7	24.3 Å²	24.3	3%	0.034	14%	0.136	C	C	.	.	H	α-helix	trans	-69.7	-32.3	179.2	-68.4	-176.6	-69.1	0	0	112.8	Y383 P384 E385 N389 M390 P393 W396 S397 F400 F401	Y383-M387 WeakPolarHBondContact O-CB 3.3Å; Y383-M387 WeakPolarHBondContact O-CE 3.21Å; Y383-M387 WeakPolarHBondContact O-CG 3.49Å; Y383-M387 PolarHBondContact O-N 2.93Å; P384-M387 HydrophobicContact CG-CE 4.4Å; E385-M387 VanDerWaalsContact C-N 3.31Å; E385-M387 PolarHBondContact O-N 3.45Å; M387-N389 PolarHBondContact O-N 3.41Å; M387-M390 HydrophobicContact CG-CE 4.33Å; M387-M390 WeakPolarHBondContact O-CB 3.15Å; M387-M390 PolarHBondContact O-N 3.15Å; M387-P393 WeakPolarHBondContact O-CB 3.45Å; M387-W396 HydrophobicContact CG-CB 4.22Å; M387-W396 VanDerWaalsContact SD-C 3.59Å; M387-W396 HydrophobicContact SD-CB 4.17Å; M387-S397 VanDerWaalsContact SD-CA 3.59Å; M387-F400 HydrophobicContact CE-CB 4.13Å; M387-F400 HydrophobicContact CE-CD1 3.8Å; M387-F400 HydrophobicContact CE-CG 4.08Å; M387-F400 HydrophobicContact SD-CB 3.69Å; M387-F400 HydrophobicContact SD-CD1 4.43Å; M387-F400 HydrophobicContact SD-CG 4.11Å; M387-F401 HydrophobicContact CE-CE2 4.14Å
388	T	92.1	Very high	91.3	Very high	23 Å²	23	25.5 Å²	25.5	14%	0.141	14%	0.142	C	C	.	.	H	α-helix	trans	-57.5	-30.8	174.2	-65.5	0	0	0	0	112.1	T175 P384 E385 M390	T175-T388 HydrophobicContact CG2-CG2 3.63Å; P384-T388 PolarHBondContact O-N 2.92Å; P384-T388 VanDerWaalsContact O-N 3.14Å; P384-T388 PolarHBondContact O-OG1 2.93Å; E385-T388 WeakPolarHBondContact O-CB 3.3Å; E385-T388 PolarHBondContact O-N 3.27Å; T388-M390 VanDerWaalsContact C-N 3.35Å
389	N	87.2	Confident	92.2	Very high	57 Å²	57	27 Å²	27	31%	0.305	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-4.4	-179.7	-68.5	-77.4	0	0	0	113.5	F359 T363 E385 A386 M387	F359-N389 HydrophobicContact CE1-CB 3.68Å; F359-N389 HydrophobicContact CZ-CB 4.1Å; F359-N389 VanDerWaalsContact CZ-O 3.31Å; F359-N389 WeakPolarHBondContact CZ-O 3.43Å; T363-N389 HydrophobicContact CG2-CB 4.3Å; E385-N389 PolarHBondContact O-ND2 3.18Å; A386-N389 PolarHBondContact O-N 3.32Å; M387-N389 PolarHBondContact O-N 3.41Å
390	M	90.3	Very high	92.6	Very high	10 Å²	10	27.3 Å²	27.3	5%	0.049	15%	0.151	C	C	.	.	S	Bend	trans	-89.3	152.3	178.5	-61.8	-175.5	-159	0	0	111.8	L276 N356 F359 M387 T388 L392 P393 W396	L276-M390 HydrophobicContact CD1-CE 3.66Å; L276-M390 HydrophobicContact CD1-CG 4.24Å; L276-M390 HydrophobicContact CD1-SD 3.97Å; N356-M390 HydrophobicContact CB-CE 4.42Å; N356-M390 WeakPolarHBondContact OD1-CE 3.43Å; F359-M390 HydrophobicContact CD1-CG 4.45Å; F359-M390 HydrophobicContact CE1-CG 3.93Å; M387-M390 HydrophobicContact CG-CE 4.33Å; M387-M390 WeakPolarHBondContact O-CB 3.15Å; M387-M390 PolarHBondContact O-N 3.15Å; T388-M390 VanDerWaalsContact C-N 3.35Å; M390-L392 PolarHBondContact O-N 3.04Å; M390-P393 WeakPolarHBondContact O-CD 3.4Å; M390-P393 WeakPolarHBondContact O-CG 3.37Å; M390-W396 HydrophobicContact SD-CB 4.48Å; M390-W396 HydrophobicContact SD-CG 4.08Å
391	P	89.8	Confident	92.9	Very high	80 Å²	80	27.3 Å²	27.3	52%	0.519	15%	0.151	S	C	.	.	S	Bend	trans	-62.2	138.4	166.2	27.6	-34.9	0	0	0	110.1	W396	P391-W396 PolarHBondContact O-NE1 2.96Å
392	L	93.3	Very high	93.1	Very high	124 Å²	124	29.6 Å²	29.6	65%	0.649	16%	0.162	S	C	*	.	S	Bend	trans	57.4	56.9	-172	-52.7	170.8	0	0	0	113.4	M390 S394 L395	M390-L392 PolarHBondContact O-N 3.04Å; L392-S394 PolarHBondContact O-N 3.28Å; L392-S394 VanDerWaalsContact O-N 3.14Å; L392-L395 HydrophobicContact CB-CB 4.1Å; L392-L395 HydrophobicContact CD1-CD2 4.29Å; L392-L395 WeakPolarHBondContact O-CB 3.3Å; L392-L395 PolarHBondContact O-N 3.4Å; L392-L395 VanDerWaalsContact O-N 3.07Å
393	P	94.9	Very high	93.4	Very high	33 Å²	33	29.3 Å²	29.3	21%	0.214	16%	0.161	C	C	.	.	H	α-helix	trans	-50.7	-42.3	-176.7	-26.4	33.3	0	0	0	114.1	L172 M387 M390 L395 W396 S397	L172-P393 HydrophobicContact CD1-CB 3.54Å; L172-P393 HydrophobicContact CG-CB 4.13Å; M387-P393 WeakPolarHBondContact O-CB 3.45Å; M390-P393 WeakPolarHBondContact O-CD 3.4Å; M390-P393 WeakPolarHBondContact O-CG 3.37Å; P393-L395 VanDerWaalsContact C-N 3.32Å; P393-L395 PolarHBondContact O-N 3.31Å; P393-W396 PolarHBondContact O-N 2.77Å; P393-S397 WeakPolarHBondContact O-CB 3.4Å; P393-S397 PolarHBondContact O-N 2.98Å
394	S	96.6	Very high	93.8	Very high	22 Å²	22	29.1 Å²	29.1	15%	0.154	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-37	-177.9	-46.7	0	0	0	0	113	T169 S170 L392 S397 V398	T169-S394 WeakPolarHBondContact O-CB 3.39Å; T169-S394 PolarHBondContact O-OG 3.28Å; S170-S394 PolarHBondContact O-OG 3.46Å; L392-S394 PolarHBondContact O-N 3.28Å; L392-S394 VanDerWaalsContact O-N 3.14Å; S394-S397 PolarHBondContact O-N 2.91Å; S394-V398 VanDerWaalsContact O-CG2 3.3Å; S394-V398 WeakPolarHBondContact O-CG2 3.38Å; S394-V398 PolarHBondContact O-N 3.36Å
395	L	95.7	Very high	94.1	Very high	82 Å²	82	29.9 Å²	29.9	43%	0.429	16%	0.164	S	C	.	.	H	α-helix	trans	-60.8	-52.2	176.2	174	64.4	0	0	0	110.5	L392 P393 S397 V398 L399	L392-L395 HydrophobicContact CB-CB 4.1Å; L392-L395 HydrophobicContact CD1-CD2 4.29Å; L392-L395 WeakPolarHBondContact O-CB 3.3Å; L392-L395 PolarHBondContact O-N 3.4Å; L392-L395 VanDerWaalsContact O-N 3.07Å; P393-L395 VanDerWaalsContact C-N 3.32Å; P393-L395 PolarHBondContact O-N 3.31Å; L395-S397 VanDerWaalsContact C-N 3.3Å; L395-S397 PolarHBondContact O-N 2.99Å; L395-V398 PolarHBondContact O-N 2.92Å; L395-L399 HydrophobicContact CD1-CD1 4.1Å; L395-L399 HydrophobicContact CD1-CG 4.34Å; L395-L399 HydrophobicContact CG-CD1 4.16Å; L395-L399 VanDerWaalsContact O-CG 3.3Å; L395-L399 WeakPolarHBondContact O-CG 3.42Å; L395-L399 PolarHBondContact O-N 2.91Å
396	W	95	Very high	94.4	Very high	34 Å²	34	29.6 Å²	29.6	13%	0.129	16%	0.163	C	C	.	.	H	α-helix	trans	-65.1	-38.2	-178.5	-54.6	112.9	0	0	0	111.7	I268 L269 R272 M387 M390 P391 P393 L399 F400	I268-W396 HydrophobicContact CG2-CZ3 4.24Å; L269-W396 HydrophobicContact CD2-CE3 4.18Å; R272-W396 HydrophobicContact CB-CE3 4.29Å; R272-W396 HydrophobicContact CB-CH2 3.69Å; R272-W396 HydrophobicContact CB-CZ2 4.33Å; R272-W396 HydrophobicContact CB-CZ3 3.65Å; R272-W396 VanDerWaalsContact CD-CZ2 3.47Å; R272-W396 HydrophobicContact CG-CD2 4.16Å; R272-W396 HydrophobicContact CG-CE3 4.03Å; R272-W396 HydrophobicContact CG-CH2 3.45Å; R272-W396 VanDerWaalsContact CG-CH2 3.45Å; R272-W396 HydrophobicContact CG-CZ2 3.58Å; R272-W396 HydrophobicContact CG-CZ3 3.68Å; M387-W396 HydrophobicContact CG-CB 4.22Å; M387-W396 VanDerWaalsContact SD-C 3.59Å; M387-W396 HydrophobicContact SD-CB 4.17Å; M390-W396 HydrophobicContact SD-CB 4.48Å; M390-W396 HydrophobicContact SD-CG 4.08Å; P391-W396 PolarHBondContact O-NE1 2.96Å; P393-W396 PolarHBondContact O-N 2.77Å; W396-L399 HydrophobicContact CE3-CD1 4.14Å; W396-L399 HydrophobicContact CZ3-CD1 4.27Å; W396-L399 PolarHBondContact O-N 3Å; W396-F400 VanDerWaalsContact O-CB 3.29Å; W396-F400 WeakPolarHBondContact O-CB 3.45Å; W396-F400 PolarHBondContact O-N 3.11Å
397	S	96.4	Very high	94.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-46.9	176.5	-172.3	0	0	0	0	112.4	S167 W174 M387 P393 S394 L395 L399 F400 F401	S167-S397 WeakPolarHBondContact CB-OG 3.49Å; S167-S397 PolarHBondContact OG-OG 3.07Å; W174-S397 WeakPolarHBondContact CZ2-OG 3.37Å; M387-S397 VanDerWaalsContact SD-CA 3.59Å; P393-S397 WeakPolarHBondContact O-CB 3.4Å; P393-S397 PolarHBondContact O-N 2.98Å; S394-S397 PolarHBondContact O-N 2.91Å; L395-S397 VanDerWaalsContact C-N 3.3Å; L395-S397 PolarHBondContact O-N 2.99Å; S397-L399 PolarHBondContact O-N 3.47Å; S397-F400 PolarHBondContact O-N 3.19Å; S397-F401 VanDerWaalsContact O-CD2 3.26Å; S397-F401 WeakPolarHBondContact O-CD2 3.23Å; S397-F401 PolarHBondContact O-N 3.48Å; S397-F401 WeakPolarHBondContact OG-CD2 3.4Å
398	V	96.9	Very high	95	Very high	29 Å²	29	29.4 Å²	29.4	18%	0.176	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-48.1	175.2	170.3	0	0	0	0	110.6	L164 F168 S394 L395 F400 F401 I402	L164-V398 HydrophobicContact CD1-CG1 4.14Å; F168-V398 HydrophobicContact CD1-CG2 4.24Å; F168-V398 HydrophobicContact CE1-CG1 4.24Å; F168-V398 HydrophobicContact CE1-CG2 4.07Å; F168-V398 HydrophobicContact CE2-CG2 4.47Å; F168-V398 HydrophobicContact CZ-CG1 3.98Å; F168-V398 HydrophobicContact CZ-CG2 4.2Å; S394-V398 VanDerWaalsContact O-CG2 3.3Å; S394-V398 WeakPolarHBondContact O-CG2 3.38Å; S394-V398 PolarHBondContact O-N 3.36Å; L395-V398 PolarHBondContact O-N 2.92Å; V398-F400 VanDerWaalsContact C-N 3.34Å; V398-F400 PolarHBondContact O-N 3.15Å; V398-F401 PolarHBondContact O-N 3.37Å; V398-I402 WeakPolarHBondContact O-CB 3.47Å; V398-I402 WeakPolarHBondContact O-CG2 3.28Å; V398-I402 PolarHBondContact O-N 3.41Å
399	L	95.6	Very high	95.3	Very high	34 Å²	34	29 Å²	29	18%	0.178	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-39.8	179.6	-66.5	174.9	0	0	0	112.4	M265 I268 L395 W396 S397 I402 M403	M265-L399 HydrophobicContact CE-CD2 4.48Å; M265-L399 HydrophobicContact SD-CB 4.34Å; M265-L399 HydrophobicContact SD-CD2 3.65Å; I268-L399 HydrophobicContact CG2-CD1 4.18Å; L395-L399 HydrophobicContact CD1-CD1 4.1Å; L395-L399 HydrophobicContact CD1-CG 4.34Å; L395-L399 HydrophobicContact CG-CD1 4.16Å; L395-L399 VanDerWaalsContact O-CG 3.3Å; L395-L399 WeakPolarHBondContact O-CG 3.42Å; L395-L399 PolarHBondContact O-N 2.91Å; W396-L399 HydrophobicContact CE3-CD1 4.14Å; W396-L399 HydrophobicContact CZ3-CD1 4.27Å; W396-L399 PolarHBondContact O-N 3Å; S397-L399 PolarHBondContact O-N 3.47Å; L399-I402 WeakPolarHBondContact O-CG2 2.99Å; L399-M403 VanDerWaalsContact O-CB 3.29Å; L399-M403 WeakPolarHBondContact O-CB 3.48Å; L399-M403 PolarHBondContact O-N 3.4Å
400	F	95.5	Very high	95.8	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.035	15%	0.146	C	C	.	.	H	α-helix	trans	-67.7	-48.6	177.1	178.1	-100.6	0	0	0	111.8	V80 L269 Y383 M387 W396 S397 V398 M403 M404	V80-F400 HydrophobicContact CG1-CE2 4.4Å; L269-F400 HydrophobicContact CD1-CB 4.41Å; L269-F400 HydrophobicContact CD1-CD2 4.13Å; Y383-F400 HydrophobicContact CD2-CE1 4.4Å; Y383-F400 HydrophobicContact CD2-CE2 4.05Å; Y383-F400 AromaticContact CD2-CZ 3.61Å; Y383-F400 HydrophobicContact CD2-CZ 3.61Å; Y383-F400 HydrophobicContact CE2-CZ 4.41Å; Y383-F400 HydrophobicContact CG-CE2 4.37Å; Y383-F400 HydrophobicContact CG-CZ 4.16Å; M387-F400 HydrophobicContact CE-CB 4.13Å; M387-F400 HydrophobicContact CE-CD1 3.8Å; M387-F400 HydrophobicContact CE-CG 4.08Å; M387-F400 HydrophobicContact SD-CB 3.69Å; M387-F400 HydrophobicContact SD-CD1 4.43Å; M387-F400 HydrophobicContact SD-CG 4.11Å; W396-F400 VanDerWaalsContact O-CB 3.29Å; W396-F400 WeakPolarHBondContact O-CB 3.45Å; W396-F400 PolarHBondContact O-N 3.11Å; S397-F400 PolarHBondContact O-N 3.19Å; V398-F400 VanDerWaalsContact C-N 3.34Å; V398-F400 PolarHBondContact O-N 3.15Å; F400-M403 HydrophobicContact CD2-CE 3.78Å; F400-M403 HydrophobicContact CE2-CE 4Å; F400-M403 WeakPolarHBondContact O-CB 3.17Å; F400-M403 PolarHBondContact O-N 2.78Å; F400-M404 HydrophobicContact CD1-CG 4.22Å; F400-M404 HydrophobicContact CD2-CG 4.46Å; F400-M404 HydrophobicContact CE1-CG 3.82Å; F400-M404 HydrophobicContact CE2-CG 4.08Å; F400-M404 HydrophobicContact CE2-SD 4.4Å; F400-M404 HydrophobicContact CZ-CE 4.28Å; F400-M404 HydrophobicContact CZ-CG 3.74Å; F400-M404 HydrophobicContact CZ-SD 4.14Å; F400-M404 VanDerWaalsContact O-CG 3.3Å; F400-M404 WeakPolarHBondContact O-CG 3.47Å; F400-M404 PolarHBondContact O-N 3.24Å
401	F	97	Very high	96.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-76.7	-29.3	-175.5	-74.6	-64.8	0	0	0	113.6	F163 L164 W174 F380 P384 M387 S397 V398 M403 M404 L405	F163-F401 HydrophobicContact CB-CD1 3.57Å; F163-F401 HydrophobicContact CB-CD2 3.74Å; F163-F401 HydrophobicContact CB-CE1 3.44Å; F163-F401 VanDerWaalsContact CB-CE1 3.44Å; F163-F401 HydrophobicContact CB-CE2 3.61Å; F163-F401 HydrophobicContact CB-CG 3.72Å; F163-F401 HydrophobicContact CB-CZ 3.45Å; F163-F401 VanDerWaalsContact CB-CZ 3.45Å; F163-F401 HydrophobicContact CD1-CE1 4.11Å; F163-F401 AromaticContact CD1-CE2 3.67Å; F163-F401 HydrophobicContact CD1-CE2 3.67Å; F163-F401 AromaticContact CD1-CZ 3.38Å; F163-F401 HydrophobicContact CD1-CZ 3.38Å; F163-F401 HydrophobicContact CD2-CE1 4.49Å; F163-F401 HydrophobicContact CD2-CZ 4.5Å; F163-F401 HydrophobicContact CE1-CZ 4.24Å; F163-F401 HydrophobicContact CG-CD1 4.41Å; F163-F401 AromaticContact CG-CE1 3.78Å; F163-F401 HydrophobicContact CG-CE1 3.78Å; F163-F401 AromaticContact CG-CE2 3.99Å; F163-F401 HydrophobicContact CG-CE2 3.99Å; F163-F401 AromaticContact CG-CZ 3.53Å; F163-F401 HydrophobicContact CG-CZ 3.53Å; L164-F401 HydrophobicContact CB-CB 3.88Å; L164-F401 HydrophobicContact CD1-CB 4.3Å; W174-F401 HydrophobicContact CH2-CE2 4.26Å; W174-F401 HydrophobicContact CZ2-CE2 4.23Å; F380-F401 AromaticContact CD1-CE1 3.8Å; F380-F401 HydrophobicContact CD1-CE1 3.8Å; F380-F401 HydrophobicContact CD1-CZ 4.38Å; F380-F401 AromaticContact CE1-CE1 3.88Å; F380-F401 HydrophobicContact CE1-CE1 3.88Å; P384-F401 HydrophobicContact CG-CE2 4.22Å; P384-F401 HydrophobicContact CG-CZ 3.75Å; M387-F401 HydrophobicContact CE-CE2 4.14Å; S397-F401 VanDerWaalsContact O-CD2 3.26Å; S397-F401 WeakPolarHBondContact O-CD2 3.23Å; S397-F401 PolarHBondContact O-N 3.48Å; S397-F401 WeakPolarHBondContact OG-CD2 3.4Å; V398-F401 PolarHBondContact O-N 3.37Å; F401-M403 VanDerWaalsContact C-N 3.33Å; F401-M404 PolarHBondContact O-N 3.16Å; F401-L405 WeakPolarHBondContact O-CB 3.27Å; F401-L405 PolarHBondContact O-N 3.33Å
402	I	96.8	Very high	96.5	Very high	53 Å²	53	22.4 Å²	22.4	27%	0.272	12%	0.121	S	C	.	.	H	α-helix	trans	-67.4	-37.1	170.5	-162.4	174.1	0	0	0	111.1	L164 F261 M265 V398 L399 T406	L164-I402 HydrophobicContact CD1-CB 4.07Å; L164-I402 HydrophobicContact CD2-CB 4.34Å; L164-I402 HydrophobicContact CD2-CG1 4.42Å; F261-I402 HydrophobicContact CE1-CB 4.47Å; F261-I402 HydrophobicContact CE1-CD1 4.17Å; F261-I402 HydrophobicContact CE1-CG1 3.97Å; F261-I402 HydrophobicContact CE1-CG2 3.87Å; F261-I402 HydrophobicContact CZ-CD1 4.11Å; F261-I402 HydrophobicContact CZ-CG1 4.39Å; F261-I402 HydrophobicContact CZ-CG2 4.02Å; M265-I402 HydrophobicContact SD-CG2 4.45Å; V398-I402 WeakPolarHBondContact O-CB 3.47Å; V398-I402 WeakPolarHBondContact O-CG2 3.28Å; V398-I402 PolarHBondContact O-N 3.41Å; L399-I402 WeakPolarHBondContact O-CG2 2.99Å; I402-T406 VanDerWaalsContact O-CB 3.28Å; I402-T406 WeakPolarHBondContact O-CB 3.33Å; I402-T406 PolarHBondContact O-N 3.07Å; I402-T406 PolarHBondContact O-OG1 3.29Å
403	M	96	Very high	96.7	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-51.3	172.4	176.6	-167.5	73.2	0	0	111.1	V80 P262 M265 L266 L269 L399 F400 F401 L405 T406 L407	V80-M403 HydrophobicContact CG1-CE 4.23Å; P262-M403 HydrophobicContact CB-CG 4.26Å; M265-M403 HydrophobicContact CB-CB 3.65Å; M265-M403 HydrophobicContact CB-CG 3.75Å; M265-M403 HydrophobicContact CB-SD 3.87Å; M265-M403 HydrophobicContact CG-CB 3.98Å; M265-M403 HydrophobicContact CG-CG 4.48Å; L266-M403 HydrophobicContact CB-SD 4.41Å; L266-M403 HydrophobicContact CD2-CE 4.15Å; L266-M403 HydrophobicContact CD2-SD 3.58Å; L266-M403 VanDerWaalsContact CD2-SD 3.58Å; L266-M403 HydrophobicContact CG-SD 3.59Å; L266-M403 VanDerWaalsContact CG-SD 3.59Å; L269-M403 HydrophobicContact CD1-CE 3.88Å; L269-M403 HydrophobicContact CD1-SD 3.88Å; L399-M403 VanDerWaalsContact O-CB 3.29Å; L399-M403 WeakPolarHBondContact O-CB 3.48Å; L399-M403 PolarHBondContact O-N 3.4Å; F400-M403 HydrophobicContact CD2-CE 3.78Å; F400-M403 HydrophobicContact CE2-CE 4Å; F400-M403 WeakPolarHBondContact O-CB 3.17Å; F400-M403 PolarHBondContact O-N 2.78Å; F401-M403 VanDerWaalsContact C-N 3.33Å; M403-L405 PolarHBondContact O-N 3.21Å; M403-T406 PolarHBondContact O-N 3.5Å; M403-T406 VanDerWaalsContact O-N 3.17Å; M403-L407 HydrophobicContact CG-CD1 4.12Å; M403-L407 WeakPolarHBondContact O-CG 3.3Å; M403-L407 PolarHBondContact O-N 2.96Å
404	M	96.3	Very high	96.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.5	-45.2	179.4	-71	-68.2	-82.9	0	0	111.5	L77 V80 C160 A379 F400 F401 T406 L407 G408	L77-M404 HydrophobicContact CD2-CB 4.04Å; L77-M404 HydrophobicContact CD2-CE 3.58Å; L77-M404 WeakPolarHBondContact CD2-O 3.4Å; L77-M404 HydrophobicContact CD2-SD 3.85Å; V80-M404 HydrophobicContact CB-SD 3.92Å; V80-M404 HydrophobicContact CG1-SD 3.72Å; V80-M404 HydrophobicContact CG2-SD 4.32Å; C160-M404 HydrophobicContact CB-CB 4.38Å; A379-M404 HydrophobicContact CB-CE 3.81Å; F400-M404 HydrophobicContact CD1-CG 4.22Å; F400-M404 HydrophobicContact CD2-CG 4.46Å; F400-M404 HydrophobicContact CE1-CG 3.82Å; F400-M404 HydrophobicContact CE2-CG 4.08Å; F400-M404 HydrophobicContact CE2-SD 4.4Å; F400-M404 HydrophobicContact CZ-CE 4.28Å; F400-M404 HydrophobicContact CZ-CG 3.74Å; F400-M404 HydrophobicContact CZ-SD 4.14Å; F400-M404 VanDerWaalsContact O-CG 3.3Å; F400-M404 WeakPolarHBondContact O-CG 3.47Å; F400-M404 PolarHBondContact O-N 3.24Å; F401-M404 PolarHBondContact O-N 3.16Å; M404-T406 VanDerWaalsContact C-N 3.3Å; M404-T406 PolarHBondContact O-N 2.74Å; M404-L407 PolarHBondContact O-N 2.96Å; M404-G408 PolarHBondContact O-N 2.75Å
405	L	97.8	Very high	96.9	Very high	17 Å²	17	14.3 Å²	14.3	9%	0.089	7%	0.074	C	C	.	.	H	α-helix	trans	-58	-44	174.7	179.3	62.5	0	0	0	111.5	V157 C160 L161 L164 F401 M403 G408 L409	V157-L405 HydrophobicContact CG1-CD1 3.68Å; C160-L405 HydrophobicContact CB-CB 4.15Å; C160-L405 HydrophobicContact CB-CD1 4.45Å; L161-L405 HydrophobicContact CB-CD1 4.06Å; L161-L405 HydrophobicContact CD1-CD2 3.9Å; L164-L405 HydrophobicContact CD2-CD2 3.63Å; F401-L405 WeakPolarHBondContact O-CB 3.27Å; F401-L405 PolarHBondContact O-N 3.33Å; M403-L405 PolarHBondContact O-N 3.21Å; L405-G408 PolarHBondContact O-N 2.93Å; L405-L409 HydrophobicContact CD1-CD1 3.94Å; L405-L409 HydrophobicContact CD1-CG 4.14Å; L405-L409 HydrophobicContact CG-CD1 3.92Å; L405-L409 HydrophobicContact CG-CG 4.48Å; L405-L409 WeakPolarHBondContact O-CB 3.32Å; L405-L409 VanDerWaalsContact O-CG 3.25Å; L405-L409 WeakPolarHBondContact O-CG 3.24Å; L405-L409 PolarHBondContact O-N 2.73Å
406	T	97.7	Very high	97	Very high	7 Å²	7	10.4 Å²	10.4	4%	0.043	5%	0.054	C	C	.	.	H	α-helix	trans	-66.1	-44.1	-179.9	-59.6	0	0	0	0	112.2	F257 T258 F261 P262 I402 M403 M404 G410	F257-T406 HydrophobicContact CD1-CG2 4.12Å; F257-T406 HydrophobicContact CE1-CG2 3.84Å; T258-T406 HydrophobicContact CG2-CG2 4Å; F261-T406 HydrophobicContact CB-CG2 4.47Å; F261-T406 HydrophobicContact CD1-CG2 4.11Å; P262-T406 HydrophobicContact CG-CG2 3.83Å; I402-T406 VanDerWaalsContact O-CB 3.28Å; I402-T406 WeakPolarHBondContact O-CB 3.33Å; I402-T406 PolarHBondContact O-N 3.07Å; I402-T406 PolarHBondContact O-OG1 3.29Å; M403-T406 PolarHBondContact O-N 3.5Å; M403-T406 VanDerWaalsContact O-N 3.17Å; M404-T406 VanDerWaalsContact C-N 3.3Å; M404-T406 PolarHBondContact O-N 2.74Å; T406-G410 PolarHBondContact O-N 3.3Å
407	L	97.1	Very high	97.1	Very high	4 Å²	4	8.9 Å²	8.9	2%	0.021	5%	0.048	C	C	.	.	H	α-helix	trans	-60.9	-47.9	174.8	-76.6	172.2	0	0	0	111.5	V75 V80 P262 M403 M404 G410 S411	V75-L407 HydrophobicContact CG1-CD2 3.78Å; V75-L407 WeakPolarHBondContact O-CD2 3.17Å; V80-L407 HydrophobicContact CG2-CD1 3.5Å; V80-L407 VanDerWaalsContact CG2-CD1 3.5Å; P262-L407 HydrophobicContact CB-CD1 4.24Å; P262-L407 HydrophobicContact CB-CD2 3.44Å; P262-L407 VanDerWaalsContact CB-CD2 3.44Å; P262-L407 HydrophobicContact CB-CG 3.66Å; P262-L407 HydrophobicContact CG-CD2 3.58Å; P262-L407 HydrophobicContact CG-CG 3.76Å; M403-L407 HydrophobicContact CG-CD1 4.12Å; M403-L407 WeakPolarHBondContact O-CG 3.3Å; M403-L407 PolarHBondContact O-N 2.96Å; M404-L407 PolarHBondContact O-N 2.96Å; L407-G410 PolarHBondContact O-N 3.13Å; L407-S411 PolarHBondContact O-N 3.23Å; L407-S411 PolarHBondContact O-OG 3.48Å
408	G	97.3	Very high	97.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-59.4	-50.5	177.5	0	0	0	0	0	112	Y153 M404 L405 G410 S411 Q412	Y153-G408 VanDerWaalsContact CE1-O 3.32Å; Y153-G408 WeakPolarHBondContact CE1-O 3.29Å; M404-G408 PolarHBondContact O-N 2.75Å; L405-G408 PolarHBondContact O-N 2.93Å; G408-G410 VanDerWaalsContact C-N 3.32Å; G408-G410 PolarHBondContact O-N 3.15Å; G408-S411 PolarHBondContact O-N 2.87Å; G408-Q412 WeakPolarHBondContact O-CB 3.42Å; G408-Q412 PolarHBondContact O-N 3.19Å
409	L	98.3	Very high	97.2	Very high	15 Å²	15	7.6 Å²	7.6	8%	0.079	4%	0.04	C	C	.	.	H	α-helix	trans	-60.6	-40.8	177.5	-73.8	173.1	0	0	0	112.5	V157 I239 L405 S411 Q412 F413	V157-L409 HydrophobicContact CG1-CD2 3.84Å; V157-L409 HydrophobicContact CG1-CG 3.91Å; I239-L409 HydrophobicContact CG2-CD1 4Å; I239-L409 HydrophobicContact CG2-CD2 4.19Å; L405-L409 HydrophobicContact CD1-CD1 3.94Å; L405-L409 HydrophobicContact CD1-CG 4.14Å; L405-L409 HydrophobicContact CG-CD1 3.92Å; L405-L409 HydrophobicContact CG-CG 4.48Å; L405-L409 WeakPolarHBondContact O-CB 3.32Å; L405-L409 VanDerWaalsContact O-CG 3.25Å; L405-L409 WeakPolarHBondContact O-CG 3.24Å; L405-L409 PolarHBondContact O-N 2.73Å; L409-S411 PolarHBondContact O-N 2.85Å; L409-Q412 PolarHBondContact O-N 3.36Å; L409-F413 HydrophobicContact CB-CE1 4.06Å; L409-F413 HydrophobicContact CB-CE2 4.09Å; L409-F413 HydrophobicContact CB-CZ 3.65Å; L409-F413 HydrophobicContact CD2-CE1 3.93Å; L409-F413 HydrophobicContact CD2-CZ 4.17Å; L409-F413 HydrophobicContact CG-CZ 4.33Å; L409-F413 VanDerWaalsContact O-CD1 3.31Å; L409-F413 WeakPolarHBondContact O-CD1 3.28Å; L409-F413 WeakPolarHBondContact O-CD2 3.23Å; L409-F413 WeakPolarHBondContact O-CG 3.47Å; L409-F413 PolarHBondContact O-N 2.96Å
410	G	97.5	Very high	97.2	Very high	2 Å²	2	6 Å²	6	2%	0.021	3%	0.032	C	C	.	.	H	α-helix	trans	-55.8	-49.5	177.5	0	0	0	0	0	112.9	G72 T406 L407 G408	G72-G410 CarbonylContact O-C 3.49Å; T406-G410 PolarHBondContact O-N 3.3Å; L407-G410 PolarHBondContact O-N 3.13Å; G408-G410 VanDerWaalsContact C-N 3.32Å; G408-G410 PolarHBondContact O-N 3.15Å
411	S	97.1	Very high	97	Very high	6 Å²	6	5.7 Å²	5.7	4%	0.042	3%	0.031	C	C	.	.	H	α-helix	trans	-67.5	-44.2	177.1	-50.9	0	0	0	0	111.2	G72 Y73 G76 L407 G408 L409 F413 S414 I415	G72-S411 VanDerWaalsContact O-CA 3.27Å; G72-S411 WeakPolarHBondContact O-CA 3.18Å; G72-S411 PolarHBondContact O-N 3.34Å; G72-S411 PolarHBondContact O-OG 2.83Å; G72-S411 VanDerWaalsContact O-OG 3.07Å; Y73-S411 PolarHBondContact O-OG 3.29Å; G76-S411 VanDerWaalsContact CA-OG 3.26Å; G76-S411 WeakPolarHBondContact CA-OG 3.33Å; L407-S411 PolarHBondContact O-N 3.23Å; L407-S411 PolarHBondContact O-OG 3.48Å; G408-S411 PolarHBondContact O-N 2.87Å; L409-S411 PolarHBondContact O-N 2.85Å; S411-F413 VanDerWaalsContact C-N 3.32Å; S411-F413 PolarHBondContact O-N 3.37Å; S411-S414 PolarHBondContact O-N 3.04Å; S411-I415 WeakPolarHBondContact O-CD1 3.26Å; S411-I415 VanDerWaalsContact O-CG1 3.29Å; S411-I415 WeakPolarHBondContact O-CG1 3.06Å; S411-I415 PolarHBondContact O-N 3.36Å; S411-I415 VanDerWaalsContact O-N 3.15Å
412	Q	97.8	Very high	96.8	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-58.6	-39.8	-176.7	-175.7	64.2	1.9	0	0	113.2	V150 Y153 G408 L409 S414 I415 L416	V150-Q412 PolarHBondContact O-NE2 3.46Å; Y153-Q412 HydrophobicContact CD1-CB 4.23Å; Y153-Q412 HydrophobicContact CE1-CB 4.39Å; G408-Q412 WeakPolarHBondContact O-CB 3.42Å; G408-Q412 PolarHBondContact O-N 3.19Å; L409-Q412 PolarHBondContact O-N 3.36Å; Q412-S414 VanDerWaalsContact C-N 3.31Å; Q412-S414 PolarHBondContact O-N 3.26Å; Q412-I415 PolarHBondContact O-N 3.05Å; Q412-L416 VanDerWaalsContact O-CB 3.29Å; Q412-L416 WeakPolarHBondContact O-CB 3.17Å; Q412-L416 PolarHBondContact O-N 2.77Å
413	F	98.1	Very high	96.5	Very high	3 Å²	3	4.6 Å²	4.6	1%	0.013	3%	0.027	C	C	.	.	H	α-helix	trans	-61.7	-39.9	179.3	-57	-31.4	0	0	0	112.7	I239 C240 A243 V244 L251 V254 T258 L409 S411 E417	I239-F413 HydrophobicContact CG2-CE1 4.26Å; I239-F413 HydrophobicContact CG2-CZ 4.04Å; C240-F413 HydrophobicContact CB-CD1 4.24Å; C240-F413 HydrophobicContact CB-CE1 4.2Å; A243-F413 HydrophobicContact CB-CD1 3.73Å; A243-F413 HydrophobicContact CB-CD2 4.02Å; A243-F413 HydrophobicContact CB-CE1 3.58Å; A243-F413 HydrophobicContact CB-CE2 3.87Å; A243-F413 HydrophobicContact CB-CG 3.95Å; A243-F413 HydrophobicContact CB-CZ 3.63Å; V244-F413 HydrophobicContact CG1-CB 4.17Å; L251-F413 HydrophobicContact CD1-CB 3.41Å; L251-F413 VanDerWaalsContact CD1-CB 3.41Å; L251-F413 HydrophobicContact CD1-CD2 4.06Å; L251-F413 HydrophobicContact CD1-CG 4.15Å; V254-F413 HydrophobicContact CG1-CD2 4.24Å; V254-F413 HydrophobicContact CG1-CE2 3.53Å; V254-F413 HydrophobicContact CG1-CZ 4.28Å; T258-F413 HydrophobicContact CG2-CE2 4.01Å; L409-F413 HydrophobicContact CB-CE1 4.06Å; L409-F413 HydrophobicContact CB-CE2 4.09Å; L409-F413 HydrophobicContact CB-CZ 3.65Å; L409-F413 HydrophobicContact CD2-CE1 3.93Å; L409-F413 HydrophobicContact CD2-CZ 4.17Å; L409-F413 HydrophobicContact CG-CZ 4.33Å; L409-F413 VanDerWaalsContact O-CD1 3.31Å; L409-F413 WeakPolarHBondContact O-CD1 3.28Å; L409-F413 WeakPolarHBondContact O-CD2 3.23Å; L409-F413 WeakPolarHBondContact O-CG 3.47Å; L409-F413 PolarHBondContact O-N 2.96Å; S411-F413 VanDerWaalsContact C-N 3.32Å; S411-F413 PolarHBondContact O-N 3.37Å; F413-E417 WeakPolarHBondContact O-CB 3.38Å; F413-E417 PolarHBondContact O-N 3.13Å
414	S	97.5	Very high	96.3	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-72.9	-38.9	-179.9	-67.7	0	0	0	0	112.3	T69 M321 S411 Q412 L416 E417 T418	T69-S414 WeakPolarHBondContact CG2-OG 3.42Å; M321-S414 WeakPolarHBondContact CE-O 3.35Å; S411-S414 PolarHBondContact O-N 3.04Å; Q412-S414 VanDerWaalsContact C-N 3.31Å; Q412-S414 PolarHBondContact O-N 3.26Å; S414-L416 VanDerWaalsContact C-N 3.34Å; S414-E417 PolarHBondContact O-N 2.98Å; S414-T418 PolarHBondContact O-N 2.88Å; S414-T418 PolarHBondContact O-OG1 3.49Å
415	I	97.4	Very high	95.7	Very high	6 Å²	6	5.8 Å²	5.8	3%	0.031	3%	0.033	C	C	.	.	H	α-helix	trans	-65.4	-41	175.1	-53.3	158.5	0	0	0	109.8	Y73 L149 V150 S411 Q412 T418 T419	Y73-I415 HydrophobicContact CD2-CG1 4.28Å; Y73-I415 HydrophobicContact CE2-CG1 3.71Å; L149-I415 HydrophobicContact CB-CG2 4.21Å; L149-I415 HydrophobicContact CD1-CD1 4.3Å; L149-I415 HydrophobicContact CD2-CD1 3.98Å; L149-I415 HydrophobicContact CD2-CG1 4.19Å; L149-I415 HydrophobicContact CD2-CG2 3.84Å; L149-I415 HydrophobicContact CG-CD1 3.94Å; L149-I415 HydrophobicContact CG-CG1 4.47Å; L149-I415 HydrophobicContact CG-CG2 3.76Å; V150-I415 HydrophobicContact CB-CG2 4.37Å; V150-I415 HydrophobicContact CG2-CB 3.93Å; V150-I415 HydrophobicContact CG2-CG2 3.33Å; S411-I415 WeakPolarHBondContact O-CD1 3.26Å; S411-I415 VanDerWaalsContact O-CG1 3.29Å; S411-I415 WeakPolarHBondContact O-CG1 3.06Å; S411-I415 PolarHBondContact O-N 3.36Å; S411-I415 VanDerWaalsContact O-N 3.15Å; Q412-I415 PolarHBondContact O-N 3.05Å; I415-T418 WeakPolarHBondContact O-CB 3.31Å; I415-T418 PolarHBondContact O-N 3.11Å; I415-T419 PolarHBondContact O-N 3.36Å; I415-T419 PolarHBondContact O-OG1 2.92Å
416	L	98.2	Very high	95	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-64.7	-46.2	175.4	178.5	60.3	0	0	0	112.2	V150 W237 C240 V244 Q412 S414 T418 T419 L420	V150-L416 HydrophobicContact CG1-CD1 4.19Å; V150-L416 HydrophobicContact CG2-CB 4.34Å; W237-L416 HydrophobicContact CH2-CD1 4.44Å; W237-L416 HydrophobicContact CZ3-CD1 4.06Å; W237-L416 HydrophobicContact CZ3-CD2 3.98Å; C240-L416 HydrophobicContact CB-CD2 3.94Å; V244-L416 HydrophobicContact CG1-CD2 4.27Å; V244-L416 HydrophobicContact CG2-CD2 3.75Å; V244-L416 HydrophobicContact CG2-CG 4.26Å; Q412-L416 VanDerWaalsContact O-CB 3.29Å; Q412-L416 WeakPolarHBondContact O-CB 3.17Å; Q412-L416 PolarHBondContact O-N 2.77Å; S414-L416 VanDerWaalsContact C-N 3.34Å; L416-T418 PolarHBondContact O-N 2.85Å; L416-T419 PolarHBondContact O-N 3.04Å; L416-T419 VanDerWaalsContact O-N 3.13Å; L416-L420 HydrophobicContact CD1-CD1 4.01Å; L416-L420 HydrophobicContact CD1-CG 4.09Å; L416-L420 HydrophobicContact CD2-CD1 4.44Å; L416-L420 HydrophobicContact CG-CD1 3.78Å; L416-L420 HydrophobicContact CG-CG 4.31Å; L416-L420 WeakPolarHBondContact O-CG 3.38Å; L416-L420 PolarHBondContact O-N 3.06Å
417	E	97.5	Very high	94.5	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-59.9	-32.9	176.2	177.7	58.6	-156.9	0	0	112.2	V248 L251 T320 M321 Y324 F413 S414 S421 R443	V248-E417 HydrophobicContact CG1-CG 4.42Å; L251-E417 HydrophobicContact CD2-CB 4.11Å; L251-E417 HydrophobicContact CD2-CG 4.31Å; T320-E417 HydrophobicContact CG2-CG 4.35Å; M321-E417 HydrophobicContact CE-CB 4.09Å; M321-E417 HydrophobicContact CE-CG 4.1Å; Y324-E417 HydrophobicContact CE2-CG 4.48Å; Y324-E417 PolarHBondContact OH-OE1 2.91Å; F413-E417 WeakPolarHBondContact O-CB 3.38Å; F413-E417 PolarHBondContact O-N 3.13Å; S414-E417 PolarHBondContact O-N 2.98Å; E417-S421 WeakPolarHBondContact O-CB 3.23Å; E417-S421 PolarHBondContact O-N 3.29Å; E417-S421 PolarHBondContact O-OG 3.42Å; E417-R443 IonicContact OE1-NH2 2.7Å; E417-R443 PolarHBondContact OE1-NH2 3.08Å; E417-R443 IonicContact OE2-CZ 2.73Å; E417-R443 IonicContact OE2-NH1 3.77Å; E417-R443 PolarHBondContact OE2-NH1 3.07Å; E417-R443 IonicContact OE2-NH2 2.74Å; E417-R443 PolarHBondContact OE2-NH2 3.22Å
418	T	97.2	Very high	93.8	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.2	-46.5	174.5	-59	0	0	0	0	111.5	P125 G317 T320 S414 I415 L416 S421 G422	P125-T418 HydrophobicContact CG-CG2 4.22Å; G317-T418 VanDerWaalsContact CA-OG1 3.27Å; G317-T418 WeakPolarHBondContact CA-OG1 3.38Å; T320-T418 WeakPolarHBondContact OG1-CG2 3.43Å; S414-T418 PolarHBondContact O-N 2.88Å; S414-T418 PolarHBondContact O-OG1 3.49Å; I415-T418 WeakPolarHBondContact O-CB 3.31Å; I415-T418 PolarHBondContact O-N 3.11Å; L416-T418 PolarHBondContact O-N 2.85Å; T418-S421 PolarHBondContact O-OG 3.05Å; T418-G422 PolarHBondContact O-N 3.41Å
419	T	96.8	Very high	92.7	Very high	2 Å²	2	17 Å²	17	1%	0.012	8%	0.077	C	C	.	.	H	α-helix	trans	-67.5	-44.1	178.4	-51.9	0	0	0	0	111.3	V143 W147 I415 L416 T423	V143-T419 HydrophobicContact CG1-CG2 4.39Å; W147-T419 HydrophobicContact CB-CG2 3.92Å; W147-T419 HydrophobicContact CD2-CG2 4.05Å; W147-T419 HydrophobicContact CE3-CG2 4.49Å; W147-T419 HydrophobicContact CG-CG2 3.8Å; I415-T419 PolarHBondContact O-N 3.36Å; I415-T419 PolarHBondContact O-OG1 2.92Å; L416-T419 PolarHBondContact O-N 3.04Å; L416-T419 VanDerWaalsContact O-N 3.13Å; T419-T423 WeakPolarHBondContact O-CG2 3.1Å; T419-T423 PolarHBondContact O-N 3.46Å; T419-T423 VanDerWaalsContact O-N 3.12Å; T419-T423 PolarHBondContact O-OG1 2.99Å
420	L	96	Very high	91.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-49.2	178.6	-70.2	170.7	0	0	0	112.2	V244 L416 T423 E424 Y442 R443 I446	V244-L420 HydrophobicContact CB-CD1 4.42Å; V244-L420 HydrophobicContact CG2-CD1 3.64Å; L416-L420 HydrophobicContact CD1-CD1 4.01Å; L416-L420 HydrophobicContact CD1-CG 4.09Å; L416-L420 HydrophobicContact CD2-CD1 4.44Å; L416-L420 HydrophobicContact CG-CD1 3.78Å; L416-L420 HydrophobicContact CG-CG 4.31Å; L416-L420 WeakPolarHBondContact O-CG 3.38Å; L416-L420 PolarHBondContact O-N 3.06Å; L420-T423 PolarHBondContact O-N 3Å; L420-T423 PolarHBondContact O-OG1 3.39Å; L420-E424 WeakPolarHBondContact O-CB 3.5Å; L420-E424 WeakPolarHBondContact O-CG 3.21Å; L420-E424 PolarHBondContact O-N 2.98Å; L420-Y442 HydrophobicContact CD2-CE1 4.13Å; L420-R443 HydrophobicContact CD1-CB 4.33Å; L420-R443 HydrophobicContact CD1-CG 4.01Å; L420-R443 HydrophobicContact CD2-CB 4.41Å; L420-R443 HydrophobicContact CD2-CG 4.06Å; L420-I446 HydrophobicContact CD2-CB 3.7Å; L420-I446 HydrophobicContact CD2-CG1 3.93Å; L420-I446 HydrophobicContact CD2-CG2 3.68Å
421	S	92.7	Very high	90.7	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-67.7	-38.5	-179	61.9	0	0	0	0	112.2	T320 Y324 E417 T418 T423 E424 D425	T320-S421 VanDerWaalsContact CG2-OG 3.31Å; T320-S421 WeakPolarHBondContact CG2-OG 3.34Å; Y324-S421 WeakPolarHBondContact OH-CB 3.11Å; E417-S421 WeakPolarHBondContact O-CB 3.23Å; E417-S421 PolarHBondContact O-N 3.29Å; E417-S421 PolarHBondContact O-OG 3.42Å; T418-S421 PolarHBondContact O-OG 3.05Å; S421-T423 VanDerWaalsContact C-N 3.34Å; S421-T423 PolarHBondContact O-N 3.39Å; S421-E424 PolarHBondContact O-N 3.31Å; S421-D425 WeakPolarHBondContact O-CB 3.31Å; S421-D425 PolarHBondContact O-N 3.35Å
422	G	91.9	Very high	90	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-43.3	174.7	0	0	0	0	0	112.4	T418 E426	T418-G422 PolarHBondContact O-N 3.41Å; G422-E426 PolarHBondContact O-N 3.32Å
423	T	91.5	Very high	88.9	Confident	30 Å²	30	32.7 Å²	32.7	18%	0.184	18%	0.179	C	C	.	.	H	α-helix	trans	-73.3	-39.6	177.6	52.6	0	0	0	0	112.8	T419 L420 S421 D425 E426 L427 Y442	T419-T423 WeakPolarHBondContact O-CG2 3.1Å; T419-T423 PolarHBondContact O-N 3.46Å; T419-T423 VanDerWaalsContact O-N 3.12Å; T419-T423 PolarHBondContact O-OG1 2.99Å; L420-T423 PolarHBondContact O-N 3Å; L420-T423 PolarHBondContact O-OG1 3.39Å; S421-T423 VanDerWaalsContact C-N 3.34Å; S421-T423 PolarHBondContact O-N 3.39Å; T423-D425 VanDerWaalsContact C-N 3.31Å; T423-D425 PolarHBondContact O-N 2.56Å; T423-E426 PolarHBondContact O-N 3.3Å; T423-L427 WeakPolarHBondContact O-CG 3.49Å; T423-L427 PolarHBondContact O-N 3.32Å; T423-Y442 WeakPolarHBondContact CB-OH 3.32Å; T423-Y442 PolarHBondContact OG1-OH 3.01Å
424	E	90.5	Very high	88	Confident	16 Å²	16	34.9 Å²	34.9	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-39.7	174.5	-77	173.4	-176.3	0	0	112.5	L420 S421 L427 R428 L434 K439 Y442 R443	L420-E424 WeakPolarHBondContact O-CB 3.5Å; L420-E424 WeakPolarHBondContact O-CG 3.21Å; L420-E424 PolarHBondContact O-N 2.98Å; S421-E424 PolarHBondContact O-N 3.31Å; E424-L427 PolarHBondContact O-N 2.87Å; E424-R428 WeakPolarHBondContact O-CB 3.29Å; E424-R428 PolarHBondContact O-N 3.43Å; E424-L434 HydrophobicContact CG-CD1 4.11Å; E424-K439 WeakPolarHBondContact OE1-CE 3.06Å; E424-K439 WeakPolarHBondContact OE1-CG 3.47Å; E424-K439 IonicContact OE1-NZ 3.75Å; E424-K439 WeakPolarHBondContact OE2-CE 3.36Å; E424-K439 IonicContact OE2-NZ 2.71Å; E424-K439 PolarHBondContact OE2-NZ 3.25Å; E424-Y442 HydrophobicContact CG-CD1 4.09Å; E424-Y442 HydrophobicContact CG-CE1 3.86Å; E424-R443 VanDerWaalsContact CD-NH2 3.32Å; E424-R443 IonicContact OE1-CZ 3.28Å; E424-R443 IonicContact OE1-NE 3.93Å; E424-R443 PolarHBondContact OE1-NE 3.15Å; E424-R443 IonicContact OE1-NH2 3.09Å; E424-R443 PolarHBondContact OE1-NH2 3.09Å; E424-R443 IonicContact OE2-CZ 3.11Å; E424-R443 IonicContact OE2-NH2 2.77Å; E424-R443 PolarHBondContact OE2-NH2 3.14Å
425	D	83.6	Confident	87.4	Confident	11 Å²	11	38.4 Å²	38.4	6%	0.059	21%	0.212	C	C	.	.	H	α-helix	trans	-61.8	-42.3	176.6	-89.1	-3.5	0	0	0	112.2	G124 S127 S421 T423 R428 R429	G124-D425 WeakPolarHBondContact CA-OD2 3.35Å; G124-D425 PolarHBondContact N-OD2 2.67Å; S127-D425 PolarHBondContact OG-OD2 3.33Å; S421-D425 WeakPolarHBondContact O-CB 3.31Å; S421-D425 PolarHBondContact O-N 3.35Å; T423-D425 VanDerWaalsContact C-N 3.31Å; T423-D425 PolarHBondContact O-N 2.56Å; D425-R428 PolarHBondContact O-N 3.28Å; D425-R428 IonicContact OD1-CZ 3.93Å; D425-R428 IonicContact OD1-NH2 3.86Å; D425-R428 PolarHBondContact OD1-NH2 3Å; D425-R429 WeakPolarHBondContact O-CB 3.48Å; D425-R429 PolarHBondContact O-N 3.04Å
426	E	84.2	Confident	86.9	Confident	21 Å²	21	43.5 Å²	43.5	10%	0.098	24%	0.243	C	C	.	.	H	α-helix	trans	-72.6	-35.5	177.3	-74.7	-63	124	0	0	112.6	I126 K136 Y140 G422 T423 R428 R429 L430	I126-E426 HydrophobicContact CB-CG 4.4Å; I126-E426 HydrophobicContact CD1-CG 4.08Å; I126-E426 HydrophobicContact CG2-CG 3.75Å; I126-E426 VanDerWaalsContact CG2-OE1 3.27Å; I126-E426 WeakPolarHBondContact CG2-OE1 3.39Å; K136-E426 WeakPolarHBondContact CE-OE1 3.23Å; K136-E426 IonicContact NZ-OE1 2.65Å; K136-E426 PolarHBondContact NZ-OE1 2.92Å; K136-E426 IonicContact NZ-OE2 2.66Å; Y140-E426 HydrophobicContact CE1-CG 4.1Å; Y140-E426 VanDerWaalsContact OH-CD 3.24Å; Y140-E426 PolarHBondContact OH-OE2 3.29Å; G422-E426 PolarHBondContact O-N 3.32Å; T423-E426 PolarHBondContact O-N 3.3Å; E426-R428 VanDerWaalsContact C-N 3.33Å; E426-R428 PolarHBondContact O-N 3.12Å; E426-R429 WeakPolarHBondContact O-CB 3.39Å; E426-R429 PolarHBondContact O-N 3.18Å; E426-R429 WeakPolarHBondContact OE1-CD 3.48Å; E426-R429 IonicContact OE1-NH1 2.72Å; E426-R429 IonicContact OE2-CZ 2.64Å; E426-R429 IonicContact OE2-NH1 2.66Å; E426-R429 PolarHBondContact OE2-NH1 3.31Å; E426-L430 WeakPolarHBondContact O-CG 3.16Å; E426-L430 PolarHBondContact O-N 3.18Å
427	L	86.1	Confident	86.5	Confident	45 Å²	45	53.4 Å²	53.4	24%	0.236	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-46.5	171.8	-73.8	175	0	0	0	111.2	T423 E424 R429 L430 G431 V432 L434 Y442	T423-L427 WeakPolarHBondContact O-CG 3.49Å; T423-L427 PolarHBondContact O-N 3.32Å; E424-L427 PolarHBondContact O-N 2.87Å; L427-R429 VanDerWaalsContact C-N 3.3Å; L427-R429 PolarHBondContact O-N 3.41Å; L427-L430 PolarHBondContact O-N 3.21Å; L427-L430 VanDerWaalsContact O-N 3.15Å; L427-G431 PolarHBondContact O-N 2.77Å; L427-V432 HydrophobicContact CB-CB 4.26Å; L427-V432 WeakPolarHBondContact O-CB 3.26Å; L427-V432 PolarHBondContact O-N 3.32Å; L427-L434 HydrophobicContact CD1-CD1 4.03Å; L427-Y442 HydrophobicContact CD1-CD2 4.35Å; L427-Y442 HydrophobicContact CD1-CE2 3.85Å
428	R	82.6	Confident	86.2	Confident	93 Å²	93	61 Å²	61	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-40.4	175.4	178	169.3	52.8	142.8	-1.7	111.6	Q55 E424 D425 E426 L430 G431	Q55-R428 PolarHBondContact O-NH1 3.39Å; E424-R428 WeakPolarHBondContact O-CB 3.29Å; E424-R428 PolarHBondContact O-N 3.43Å; D425-R428 PolarHBondContact O-N 3.28Å; D425-R428 IonicContact OD1-CZ 3.93Å; D425-R428 IonicContact OD1-NH2 3.86Å; D425-R428 PolarHBondContact OD1-NH2 3Å; E426-R428 VanDerWaalsContact C-N 3.33Å; E426-R428 PolarHBondContact O-N 3.12Å; R428-L430 VanDerWaalsContact C-N 3.31Å; R428-L430 PolarHBondContact O-N 2.77Å; R428-G431 PolarHBondContact O-N 3.04Å
429	R	73.8	Confident	85.9	Confident	103 Å²	103	64 Å²	64	39%	0.389	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-33.9	175.7	-177.1	179.9	171.1	-129.7	-6.8	113.2	D425 E426 L427 G431	D425-R429 WeakPolarHBondContact O-CB 3.48Å; D425-R429 PolarHBondContact O-N 3.04Å; E426-R429 WeakPolarHBondContact O-CB 3.39Å; E426-R429 PolarHBondContact O-N 3.18Å; E426-R429 WeakPolarHBondContact OE1-CD 3.48Å; E426-R429 IonicContact OE1-NH1 2.72Å; E426-R429 IonicContact OE2-CZ 2.64Å; E426-R429 IonicContact OE2-NH1 2.66Å; E426-R429 PolarHBondContact OE2-NH1 3.31Å; L427-R429 VanDerWaalsContact C-N 3.3Å; L427-R429 PolarHBondContact O-N 3.41Å; R429-G431 PolarHBondContact O-N 3.11Å
430	L	77.6	Confident	85.8	Confident	135 Å²	135	66.5 Å²	66.5	71%	0.707	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	2	173.6	-68.4	172.7	0	0	0	113.4	E426 L427 R428	E426-L430 WeakPolarHBondContact O-CG 3.16Å; E426-L430 PolarHBondContact O-N 3.18Å; L427-L430 PolarHBondContact O-N 3.21Å; L427-L430 VanDerWaalsContact O-N 3.15Å; R428-L430 VanDerWaalsContact C-N 3.31Å; R428-L430 PolarHBondContact O-N 2.77Å
431	G	77	Confident	85.8	Confident	59 Å²	59	73 Å²	73	61%	0.608	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	4.2	-179.9	0	0	0	0	0	114.3	L427 R428 R429 V433	L427-G431 PolarHBondContact O-N 2.77Å; R428-G431 PolarHBondContact O-N 3.04Å; R429-G431 PolarHBondContact O-N 3.11Å; G431-V433 PolarHBondContact O-N 3.35Å
432	V	81.7	Confident	85.9	Confident	70 Å²	70	74.9 Å²	74.9	42%	0.424	37%	0.37	S	S	.	.			trans	-82.3	101.4	177.1	-176.9	0	0	0	0	109.4	L427 L434	L427-V432 HydrophobicContact CB-CB 4.26Å; L427-V432 WeakPolarHBondContact O-CB 3.26Å; L427-V432 PolarHBondContact O-N 3.32Å; V432-L434 HydrophobicContact CG1-CD2 4.43Å; V432-L434 PolarHBondContact O-N 3.39Å
433	V	76.1	Confident	86.2	Confident	90 Å²	90	75 Å²	75	55%	0.545	37%	0.37	S	S	.	.			trans	-84.1	112.4	175.3	-176.2	0	0	0	0	110.1	G431 T435	G431-V433 PolarHBondContact O-N 3.35Å; V433-T435 PolarHBondContact O-N 3.37Å
434	L	77.5	Confident	86.5	Confident	48 Å²	48	77.2 Å²	77.2	25%	0.251	38%	0.38	S	S	.	.			trans	-86.7	107	175.6	-66.7	169.8	0	0	0	110	E424 L427 V432 R438 K439	E424-L434 HydrophobicContact CG-CD1 4.11Å; L427-L434 HydrophobicContact CD1-CD1 4.03Å; V432-L434 HydrophobicContact CG1-CD2 4.43Å; V432-L434 PolarHBondContact O-N 3.39Å; L434-R438 HydrophobicContact CD2-CB 4.04Å; L434-K439 HydrophobicContact CB-CB 4.26Å
435	T	86.1	Confident	86.8	Confident	75 Å²	75	79.9 Å²	79.9	46%	0.46	39%	0.394	S	S	.	.			trans	-57.4	157.5	164.5	63.9	0	0	0	0	110.4	V433 R437 R438 K439	V433-T435 PolarHBondContact O-N 3.37Å; T435-R437 PolarHBondContact O-N 3.47Å; T435-R437 VanDerWaalsContact O-N 3.11Å; T435-R438 PolarHBondContact O-N 3.43Å; T435-R438 WeakPolarHBondContact OG1-CG 3.42Å; T435-R438 PolarHBondContact OG1-N 3.49Å; T435-K439 PolarHBondContact O-N 3.19Å
436	T	86.3	Confident	87.5	Confident	112 Å²	112	80.3 Å²	80.3	69%	0.687	40%	0.397	S	S	*	.	H	α-helix	trans	-51	-41.3	-180	-48.6	0	0	0	0	113	K439 M440	T436-K439 PolarHBondContact O-N 3.28Å; T436-M440 WeakPolarHBondContact O-CG 3.42Å; T436-M440 PolarHBondContact O-N 2.98Å; T436-M440 VanDerWaalsContact O-N 3.08Å
437	R	90.1	Very high	88.2	Confident	208 Å²	208	79.5 Å²	79.5	79%	0.785	39%	0.393	S	S	*	.	H	α-helix	trans	-67.7	-43.3	176.7	-69.4	-174.9	-179	169.7	0.8	112.7	T435 K439 M440 F441	T435-R437 PolarHBondContact O-N 3.47Å; T435-R437 VanDerWaalsContact O-N 3.11Å; R437-K439 VanDerWaalsContact C-N 3.33Å; R437-M440 HydrophobicContact CB-CE 4.44Å; R437-M440 HydrophobicContact CG-CE 4.13Å; R437-M440 PolarHBondContact O-N 3.26Å; R437-F441 PolarHBondContact O-N 3.09Å
438	R	91.3	Very high	88.8	Confident	160 Å²	160	82.7 Å²	82.7	60%	0.604	41%	0.405	S	S	*	.	H	α-helix	trans	-65.2	-37.2	176.5	-72.3	-177.8	-178.2	178.7	-1.5	111.7	L434 T435 F441 Y442	L434-R438 HydrophobicContact CD2-CB 4.04Å; T435-R438 PolarHBondContact O-N 3.43Å; T435-R438 WeakPolarHBondContact OG1-CG 3.42Å; T435-R438 PolarHBondContact OG1-N 3.49Å; R438-F441 PolarHBondContact O-N 2.99Å; R438-Y442 VanDerWaalsContact O-CB 3.29Å; R438-Y442 WeakPolarHBondContact O-CB 3.4Å; R438-Y442 PolarHBondContact O-N 3.5Å
439	K	91.7	Very high	89.5	Confident	64 Å²	64	80.9 Å²	80.9	28%	0.278	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-47.4	173.7	-178.9	170.6	171.4	149.2	0	111.6	E424 L434 T435 T436 R437 F441 Y442 R443	E424-K439 WeakPolarHBondContact OE1-CE 3.06Å; E424-K439 WeakPolarHBondContact OE1-CG 3.47Å; E424-K439 IonicContact OE1-NZ 3.75Å; E424-K439 WeakPolarHBondContact OE2-CE 3.36Å; E424-K439 IonicContact OE2-NZ 2.71Å; E424-K439 PolarHBondContact OE2-NZ 3.25Å; L434-K439 HydrophobicContact CB-CB 4.26Å; T435-K439 PolarHBondContact O-N 3.19Å; T436-K439 PolarHBondContact O-N 3.28Å; R437-K439 VanDerWaalsContact C-N 3.33Å; K439-F441 PolarHBondContact O-N 3.38Å; K439-Y442 PolarHBondContact O-N 3.36Å; K439-R443 VanDerWaalsContact CE-NE 3.3Å; K439-R443 VanDerWaalsContact O-CG 3.26Å; K439-R443 WeakPolarHBondContact O-CG 3.39Å; K439-R443 PolarHBondContact O-N 3.08Å; K439-R443 VanDerWaalsContact O-N 3.09Å
440	M	94.6	Very high	90.7	Very high	54 Å²	54	76 Å²	76	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-59.8	-45	175.7	-69.1	-174	-64.9	0	0	111.9	I245 T436 R437 R443 I444	I245-M440 HydrophobicContact CG1-CB 4.1Å; I245-M440 HydrophobicContact CG1-CG 4.01Å; I245-M440 HydrophobicContact CG1-SD 4.34Å; I245-M440 WeakPolarHBondContact O-CG 3.04Å; T436-M440 WeakPolarHBondContact O-CG 3.42Å; T436-M440 PolarHBondContact O-N 2.98Å; T436-M440 VanDerWaalsContact O-N 3.08Å; R437-M440 HydrophobicContact CB-CE 4.44Å; R437-M440 HydrophobicContact CG-CE 4.13Å; R437-M440 PolarHBondContact O-N 3.26Å; M440-R443 PolarHBondContact O-N 2.98Å; M440-I444 WeakPolarHBondContact O-CG1 3.32Å; M440-I444 PolarHBondContact O-N 2.75Å
441	F	95.3	Very high	91.7	Very high	136 Å²	136	70.6 Å²	70.6	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-65.7	-42	179.1	-172	-113.4	0	0	0	112.6	R437 R438 K439 R443 I444 I445	R437-F441 PolarHBondContact O-N 3.09Å; R438-F441 PolarHBondContact O-N 2.99Å; K439-F441 PolarHBondContact O-N 3.38Å; F441-R443 VanDerWaalsContact C-N 3.32Å; F441-R443 PolarHBondContact O-N 2.66Å; F441-I444 PolarHBondContact O-N 3.34Å; F441-I445 HydrophobicContact CD1-CD1 3.5Å; F441-I445 VanDerWaalsContact CD1-CD1 3.5Å; F441-I445 HydrophobicContact CD1-CG1 4.37Å; F441-I445 HydrophobicContact CE1-CD1 3.24Å; F441-I445 HydrophobicContact CE1-CG1 4.12Å; F441-I445 HydrophobicContact CG-CD1 4.28Å; F441-I445 HydrophobicContact CZ-CD1 3.8Å; F441-I445 HydrophobicContact CZ-CG1 4.23Å; F441-I445 WeakPolarHBondContact O-CG1 3.36Å; F441-I445 PolarHBondContact O-N 3.49Å
442	Y	95.3	Very high	92.7	Very high	43 Å²	43	71.7 Å²	71.7	17%	0.169	35%	0.348	C	S	.	.	H	α-helix	trans	-54.8	-47.7	174	171.9	-102.7	0	0	0	111.6	L420 T423 E424 L427 R438 K439 I444 I445 I446	L420-Y442 HydrophobicContact CD2-CE1 4.13Å; T423-Y442 WeakPolarHBondContact CB-OH 3.32Å; T423-Y442 PolarHBondContact OG1-OH 3.01Å; E424-Y442 HydrophobicContact CG-CD1 4.09Å; E424-Y442 HydrophobicContact CG-CE1 3.86Å; L427-Y442 HydrophobicContact CD1-CD2 4.35Å; L427-Y442 HydrophobicContact CD1-CE2 3.85Å; R438-Y442 VanDerWaalsContact O-CB 3.29Å; R438-Y442 WeakPolarHBondContact O-CB 3.4Å; R438-Y442 PolarHBondContact O-N 3.5Å; K439-Y442 PolarHBondContact O-N 3.36Å; Y442-I444 PolarHBondContact O-N 2.95Å; Y442-I445 WeakPolarHBondContact O-CB 3.38Å; Y442-I445 PolarHBondContact O-N 3.47Å; Y442-I446 HydrophobicContact CD1-CG1 4.44Å; Y442-I446 HydrophobicContact CD2-CG1 4.37Å; Y442-I446 HydrophobicContact CE1-CG1 3.97Å; Y442-I446 HydrophobicContact CE2-CD1 3.98Å; Y442-I446 HydrophobicContact CE2-CG1 3.89Å; Y442-I446 WeakPolarHBondContact O-CG1 3.33Å; Y442-I446 PolarHBondContact O-N 3.46Å
443	R	97	Very high	93.5	Very high	1 Å²	1	72.7 Å²	72.7	0%	0.004	35%	0.351	C	S	.	.	H	α-helix	trans	-62	-41.7	179.6	-68.3	171.2	167.5	-100.5	-8.1	112.6	V244 E417 L420 E424 K439 M440 F441 I446 C447	V244-R443 PolarHBondContact O-NH1 3.11Å; E417-R443 IonicContact OE1-NH2 2.7Å; E417-R443 PolarHBondContact OE1-NH2 3.08Å; E417-R443 IonicContact OE2-CZ 2.73Å; E417-R443 IonicContact OE2-NH1 3.77Å; E417-R443 PolarHBondContact OE2-NH1 3.07Å; E417-R443 IonicContact OE2-NH2 2.74Å; E417-R443 PolarHBondContact OE2-NH2 3.22Å; L420-R443 HydrophobicContact CD1-CB 4.33Å; L420-R443 HydrophobicContact CD1-CG 4.01Å; L420-R443 HydrophobicContact CD2-CB 4.41Å; L420-R443 HydrophobicContact CD2-CG 4.06Å; E424-R443 VanDerWaalsContact CD-NH2 3.32Å; E424-R443 IonicContact OE1-CZ 3.28Å; E424-R443 IonicContact OE1-NE 3.93Å; E424-R443 PolarHBondContact OE1-NE 3.15Å; E424-R443 IonicContact OE1-NH2 3.09Å; E424-R443 PolarHBondContact OE1-NH2 3.09Å; E424-R443 IonicContact OE2-CZ 3.11Å; E424-R443 IonicContact OE2-NH2 2.77Å; E424-R443 PolarHBondContact OE2-NH2 3.14Å; K439-R443 VanDerWaalsContact CE-NE 3.3Å; K439-R443 VanDerWaalsContact O-CG 3.26Å; K439-R443 WeakPolarHBondContact O-CG 3.39Å; K439-R443 PolarHBondContact O-N 3.08Å; K439-R443 VanDerWaalsContact O-N 3.09Å; M440-R443 PolarHBondContact O-N 2.98Å; F441-R443 VanDerWaalsContact C-N 3.32Å; F441-R443 PolarHBondContact O-N 2.66Å; R443-I446 PolarHBondContact O-N 3.16Å; R443-C447 PolarHBondContact O-N 2.93Å; R443-C447 PolarHBondContact O-SG 3.14Å
444	I	97.9	Very high	94.6	Very high	77 Å²	77	68.4 Å²	68.4	40%	0.395	33%	0.325	S	S	.	.	H	α-helix	trans	-63	-42.8	175.3	-66.4	166.8	0	0	0	110.7	I245 M440 F441 Y442 C447 F448	I245-I444 HydrophobicContact CD1-CD1 4.18Å; M440-I444 WeakPolarHBondContact O-CG1 3.32Å; M440-I444 PolarHBondContact O-N 2.75Å; F441-I444 PolarHBondContact O-N 3.34Å; Y442-I444 PolarHBondContact O-N 2.95Å; I444-C447 PolarHBondContact O-N 2.87Å; I444-F448 PolarHBondContact O-N 2.91Å
445	I	97.4	Very high	95.5	Very high	72 Å²	72	67.8 Å²	67.8	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-47.3	176.5	-70.5	164.9	0	0	0	110.9	F441 Y442 C447 F448 V449	F441-I445 HydrophobicContact CD1-CD1 3.5Å; F441-I445 VanDerWaalsContact CD1-CD1 3.5Å; F441-I445 HydrophobicContact CD1-CG1 4.37Å; F441-I445 HydrophobicContact CE1-CD1 3.24Å; F441-I445 HydrophobicContact CE1-CG1 4.12Å; F441-I445 HydrophobicContact CG-CD1 4.28Å; F441-I445 HydrophobicContact CZ-CD1 3.8Å; F441-I445 HydrophobicContact CZ-CG1 4.23Å; F441-I445 WeakPolarHBondContact O-CG1 3.36Å; F441-I445 PolarHBondContact O-N 3.49Å; Y442-I445 WeakPolarHBondContact O-CB 3.38Å; Y442-I445 PolarHBondContact O-N 3.47Å; I445-C447 VanDerWaalsContact C-N 3.35Å; I445-C447 PolarHBondContact O-N 3.48Å; I445-F448 CarbonylContact O-C 3.58Å; I445-F448 WeakPolarHBondContact O-CB 3.38Å; I445-F448 PolarHBondContact O-N 3.5Å; I445-F448 VanDerWaalsContact O-N 3.11Å; I445-V449 HydrophobicContact CG2-CG2 4.22Å; I445-V449 WeakPolarHBondContact O-CG2 3.38Å; I445-V449 PolarHBondContact O-N 2.92Å
446	I	97.5	Very high	96.1	Very high	21 Å²	21	66.4 Å²	66.4	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-60.9	-44.7	179.4	-64.8	-61.1	0	0	0	110.8	L420 Y442 R443 F448 V449 D450	L420-I446 HydrophobicContact CD2-CB 3.7Å; L420-I446 HydrophobicContact CD2-CG1 3.93Å; L420-I446 HydrophobicContact CD2-CG2 3.68Å; Y442-I446 HydrophobicContact CD1-CG1 4.44Å; Y442-I446 HydrophobicContact CD2-CG1 4.37Å; Y442-I446 HydrophobicContact CE1-CG1 3.97Å; Y442-I446 HydrophobicContact CE2-CD1 3.98Å; Y442-I446 HydrophobicContact CE2-CG1 3.89Å; Y442-I446 WeakPolarHBondContact O-CG1 3.33Å; Y442-I446 PolarHBondContact O-N 3.46Å; R443-I446 PolarHBondContact O-N 3.16Å; I446-F448 VanDerWaalsContact C-N 3.26Å; I446-F448 PolarHBondContact O-N 3.24Å; I446-V449 PolarHBondContact O-N 3.43Å; I446-V449 VanDerWaalsContact O-N 3.15Å; I446-D450 WeakPolarHBondContact O-CB 3.25Å; I446-D450 PolarHBondContact O-N 3.45Å
447	C	98.6	Very high	96.6	Very high	4 Å²	4	61.7 Å²	61.7	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-38.6	174.6	-64	0	0	0	0	112.3	W237 A241 R443 I444 I445 D450 F451	W237-C447 HydrophobicContact CE3-CB 3.74Å; W237-C447 HydrophobicContact CZ3-CB 4.13Å; A241-C447 HydrophobicContact CB-CB 4.05Å; R443-C447 PolarHBondContact O-N 2.93Å; R443-C447 PolarHBondContact O-SG 3.14Å; I444-C447 PolarHBondContact O-N 2.87Å; I445-C447 VanDerWaalsContact C-N 3.35Å; I445-C447 PolarHBondContact O-N 3.48Å; C447-D450 PolarHBondContact O-N 2.83Å; C447-F451 WeakPolarHBondContact O-CB 3.44Å; C447-F451 PolarHBondContact O-N 3.39Å
448	F	98.5	Very high	97	Very high	111 Å²	111	51.9 Å²	51.9	49%	0.487	25%	0.248	S	C	.	.	H	α-helix	trans	-70.2	-38.7	176.9	-177	-106.8	0	0	0	112.5	I444 I445 I446 D450 F451 L452	I444-F448 PolarHBondContact O-N 2.91Å; I445-F448 CarbonylContact O-C 3.58Å; I445-F448 WeakPolarHBondContact O-CB 3.38Å; I445-F448 PolarHBondContact O-N 3.5Å; I445-F448 VanDerWaalsContact O-N 3.11Å; I446-F448 VanDerWaalsContact C-N 3.26Å; I446-F448 PolarHBondContact O-N 3.24Å; F448-D450 VanDerWaalsContact C-N 3.34Å; F448-F451 HydrophobicContact CD2-CD1 4.14Å; F448-F451 HydrophobicContact CE2-CD1 4.07Å; F448-F451 HydrophobicContact CE2-CE1 4.38Å; F448-F451 WeakPolarHBondContact O-CB 3.37Å; F448-F451 PolarHBondContact O-N 3.23Å; F448-L452 HydrophobicContact CD1-CD1 4.27Å; F448-L452 HydrophobicContact CE1-CD1 3.8Å; F448-L452 HydrophobicContact CE1-CG 4.35Å; F448-L452 HydrophobicContact CZ-CD1 4.23Å; F448-L452 HydrophobicContact CZ-CD2 4.39Å; F448-L452 HydrophobicContact CZ-CG 4.42Å; F448-L452 WeakPolarHBondContact O-CG 3.34Å; F448-L452 PolarHBondContact O-N 2.97Å; F448-L452 VanDerWaalsContact O-N 3.12Å
449	V	98.5	Very high	97.3	Very high	55 Å²	55	44.6 Å²	44.6	33%	0.333	22%	0.221	S	C	.	.	H	α-helix	trans	-62.1	-44.7	172.6	169.9	0	0	0	0	110.3	I445 I446 F451 L452 L453	I445-V449 HydrophobicContact CG2-CG2 4.22Å; I445-V449 WeakPolarHBondContact O-CG2 3.38Å; I445-V449 PolarHBondContact O-N 2.92Å; I446-V449 PolarHBondContact O-N 3.43Å; I446-V449 VanDerWaalsContact O-N 3.15Å; V449-F451 VanDerWaalsContact C-N 3.33Å; V449-F451 PolarHBondContact O-N 3.33Å; V449-L452 WeakPolarHBondContact O-CB 3.34Å; V449-L452 PolarHBondContact O-N 2.87Å; V449-L452 VanDerWaalsContact O-N 3.09Å; V449-L453 HydrophobicContact CG1-CD1 4.1Å; V449-L453 HydrophobicContact CG1-CG 4.38Å; V449-L453 WeakPolarHBondContact O-CG 3.39Å; V449-L453 PolarHBondContact O-N 3.33Å
450	D	98.5	Very high	97.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.6	-32.5	179.9	-64.4	-21.4	0	0	0	112.5	W147 V151 W237 I446 C447 F448 L453 G454	W147-D450 PolarHBondContact NE1-OD1 3.28Å; V151-D450 HydrophobicContact CG2-CB 4.25Å; W237-D450 HydrophobicContact CH2-CB 3.16Å; W237-D450 HydrophobicContact CZ2-CB 3.22Å; W237-D450 HydrophobicContact CZ3-CB 3.88Å; I446-D450 WeakPolarHBondContact O-CB 3.25Å; I446-D450 PolarHBondContact O-N 3.45Å; C447-D450 PolarHBondContact O-N 2.83Å; F448-D450 VanDerWaalsContact C-N 3.34Å; D450-L453 PolarHBondContact O-N 3.28Å; D450-G454 PolarHBondContact O-N 2.99Å
451	F	98.7	Very high	97.6	Very high	22 Å²	22	40 Å²	40	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-56.4	-49.9	166.3	162.9	-105.8	0	0	0	111.4	L233 L234 W237 C447 F448 V449 L453 G454 L455	L233-F451 HydrophobicContact CD2-CD2 4.2Å; L233-F451 HydrophobicContact CD2-CE2 4.43Å; L233-F451 HydrophobicContact CG-CD2 4.01Å; L233-F451 HydrophobicContact CG-CE2 4.38Å; L234-F451 HydrophobicContact CB-CD2 4.12Å; L234-F451 HydrophobicContact CB-CE2 3.66Å; L234-F451 HydrophobicContact CB-CZ 4.18Å; L234-F451 HydrophobicContact CD1-CD1 4.3Å; L234-F451 HydrophobicContact CD1-CD2 4.16Å; L234-F451 HydrophobicContact CD1-CE1 4.24Å; L234-F451 HydrophobicContact CD1-CE2 4.12Å; L234-F451 HydrophobicContact CD1-CG 4.26Å; L234-F451 HydrophobicContact CD1-CZ 4.15Å; L234-F451 HydrophobicContact CG-CE2 4.44Å; W237-F451 HydrophobicContact CB-CB 4.37Å; W237-F451 AromaticContact CD1-CD2 3.99Å; W237-F451 HydrophobicContact CG-CB 3.9Å; C447-F451 WeakPolarHBondContact O-CB 3.44Å; C447-F451 PolarHBondContact O-N 3.39Å; F448-F451 HydrophobicContact CD2-CD1 4.14Å; F448-F451 HydrophobicContact CE2-CD1 4.07Å; F448-F451 HydrophobicContact CE2-CE1 4.38Å; F448-F451 WeakPolarHBondContact O-CB 3.37Å; F448-F451 PolarHBondContact O-N 3.23Å; V449-F451 VanDerWaalsContact C-N 3.33Å; V449-F451 PolarHBondContact O-N 3.33Å; F451-L453 PolarHBondContact O-N 3.29Å; F451-G454 PolarHBondContact O-N 2.68Å; F451-G454 VanDerWaalsContact O-N 3.14Å; F451-L455 HydrophobicContact CE1-CD1 4.19Å; F451-L455 HydrophobicContact CE2-CD2 3.82Å; F451-L455 HydrophobicContact CE2-CG 4.34Å; F451-L455 HydrophobicContact CZ-CD1 4.17Å; F451-L455 HydrophobicContact CZ-CD2 3.8Å; F451-L455 HydrophobicContact CZ-CG 4.19Å; F451-L455 PolarHBondContact O-N 2.84Å
452	L	98.5	Very high	97.6	Very high	82 Å²	82	33.5 Å²	33.5	43%	0.429	18%	0.175	S	C	.	.	H	α-helix	trans	-64.4	-38.4	178.5	-64	176.7	0	0	0	112.3	F448 V449 G454 L455 P456	F448-L452 HydrophobicContact CD1-CD1 4.27Å; F448-L452 HydrophobicContact CE1-CD1 3.8Å; F448-L452 HydrophobicContact CE1-CG 4.35Å; F448-L452 HydrophobicContact CZ-CD1 4.23Å; F448-L452 HydrophobicContact CZ-CD2 4.39Å; F448-L452 HydrophobicContact CZ-CG 4.42Å; F448-L452 WeakPolarHBondContact O-CG 3.34Å; F448-L452 PolarHBondContact O-N 2.97Å; F448-L452 VanDerWaalsContact O-N 3.12Å; V449-L452 WeakPolarHBondContact O-CB 3.34Å; V449-L452 PolarHBondContact O-N 2.87Å; V449-L452 VanDerWaalsContact O-N 3.09Å; L452-G454 VanDerWaalsContact C-N 3.25Å; L452-G454 PolarHBondContact O-N 2.89Å; L452-L455 HydrophobicContact CD2-CD1 3.91Å; L452-L455 PolarHBondContact O-N 3.45Å; L452-P456 WeakPolarHBondContact O-CD 3.2Å
453	L	98	Very high	97.5	Very high	91 Å²	91	32.8 Å²	32.8	48%	0.476	17%	0.173	S	C	.	.	H	α-helix	trans	-66.7	-26.2	174.8	-68.8	175.3	0	0	0	112.8	V151 V449 D450 F451 P456	V151-L453 HydrophobicContact CG1-CB 3.88Å; V151-L453 HydrophobicContact CG2-CB 4.21Å; V151-L453 HydrophobicContact CG2-CD1 4.39Å; V449-L453 HydrophobicContact CG1-CD1 4.1Å; V449-L453 HydrophobicContact CG1-CG 4.38Å; V449-L453 WeakPolarHBondContact O-CG 3.39Å; V449-L453 PolarHBondContact O-N 3.33Å; D450-L453 PolarHBondContact O-N 3.28Å; F451-L453 PolarHBondContact O-N 3.29Å; L453-P456 WeakPolarHBondContact O-CD 3.39Å
454	G	98.4	Very high	97.5	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-81	-23.8	176.1	0	0	0	0	0	114.4	I155 D450 F451 L452 P456 M457	I155-G454 WeakPolarHBondContact CD1-O 3.38Å; D450-G454 PolarHBondContact O-N 2.99Å; F451-G454 PolarHBondContact O-N 2.68Å; F451-G454 VanDerWaalsContact O-N 3.14Å; L452-G454 VanDerWaalsContact C-N 3.25Å; L452-G454 PolarHBondContact O-N 2.89Å; G454-P456 VanDerWaalsContact C-CD 3.45Å; G454-M457 PolarHBondContact O-N 3.39Å
455	L	98.2	Very high	97.4	Very high	34 Å²	34	31.2 Å²	31.2	18%	0.178	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-54.3	-40.5	-177.7	-73.8	177.9	0	0	0	114.7	L233 F451 L452 M457 V458	L233-L455 HydrophobicContact CD2-CD2 4.43Å; F451-L455 HydrophobicContact CE1-CD1 4.19Å; F451-L455 HydrophobicContact CE2-CD2 3.82Å; F451-L455 HydrophobicContact CE2-CG 4.34Å; F451-L455 HydrophobicContact CZ-CD1 4.17Å; F451-L455 HydrophobicContact CZ-CD2 3.8Å; F451-L455 HydrophobicContact CZ-CG 4.19Å; F451-L455 PolarHBondContact O-N 2.84Å; L452-L455 HydrophobicContact CD2-CD1 3.91Å; L452-L455 PolarHBondContact O-N 3.45Å; L455-M457 PolarHBondContact O-N 3.45Å; L455-V458 HydrophobicContact CD2-CG2 4.22Å; L455-V458 WeakPolarHBondContact O-CG2 3.4Å; L455-V458 PolarHBondContact O-N 2.88Å; L455-V458 VanDerWaalsContact O-N 3.1Å
456	P	97.8	Very high	97.3	Very high	46 Å²	46	29.2 Å²	29.2	30%	0.299	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-58.5	-30.2	176.1	-26	35.9	0	0	0	113.7	F222 L452 L453 G454 V458 C459 G462 L465	F222-P456 HydrophobicContact CE1-CB 3.95Å; F222-P456 WeakPolarHBondContact CE1-O 3.46Å; F222-P456 HydrophobicContact CZ-CB 3.63Å; F222-P456 WeakPolarHBondContact CZ-O 3.26Å; L452-P456 WeakPolarHBondContact O-CD 3.2Å; L453-P456 WeakPolarHBondContact O-CD 3.39Å; G454-P456 VanDerWaalsContact C-CD 3.45Å; P456-V458 VanDerWaalsContact C-N 3.32Å; P456-V458 PolarHBondContact O-N 3.26Å; P456-C459 PolarHBondContact O-N 2.82Å; P456-G462 VanDerWaalsContact O-CA 3.24Å; P456-G462 WeakPolarHBondContact O-CA 3.41Å; P456-L465 HydrophobicContact CB-CD2 3.83Å
457	M	97.4	Very high	97.1	Very high	13 Å²	13	28.7 Å²	28.7	6%	0.064	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-81.4	-6.3	179.6	-71.3	-178	-73.1	0	0	113.9	V151 I155 G454 L455 L465 F466	V151-M457 HydrophobicContact CB-CE 4.46Å; V151-M457 HydrophobicContact CG1-CE 3.6Å; I155-M457 HydrophobicContact CD1-CB 3.89Å; I155-M457 HydrophobicContact CD1-CE 4.19Å; I155-M457 HydrophobicContact CG1-CB 3.82Å; I155-M457 HydrophobicContact CG1-CE 3.82Å; I155-M457 HydrophobicContact CG1-SD 4.18Å; I155-M457 HydrophobicContact CG2-CB 4.46Å; G454-M457 PolarHBondContact O-N 3.39Å; L455-M457 PolarHBondContact O-N 3.45Å; M457-L465 HydrophobicContact CG-CB 4.25Å; M457-L465 HydrophobicContact CG-CD2 3.88Å; M457-L465 HydrophobicContact CG-CG 3.87Å; M457-F466 HydrophobicContact CG-CB 4.34Å; M457-F466 HydrophobicContact SD-CB 4.19Å; M457-F466 HydrophobicContact SD-CD2 4.5Å
458	V	97.5	Very high	96.9	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.018	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-102.6	9.4	171.6	-55.5	0	0	0	0	113.1	I155 P225 S226 L229 L233 L455 P456	I155-V458 HydrophobicContact CD1-CG1 4.04Å; I155-V458 HydrophobicContact CG2-CG1 4.47Å; P225-V458 HydrophobicContact CB-CG2 4.19Å; S226-V458 WeakPolarHBondContact CB-O 3.49Å; S226-V458 PolarHBondContact N-O 2.84Å; L229-V458 HydrophobicContact CB-CB 3.94Å; L229-V458 HydrophobicContact CB-CG1 4.11Å; L229-V458 HydrophobicContact CD1-CB 4.43Å; L233-V458 HydrophobicContact CD2-CG1 4.05Å; L455-V458 HydrophobicContact CD2-CG2 4.22Å; L455-V458 WeakPolarHBondContact O-CG2 3.4Å; L455-V458 PolarHBondContact O-N 2.88Å; L455-V458 VanDerWaalsContact O-N 3.1Å; P456-V458 VanDerWaalsContact C-N 3.32Å; P456-V458 PolarHBondContact O-N 3.26Å
459	C	97.8	Very high	96.8	Very high	6 Å²	6	23.9 Å²	23.9	4%	0.041	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-80.6	166.5	168.4	-58	0	0	0	0	111.4	F222 T224 P225 P456 G461 G462	F222-C459 HydrophobicContact CD1-CB 3.91Å; F222-C459 HydrophobicContact CE1-CB 3.76Å; F222-C459 VanDerWaalsContact CE1-SG 3.58Å; F222-C459 HydrophobicContact CZ-CB 4.48Å; F222-C459 WeakPolarHBondContact O-CB 3.37Å; T224-C459 VanDerWaalsContact C-SG 3.58Å; P225-C459 VanDerWaalsContact CA-SG 3.58Å; P456-C459 PolarHBondContact O-N 2.82Å; C459-G461 VanDerWaalsContact C-N 3.33Å; C459-G461 PolarHBondContact O-N 3.17Å; C459-G462 WeakPolarHBondContact O-CA 3.2Å; C459-G462 PolarHBondContact O-N 2.96Å
460	A	96.3	Very high	96.4	Very high	22 Å²	22	23.6 Å²	23.6	18%	0.182	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-38.7	178	0	0	0	0	0	114.1	K214 S216 F222	K214-A460 VanDerWaalsContact O-CA 3.31Å; K214-A460 WeakPolarHBondContact O-CA 3.27Å; K214-A460 WeakPolarHBondContact O-CB 3.36Å; S216-A460 PolarHBondContact N-O 3.31Å; S216-A460 PolarHBondContact OG-O 3.15Å; S216-A460 VanDerWaalsContact OG-O 3.08Å; F222-A460 PolarHBondContact O-N 3.39Å
461	G	95.8	Very high	96.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-4.2	171.2	0	0	0	0	0	114.1	S216 L219 F222 C459 Y463 Y464	S216-G461 WeakPolarHBondContact OG-CA 3.33Å; S216-G461 PolarHBondContact OG-N 3.42Å; L219-G461 WeakPolarHBondContact CD1-O 3.45Å; F222-G461 PolarHBondContact O-N 2.98Å; C459-G461 VanDerWaalsContact C-N 3.33Å; C459-G461 PolarHBondContact O-N 3.17Å; G461-Y463 VanDerWaalsContact C-N 3.27Å; G461-Y463 PolarHBondContact O-N 3.22Å; G461-Y464 PolarHBondContact O-N 2.85Å
462	G	96.1	Very high	95.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-26.4	-176.4	0	0	0	0	0	114	P456 C459 Y464 L465 F466	P456-G462 VanDerWaalsContact O-CA 3.24Å; P456-G462 WeakPolarHBondContact O-CA 3.41Å; C459-G462 WeakPolarHBondContact O-CA 3.2Å; C459-G462 PolarHBondContact O-N 2.96Å; G462-Y464 VanDerWaalsContact C-N 3.28Å; G462-Y464 PolarHBondContact O-N 3.18Å; G462-L465 WeakPolarHBondContact O-CB 3.42Å; G462-L465 PolarHBondContact O-N 3.08Å; G462-L465 VanDerWaalsContact O-N 3.15Å; G462-F466 WeakPolarHBondContact O-CB 3.42Å; G462-F466 PolarHBondContact O-N 3.47Å
463	Y	93.6	Very high	95.3	Very high	28 Å²	28	20.3 Å²	20.3	11%	0.11	11%	0.113	C	C	.	.	H	α-helix	trans	-56.9	-39.9	174.3	177.2	-93.1	0	0	0	112.5	F209 I213 L215 G461 F466 S467 E542	F209-Y463 HydrophobicContact CE1-CE2 4.2Å; I213-Y463 HydrophobicContact CD1-CD2 4.02Å; L215-Y463 HydrophobicContact CD1-CD1 3.76Å; L215-Y463 HydrophobicContact CD1-CG 3.78Å; G461-Y463 VanDerWaalsContact C-N 3.27Å; G461-Y463 PolarHBondContact O-N 3.22Å; Y463-F466 WeakPolarHBondContact O-CB 3.25Å; Y463-F466 PolarHBondContact O-N 3.25Å; Y463-S467 PolarHBondContact O-N 2.98Å; Y463-E542 HydrophobicContact CE1-CG 4.32Å; Y463-E542 PolarHBondContact OH-OE2 3.32Å
464	Y	95.5	Very high	94.8	Very high	15 Å²	15	17 Å²	17	6%	0.059	10%	0.097	C	C	.	.	H	α-helix	trans	-70.6	-36.3	177.9	-59.1	-70.4	0	0	0	112	L215 S216 S217 L219 G461 G462 S467 I468 E542 Y545 Y547	L215-Y464 HydrophobicContact CD1-CE2 3.92Å; S216-Y464 PolarHBondContact O-OH 3.25Å; S217-Y464 PolarHBondContact O-OH 3.43Å; L219-Y464 HydrophobicContact CB-CD2 4.48Å; G461-Y464 PolarHBondContact O-N 2.85Å; G462-Y464 VanDerWaalsContact C-N 3.28Å; G462-Y464 PolarHBondContact O-N 3.18Å; Y464-S467 PolarHBondContact O-N 3.06Å; Y464-I468 WeakPolarHBondContact O-CG1 3.3Å; Y464-I468 PolarHBondContact O-N 3.32Å; Y464-E542 HydrophobicContact CD1-CB 4.34Å; Y464-E542 HydrophobicContact CD1-CG 4.37Å; Y464-E542 HydrophobicContact CE1-CB 4.14Å; Y464-Y545 AromaticContact CD1-CD1 3.51Å; Y464-Y545 HydrophobicContact CD1-CD1 3.51Å; Y464-Y545 AromaticContact CD1-CE1 3.54Å; Y464-Y545 HydrophobicContact CD1-CE1 3.54Å; Y464-Y545 HydrophobicContact CD1-CG 4.33Å; Y464-Y545 AromaticContact CE1-CD1 3.32Å; Y464-Y545 HydrophobicContact CE1-CD1 3.32Å; Y464-Y545 HydrophobicContact CE1-CD2 4.46Å; Y464-Y545 AromaticContact CE1-CE1 3.76Å; Y464-Y545 HydrophobicContact CE1-CE1 3.76Å; Y464-Y545 AromaticContact CE1-CG 3.7Å; Y464-Y545 HydrophobicContact CE1-CG 3.7Å; Y464-Y545 HydrophobicContact CG-CD1 4.42Å; Y464-Y545 HydrophobicContact CG-CE1 4.04Å; Y464-Y547 HydrophobicContact CD1-CE1 4.41Å; Y464-Y547 PolarHBondContact O-OH 2.94Å
465	L	96.2	Very high	94.3	Very high	30 Å²	30	17.6 Å²	17.6	16%	0.157	10%	0.104	C	C	.	.	H	α-helix	trans	-66.3	-40.7	172.6	179	60.9	0	0	0	111.4	L219 F222 P456 M457 G462 S467 I468 C469 F554	L219-L465 HydrophobicContact CD1-CB 4.24Å; F222-L465 HydrophobicContact CE2-CD2 4.38Å; F222-L465 HydrophobicContact CZ-CD2 4.18Å; P456-L465 HydrophobicContact CB-CD2 3.83Å; M457-L465 HydrophobicContact CG-CB 4.25Å; M457-L465 HydrophobicContact CG-CD2 3.88Å; M457-L465 HydrophobicContact CG-CG 3.87Å; G462-L465 WeakPolarHBondContact O-CB 3.42Å; G462-L465 PolarHBondContact O-N 3.08Å; G462-L465 VanDerWaalsContact O-N 3.15Å; L465-S467 VanDerWaalsContact C-N 3.35Å; L465-S467 PolarHBondContact O-N 2.97Å; L465-I468 WeakPolarHBondContact O-CB 3.37Å; L465-I468 PolarHBondContact O-N 2.78Å; L465-C469 PolarHBondContact O-N 2.8Å; L465-C469 PolarHBondContact O-SG 3.32Å; L465-F554 HydrophobicContact CD1-CE1 3.74Å
466	F	95.1	Very high	94.1	Very high	29 Å²	29	17.5 Å²	17.5	13%	0.127	10%	0.101	C	C	.	.	H	α-helix	trans	-57.4	-46.6	172.9	169.4	-86.6	0	0	0	111.5	Y152 I155 V156 M457 G462 Y463 I468 C469 D470	Y152-F466 HydrophobicContact CD2-CD2 4.1Å; Y152-F466 AromaticContact CD2-CE2 3.58Å; Y152-F466 HydrophobicContact CD2-CE2 3.58Å; Y152-F466 HydrophobicContact CD2-CZ 4.07Å; Y152-F466 HydrophobicContact CE2-CE2 4.24Å; Y152-F466 HydrophobicContact CE2-CZ 4.32Å; I155-F466 HydrophobicContact CB-CD2 4.06Å; I155-F466 HydrophobicContact CB-CE2 4.26Å; I155-F466 HydrophobicContact CG1-CD2 4.49Å; I155-F466 HydrophobicContact CG2-CD2 4.11Å; V156-F466 HydrophobicContact CG2-CE2 3.47Å; V156-F466 VanDerWaalsContact CG2-CE2 3.47Å; V156-F466 HydrophobicContact CG2-CZ 3.45Å; V156-F466 VanDerWaalsContact CG2-CZ 3.45Å; M457-F466 HydrophobicContact CG-CB 4.34Å; M457-F466 HydrophobicContact SD-CB 4.19Å; M457-F466 HydrophobicContact SD-CD2 4.5Å; G462-F466 WeakPolarHBondContact O-CB 3.42Å; G462-F466 PolarHBondContact O-N 3.47Å; Y463-F466 WeakPolarHBondContact O-CB 3.25Å; Y463-F466 PolarHBondContact O-N 3.25Å; F466-I468 VanDerWaalsContact C-N 3.35Å; F466-I468 PolarHBondContact O-N 3.48Å; F466-C469 PolarHBondContact O-N 3.3Å; F466-D470 PolarHBondContact O-N 3.08Å
467	S	93.4	Very high	93.9	Very high	11 Å²	11	15.3 Å²	15.3	8%	0.077	9%	0.087	C	C	.	.	H	α-helix	trans	-62.6	-39.4	176.8	175.1	0	0	0	0	112.3	Y463 Y464 L465 C469 D470 S471 F540 E542 Y547	Y463-S467 PolarHBondContact O-N 2.98Å; Y464-S467 PolarHBondContact O-N 3.06Å; L465-S467 VanDerWaalsContact C-N 3.35Å; L465-S467 PolarHBondContact O-N 2.97Å; S467-C469 PolarHBondContact O-N 3.36Å; S467-D470 PolarHBondContact O-N 2.98Å; S467-S471 WeakPolarHBondContact O-CB 3.48Å; S467-S471 PolarHBondContact O-N 3.29Å; S467-F540 WeakPolarHBondContact OG-CZ 3.43Å; S467-E542 WeakPolarHBondContact CB-OE1 3.34Å; S467-E542 PolarHBondContact OG-OE1 3.27Å; S467-Y547 WeakPolarHBondContact CB-OH 3.46Å; S467-Y547 PolarHBondContact OG-OH 3.48Å
468	I	95.4	Very high	93.7	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-57	-49.3	172	-75	170.2	0	0	0	110.9	L219 Y464 L465 F466 S471 V472 F540 Y547 A551 F554 R555 L558	L219-I468 HydrophobicContact CD2-CD1 4.2Å; Y464-I468 WeakPolarHBondContact O-CG1 3.3Å; Y464-I468 PolarHBondContact O-N 3.32Å; L465-I468 WeakPolarHBondContact O-CB 3.37Å; L465-I468 PolarHBondContact O-N 2.78Å; F466-I468 VanDerWaalsContact C-N 3.35Å; F466-I468 PolarHBondContact O-N 3.48Å; I468-S471 PolarHBondContact O-N 3.06Å; I468-S471 PolarHBondContact O-OG 3.19Å; I468-V472 PolarHBondContact O-N 3.07Å; I468-F540 HydrophobicContact CG1-CE1 3.98Å; I468-F540 HydrophobicContact CG1-CZ 4.49Å; I468-Y547 HydrophobicContact CD1-CD1 4.06Å; I468-Y547 HydrophobicContact CD1-CE1 3.85Å; I468-Y547 HydrophobicContact CG1-CD1 4.39Å; I468-Y547 HydrophobicContact CG1-CE1 3.88Å; I468-A551 HydrophobicContact CD1-CB 4.15Å; I468-F554 HydrophobicContact CG2-CD1 4.15Å; I468-F554 HydrophobicContact CG2-CE1 4.29Å; I468-R555 HydrophobicContact CG1-CB 4.44Å; I468-R555 HydrophobicContact CG2-CB 3.83Å; I468-R555 HydrophobicContact CG2-CG 4Å; I468-L558 HydrophobicContact CG2-CD2 4.48Å
469	C	95.1	Very high	93.6	Very high	13 Å²	13	15.3 Å²	15.3	9%	0.088	9%	0.088	C	C	.	.	H	α-helix	trans	-61.5	-46.4	178.7	-69.4	0	0	0	0	112.3	Y152 L465 F466 S467 S471 V472 I473	Y152-C469 HydrophobicContact CG-CB 4.25Å; L465-C469 PolarHBondContact O-N 2.8Å; L465-C469 PolarHBondContact O-SG 3.32Å; F466-C469 PolarHBondContact O-N 3.3Å; S467-C469 PolarHBondContact O-N 3.36Å; C469-S471 VanDerWaalsContact C-N 3.26Å; C469-S471 PolarHBondContact O-N 3.37Å; C469-V472 WeakPolarHBondContact O-CB 3.36Å; C469-V472 PolarHBondContact O-N 2.95Å; C469-V472 VanDerWaalsContact O-N 3.09Å; C469-I473 PolarHBondContact O-N 3.09Å
470	D	91.7	Very high	93.5	Very high	48 Å²	48	16.2 Å²	16.2	26%	0.257	9%	0.093	S	C	.	.	H	α-helix	trans	-60.2	-37.7	178.2	-175	71.6	0	0	0	112	Y152 F466 S467 V472 I473 S474	Y152-D470 HydrophobicContact CD2-CB 4.48Å; Y152-D470 HydrophobicContact CE2-CB 4.09Å; Y152-D470 PolarHBondContact OH-OD1 2.8Å; F466-D470 PolarHBondContact O-N 3.08Å; S467-D470 PolarHBondContact O-N 2.98Å; D470-V472 VanDerWaalsContact C-N 3.26Å; D470-V472 PolarHBondContact O-N 2.86Å; D470-I473 PolarHBondContact O-N 2.94Å; D470-S474 WeakPolarHBondContact O-CB 3.32Å; D470-S474 PolarHBondContact O-N 2.94Å; D470-S474 PolarHBondContact O-OG 3.39Å
471	S	91	Very high	93.6	Very high	21 Å²	21	15.2 Å²	15.2	15%	0.147	8%	0.084	C	C	.	.	H	α-helix	trans	-64.1	-28	177	83.5	0	0	0	0	113.8	S467 I468 C469 G475 R555	S467-S471 WeakPolarHBondContact O-CB 3.48Å; S467-S471 PolarHBondContact O-N 3.29Å; I468-S471 PolarHBondContact O-N 3.06Å; I468-S471 PolarHBondContact O-OG 3.19Å; C469-S471 VanDerWaalsContact C-N 3.26Å; C469-S471 PolarHBondContact O-N 3.37Å; S471-G475 WeakPolarHBondContact O-CA 3.12Å; S471-G475 PolarHBondContact O-N 3.42Å; S471-R555 WeakPolarHBondContact OG-CD 3.21Å
472	V	91.5	Very high	93.6	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-74.1	-44.5	177.1	173	0	0	0	0	110.5	I468 C469 D470 G475 L558 A559	I468-V472 PolarHBondContact O-N 3.07Å; C469-V472 WeakPolarHBondContact O-CB 3.36Å; C469-V472 PolarHBondContact O-N 2.95Å; C469-V472 VanDerWaalsContact O-N 3.09Å; D470-V472 VanDerWaalsContact C-N 3.26Å; D470-V472 PolarHBondContact O-N 2.86Å; V472-G475 PolarHBondContact O-N 2.93Å; V472-L558 HydrophobicContact CG2-CB 4.11Å; V472-L558 HydrophobicContact CG2-CD2 3.98Å; V472-L558 HydrophobicContact CG2-CG 4Å; V472-A559 HydrophobicContact CG1-CB 4.14Å; V472-A559 HydrophobicContact CG2-CB 4.07Å
473	I	89.9	Confident	93.7	Very high	13 Å²	13	16.6 Å²	16.6	7%	0.067	9%	0.092	C	C	.	.	H	α-helix	trans	-70.7	-35	-179.3	-55.7	-54.9	0	0	0	111.4	L145 I148 L149 Y152 F309 C469 D470 G475 P478	L145-I473 HydrophobicContact CD1-CD1 3.37Å; L145-I473 HydrophobicContact CG-CD1 3.95Å; I148-I473 HydrophobicContact CB-CD1 4.07Å; I148-I473 HydrophobicContact CG2-CD1 3.86Å; I148-I473 HydrophobicContact CG2-CG1 4.31Å; L149-I473 HydrophobicContact CB-CD1 4.16Å; L149-I473 HydrophobicContact CB-CG1 4.47Å; L149-I473 HydrophobicContact CD1-CG2 4.34Å; Y152-I473 HydrophobicContact CD1-CG1 4.19Å; Y152-I473 HydrophobicContact CE1-CB 4.29Å; Y152-I473 HydrophobicContact CE1-CG1 3.69Å; Y152-I473 HydrophobicContact CE1-CG2 4.46Å; F309-I473 HydrophobicContact CD2-CG2 4.06Å; F309-I473 HydrophobicContact CE2-CG2 4.13Å; C469-I473 PolarHBondContact O-N 3.09Å; D470-I473 PolarHBondContact O-N 2.94Å; I473-G475 VanDerWaalsContact C-N 3.31Å; I473-P478 WeakPolarHBondContact O-CG 3.47Å
474	S	86.6	Confident	93.9	Very high	22 Å²	22	16.9 Å²	16.9	15%	0.154	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.4	176.3	-59.4	0	0	0	0	113.6	R82 T305 D470	R82-S474 PolarHBondContact NH1-OG 2.97Å; R82-S474 VanDerWaalsContact NH1-OG 3.07Å; R82-S474 PolarHBondContact NH2-OG 3.41Å; T305-S474 WeakPolarHBondContact CG2-O 3.34Å; D470-S474 WeakPolarHBondContact O-CB 3.32Å; D470-S474 PolarHBondContact O-N 2.94Å; D470-S474 PolarHBondContact O-OG 3.39Å
475	G	89.4	Confident	94	Very high	14 Å²	14	16.1 Å²	16.1	14%	0.144	9%	0.094	C	C	.	.	S	Bend	trans	-97.9	-155	-172.8	0	0	0	0	0	114.7	S471 V472 I473 T477 P478	S471-G475 WeakPolarHBondContact O-CA 3.12Å; S471-G475 PolarHBondContact O-N 3.42Å; V472-G475 PolarHBondContact O-N 2.93Å; I473-G475 VanDerWaalsContact C-N 3.31Å; G475-T477 VanDerWaalsContact C-N 3.27Å; G475-T477 PolarHBondContact O-N 2.93Å; G475-P478 WeakPolarHBondContact O-CD 3.41Å; G475-P478 WeakPolarHBondContact O-CG 3.3Å
476	Y	92.2	Very high	94.1	Very high	32 Å²	32	14.7 Å²	14.7	13%	0.125	9%	0.087	C	C	.	.	H	α-helix	trans	-71.4	-19.5	-180	66.2	-98.6	0	0	0	113.5	L479 V480 F534 A559 V563	Y476-L479 WeakPolarHBondContact O-CB 3.32Å; Y476-L479 PolarHBondContact O-N 3.48Å; Y476-L479 VanDerWaalsContact O-N 3.15Å; Y476-V480 HydrophobicContact CD2-CG2 4.09Å; Y476-V480 WeakPolarHBondContact O-CG2 3.48Å; Y476-V480 PolarHBondContact O-N 3.14Å; Y476-F534 HydrophobicContact CD1-CE2 4.34Å; Y476-F534 AromaticContact CD1-CZ 3.83Å; Y476-F534 HydrophobicContact CD1-CZ 3.83Å; Y476-F534 HydrophobicContact CE1-CZ 4.05Å; Y476-F534 HydrophobicContact CG-CE2 4.29Å; Y476-F534 HydrophobicContact CG-CZ 4.14Å; Y476-A559 HydrophobicContact CE1-CB 4.08Å; Y476-A559 VanDerWaalsContact OH-CB 3.32Å; Y476-A559 WeakPolarHBondContact OH-CB 3.26Å; Y476-V563 HydrophobicContact CE2-CG2 4.12Å
477	T	94.1	Very high	94.1	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-55.9	-55.8	-174.4	-47	0	0	0	0	113.7	L145 G475 L479 V480 I481 A559 P562 V563	L145-T477 HydrophobicContact CD1-CG2 3.84Å; G475-T477 VanDerWaalsContact C-N 3.27Å; G475-T477 PolarHBondContact O-N 2.93Å; T477-L479 VanDerWaalsContact C-N 3.27Å; T477-L479 PolarHBondContact O-N 2.97Å; T477-V480 PolarHBondContact O-N 3.19Å; T477-I481 PolarHBondContact O-N 3.42Å; T477-A559 PolarHBondContact OG1-O 3.01Å; T477-P562 HydrophobicContact CG2-CB 3.73Å; T477-P562 HydrophobicContact CG2-CG 3.82Å; T477-V563 HydrophobicContact CG2-CG2 4.36Å
478	P	94.3	Very high	94.2	Very high	11 Å²	11	16.2 Å²	16.2	7%	0.071	10%	0.095	C	C	.	.	H	α-helix	trans	-61.5	-33.3	175.3	25.6	-37.5	0	0	0	113	L145 F308 I473 G475 I481 A482	L145-P478 HydrophobicContact CD2-CB 4.1Å; F308-P478 HydrophobicContact CD1-CB 4.42Å; I473-P478 WeakPolarHBondContact O-CG 3.47Å; G475-P478 WeakPolarHBondContact O-CD 3.41Å; G475-P478 WeakPolarHBondContact O-CG 3.3Å; P478-I481 PolarHBondContact O-N 3.44Å; P478-A482 WeakPolarHBondContact O-CB 3.38Å; P478-A482 PolarHBondContact O-N 2.81Å
479	L	94.6	Very high	94.2	Very high	5 Å²	5	16.2 Å²	16.2	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-67.3	-38.1	178.9	-60.7	175.6	0	0	0	112.1	F308 Y476 T477 A482 L483 L529 I530 I533	F308-L479 HydrophobicContact CD2-CD2 3.84Å; F308-L479 HydrophobicContact CE1-CD2 4.46Å; F308-L479 HydrophobicContact CE2-CD2 3.37Å; F308-L479 HydrophobicContact CZ-CD2 3.74Å; Y476-L479 WeakPolarHBondContact O-CB 3.32Å; Y476-L479 PolarHBondContact O-N 3.48Å; Y476-L479 VanDerWaalsContact O-N 3.15Å; T477-L479 VanDerWaalsContact C-N 3.27Å; T477-L479 PolarHBondContact O-N 2.97Å; L479-A482 PolarHBondContact O-N 3.48Å; L479-L483 WeakPolarHBondContact O-CB 3.27Å; L479-L483 PolarHBondContact O-N 2.98Å; L479-L529 HydrophobicContact CD1-CB 3.64Å; L479-L529 HydrophobicContact CD2-CB 4.44Å; L479-L529 HydrophobicContact CD2-CD1 4.04Å; L479-I530 HydrophobicContact CB-CD1 4.01Å; L479-I530 HydrophobicContact CB-CG1 3.63Å; L479-I530 HydrophobicContact CD1-CG1 4.13Å; L479-I533 HydrophobicContact CD1-CD1 3.54Å
480	V	96.3	Very high	94.3	Very high	25 Å²	25	15.9 Å²	15.9	15%	0.152	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-43.3	174.3	171.7	0	0	0	0	110.4	Y476 T477 A482 L483 C484 I530 V563	Y476-V480 HydrophobicContact CD2-CG2 4.09Å; Y476-V480 WeakPolarHBondContact O-CG2 3.48Å; Y476-V480 PolarHBondContact O-N 3.14Å; T477-V480 PolarHBondContact O-N 3.19Å; V480-A482 PolarHBondContact O-N 2.87Å; V480-L483 PolarHBondContact O-N 3.08Å; V480-C484 WeakPolarHBondContact O-CB 3.45Å; V480-C484 PolarHBondContact O-N 3.04Å; V480-C484 PolarHBondContact O-SG 2.92Å; V480-C484 VanDerWaalsContact O-SG 3.33Å; V480-I530 HydrophobicContact CG2-CD1 3.83Å; V480-I530 HydrophobicContact CG2-CG1 4.4Å; V480-V563 HydrophobicContact CB-CG2 4.12Å; V480-V563 HydrophobicContact CG1-CG1 4.05Å; V480-V563 HydrophobicContact CG1-CG2 3.95Å; V480-V563 HydrophobicContact CG2-CG2 4.39Å
481	I	97.3	Very high	94.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.9	-47.6	175.5	-64.3	173	0	0	0	110.1	I138 A141 M142 L145 C314 T477 P478 L483 C484 E485 I566	I138-I481 HydrophobicContact CG2-CG2 3.99Å; A141-I481 HydrophobicContact CB-CD1 3.96Å; A141-I481 HydrophobicContact CB-CG1 4.15Å; M142-I481 HydrophobicContact CE-CG2 3.76Å; M142-I481 HydrophobicContact CG-CG2 3.75Å; L145-I481 HydrophobicContact CB-CD1 4.42Å; L145-I481 HydrophobicContact CD2-CD1 3.95Å; C314-I481 HydrophobicContact CB-CB 4.39Å; C314-I481 HydrophobicContact CB-CG2 4.01Å; C314-I481 WeakPolarHBondContact O-CG2 3.34Å; T477-I481 PolarHBondContact O-N 3.42Å; P478-I481 PolarHBondContact O-N 3.44Å; I481-L483 VanDerWaalsContact C-N 3.34Å; I481-L483 PolarHBondContact O-N 2.95Å; I481-C484 PolarHBondContact O-N 3.5Å; I481-E485 VanDerWaalsContact O-CB 3.29Å; I481-E485 WeakPolarHBondContact O-CB 3.26Å; I481-E485 PolarHBondContact O-N 2.91Å; I481-I566 HydrophobicContact CG1-CD1 4.33Å
482	A	97.1	Very high	94.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.6	-42.5	177.7	0	0	0	0	0	112.9	L110 F308 C314 P478 L479 V480 T486	L110-A482 HydrophobicContact CD1-CB 4.17Å; L110-A482 HydrophobicContact CD2-CB 4.42Å; F308-A482 HydrophobicContact CE1-CB 3.69Å; F308-A482 HydrophobicContact CZ-CB 3.66Å; C314-A482 HydrophobicContact CB-CB 4.17Å; C314-A482 VanDerWaalsContact SG-CA 3.56Å; C314-A482 WeakPolarHBondContact SG-CB 3.24Å; P478-A482 WeakPolarHBondContact O-CB 3.38Å; P478-A482 PolarHBondContact O-N 2.81Å; L479-A482 PolarHBondContact O-N 3.48Å; V480-A482 PolarHBondContact O-N 2.87Å; A482-T486 WeakPolarHBondContact O-CB 3.15Å; A482-T486 VanDerWaalsContact O-CG2 3.32Å; A482-T486 WeakPolarHBondContact O-CG2 3.35Å; A482-T486 PolarHBondContact O-N 3.35Å; A482-T486 PolarHBondContact O-OG1 3.04Å
483	L	97.5	Very high	94.2	Very high	30 Å²	30	22.1 Å²	22.1	16%	0.157	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-47.5	177.1	-177.7	62.3	0	0	0	111	L479 V480 I481 T486 I487 P523 C526 F527 I530	L479-L483 WeakPolarHBondContact O-CB 3.27Å; L479-L483 PolarHBondContact O-N 2.98Å; V480-L483 PolarHBondContact O-N 3.08Å; I481-L483 VanDerWaalsContact C-N 3.34Å; I481-L483 PolarHBondContact O-N 2.95Å; L483-T486 PolarHBondContact O-OG1 3.48Å; L483-T486 VanDerWaalsContact O-OG1 3.08Å; L483-I487 HydrophobicContact CD1-CD1 3.8Å; L483-I487 HydrophobicContact CD1-CG1 4.32Å; L483-I487 HydrophobicContact CG-CD1 3.85Å; L483-I487 WeakPolarHBondContact O-CB 3.16Å; L483-I487 WeakPolarHBondContact O-CD1 3.41Å; L483-I487 WeakPolarHBondContact O-CG1 3.48Å; L483-I487 PolarHBondContact O-N 3.48Å; L483-P523 HydrophobicContact CD1-CB 3.89Å; L483-P523 WeakPolarHBondContact CD1-O 3.47Å; L483-C526 HydrophobicContact CB-CB 4.17Å; L483-C526 HydrophobicContact CD1-CB 4.43Å; L483-F527 HydrophobicContact CD2-CB 4.46Å; L483-F527 HydrophobicContact CD2-CD2 4.32Å; L483-I530 HydrophobicContact CD2-CD1 4.09Å
484	C	97.9	Very high	94.2	Very high	33 Å²	33	22.6 Å²	22.6	22%	0.223	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-44.7	177.3	-71.2	0	0	0	0	111.6	I138 V480 I481 I487 V488	I138-C484 HydrophobicContact CD1-CB 3.68Å; I138-C484 HydrophobicContact CG1-CB 4.09Å; V480-C484 WeakPolarHBondContact O-CB 3.45Å; V480-C484 PolarHBondContact O-N 3.04Å; V480-C484 PolarHBondContact O-SG 2.92Å; V480-C484 VanDerWaalsContact O-SG 3.33Å; I481-C484 PolarHBondContact O-N 3.5Å; C484-I487 PolarHBondContact O-N 3.24Å; C484-V488 WeakPolarHBondContact O-CB 3.19Å; C484-V488 VanDerWaalsContact O-CG2 3.24Å; C484-V488 WeakPolarHBondContact O-CG2 3.45Å; C484-V488 PolarHBondContact O-N 3.38Å
485	E	97.2	Very high	94.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.3	-49.8	-178.7	170.8	174.6	-148.5	0	0	112.2	L113 E114 W129 M142 C314 I481 I487 V488 I489	L113-E485 HydrophobicContact CD2-CG 3.8Å; L113-E485 WeakPolarHBondContact CD2-OE1 3.25Å; E114-E485 WeakPolarHBondContact CG-OE1 3.5Å; W129-E485 HydrophobicContact CH2-CB 3.92Å; W129-E485 HydrophobicContact CH2-CG 3.92Å; W129-E485 HydrophobicContact CZ2-CB 4.28Å; W129-E485 HydrophobicContact CZ2-CG 4.23Å; M142-E485 WeakPolarHBondContact CE-OE2 3.16Å; C314-E485 PolarHBondContact SG-OE2 3.26Å; I481-E485 VanDerWaalsContact O-CB 3.29Å; I481-E485 WeakPolarHBondContact O-CB 3.26Å; I481-E485 PolarHBondContact O-N 2.91Å; E485-I487 VanDerWaalsContact C-N 3.35Å; E485-I487 PolarHBondContact O-N 2.56Å; E485-V488 PolarHBondContact O-N 2.99Å; E485-I489 HydrophobicContact CG-CD1 3.8Å; E485-I489 PolarHBondContact O-N 2.78Å
486	T	97.5	Very high	94.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-40.4	177.8	51.5	0	0	0	0	111.9	L110 L113 A482 L483 C490 T522	L110-T486 HydrophobicContact CD2-CG2 3.6Å; L113-T486 HydrophobicContact CD1-CG2 4.47Å; A482-T486 WeakPolarHBondContact O-CB 3.15Å; A482-T486 VanDerWaalsContact O-CG2 3.32Å; A482-T486 WeakPolarHBondContact O-CG2 3.35Å; A482-T486 PolarHBondContact O-N 3.35Å; A482-T486 PolarHBondContact O-OG1 3.04Å; L483-T486 PolarHBondContact O-OG1 3.48Å; L483-T486 VanDerWaalsContact O-OG1 3.08Å; T486-C490 WeakPolarHBondContact O-CB 3.31Å; T486-C490 PolarHBondContact O-N 2.83Å; T486-C490 PolarHBondContact O-SG 3.12Å; T486-C490 VanDerWaalsContact O-SG 3.36Å; T486-T522 HydrophobicContact CG2-CG2 3.74Å
487	I	96.3	Very high	94.6	Very high	70 Å²	70	29.7 Å²	29.7	36%	0.359	15%	0.149	S	C	.	.	H	α-helix	trans	-61.7	-49.1	176.3	-72.6	171	0	0	0	110.9	L483 C484 E485 Y491 V492	L483-I487 HydrophobicContact CD1-CD1 3.8Å; L483-I487 HydrophobicContact CD1-CG1 4.32Å; L483-I487 HydrophobicContact CG-CD1 3.85Å; L483-I487 WeakPolarHBondContact O-CB 3.16Å; L483-I487 WeakPolarHBondContact O-CD1 3.41Å; L483-I487 WeakPolarHBondContact O-CG1 3.48Å; L483-I487 PolarHBondContact O-N 3.48Å; C484-I487 PolarHBondContact O-N 3.24Å; E485-I487 VanDerWaalsContact C-N 3.35Å; E485-I487 PolarHBondContact O-N 2.56Å; I487-Y491 WeakPolarHBondContact O-CB 3.47Å; I487-Y491 PolarHBondContact O-N 2.88Å; I487-V492 PolarHBondContact O-N 2.85Å
488	V	95.5	Very high	94.7	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	15%	0.149	C	C	.	.	I	π-helix	trans	-66.2	-47.5	-175.8	174.4	0	0	0	0	110.9	W129 F135 I138 C484 E485 V492 Y493	W129-V488 HydrophobicContact CE3-CG1 4.44Å; W129-V488 HydrophobicContact CZ3-CB 4.06Å; W129-V488 HydrophobicContact CZ3-CG1 3.83Å; F135-V488 HydrophobicContact CB-CG1 4.22Å; F135-V488 HydrophobicContact CB-CG2 3.99Å; F135-V488 HydrophobicContact CD1-CG2 3.63Å; F135-V488 HydrophobicContact CD2-CB 4.49Å; F135-V488 HydrophobicContact CD2-CG1 3.94Å; F135-V488 HydrophobicContact CD2-CG2 3.64Å; F135-V488 HydrophobicContact CE1-CG2 3.95Å; F135-V488 HydrophobicContact CE2-CG2 3.96Å; F135-V488 HydrophobicContact CG-CG1 4.2Å; F135-V488 HydrophobicContact CG-CG2 3.47Å; F135-V488 VanDerWaalsContact CG-CG2 3.47Å; F135-V488 HydrophobicContact CZ-CG2 4.1Å; I138-V488 HydrophobicContact CD1-CG2 4.02Å; C484-V488 WeakPolarHBondContact O-CB 3.19Å; C484-V488 VanDerWaalsContact O-CG2 3.24Å; C484-V488 WeakPolarHBondContact O-CG2 3.45Å; C484-V488 PolarHBondContact O-N 3.38Å; E485-V488 PolarHBondContact O-N 2.99Å; V488-V492 HydrophobicContact CG1-CB 4.32Å; V488-V492 WeakPolarHBondContact O-CA 3.47Å; V488-V492 VanDerWaalsContact O-CB 3.26Å; V488-V492 WeakPolarHBondContact O-CB 3.48Å; V488-V492 PolarHBondContact O-N 3.45Å; V488-V492 VanDerWaalsContact O-N 3.12Å; V488-Y493 PolarHBondContact O-N 3.16Å
489	I	95.9	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-67.7	-43.6	-178.4	-69.8	165.8	0	0	0	111.2	L113 F117 E485 G494 F498	L113-I489 HydrophobicContact CD1-CG2 4.38Å; L113-I489 HydrophobicContact CD2-CD1 3.7Å; L113-I489 HydrophobicContact CG-CD1 4.3Å; F117-I489 HydrophobicContact CD1-CD1 3.89Å; F117-I489 HydrophobicContact CD2-CD1 4.36Å; F117-I489 HydrophobicContact CE1-CD1 4.04Å; F117-I489 HydrophobicContact CE2-CD1 4.49Å; F117-I489 HydrophobicContact CG-CD1 4.07Å; F117-I489 HydrophobicContact CZ-CD1 4.35Å; E485-I489 HydrophobicContact CG-CD1 3.8Å; E485-I489 PolarHBondContact O-N 2.78Å; I489-G494 PolarHBondContact O-N 3.09Å; I489-G494 VanDerWaalsContact O-N 3.11Å; I489-F498 HydrophobicContact CG2-CB 4.26Å; I489-F498 HydrophobicContact CG2-CD1 3.72Å; I489-F498 HydrophobicContact CG2-CD2 3.85Å; I489-F498 HydrophobicContact CG2-CE1 3.94Å; I489-F498 HydrophobicContact CG2-CE2 4.07Å; I489-F498 HydrophobicContact CG2-CG 3.67Å; I489-F498 HydrophobicContact CG2-CZ 4.11Å
490	C	95.8	Very high	94.7	Very high	6 Å²	6	34.8 Å²	34.8	4%	0.041	17%	0.166	C	C	.	.	I	π-helix	trans	-81.1	-37.6	-173.2	-66	0	0	0	0	114.1	T486 G494 L495 W518	T486-C490 WeakPolarHBondContact O-CB 3.31Å; T486-C490 PolarHBondContact O-N 2.83Å; T486-C490 PolarHBondContact O-SG 3.12Å; T486-C490 VanDerWaalsContact O-SG 3.36Å; C490-G494 CarbonylContact O-C 3.27Å; C490-G494 WeakPolarHBondContact O-CA 3.23Å; C490-L495 HydrophobicContact CB-CB 4.37Å; C490-L495 PolarHBondContact O-N 3.14Å; C490-W518 VanDerWaalsContact SG-CB 3.59Å; C490-W518 PolarHBondContact SG-O 3.27Å
491	Y	92	Very high	94.6	Very high	132 Å²	132	33.6 Å²	33.6	52%	0.518	16%	0.159	S	C	.	.	I	π-helix	trans	-109.6	-33.4	-171	-62.6	-92.1	0	0	0	113.9	I487 L519	I487-Y491 WeakPolarHBondContact O-CB 3.47Å; I487-Y491 PolarHBondContact O-N 2.88Å; Y491-L519 HydrophobicContact CD1-CD1 4.34Å; Y491-L519 HydrophobicContact CE1-CD1 3.69Å; Y491-L519 HydrophobicContact CE2-CD1 4.17Å; Y491-L519 PolarHBondContact OH-O 3.4Å
492	V	90.1	Very high	94.6	Very high	46 Å²	46	33.6 Å²	33.6	28%	0.279	16%	0.159	S	C	.	.	I	π-helix	trans	-84.8	-59.8	178.8	176.7	0	0	0	0	110.4	F135 I487 V488 L587	F135-V492 HydrophobicContact CE2-CG1 4.47Å; F135-V492 HydrophobicContact CE2-CG2 4.28Å; I487-V492 PolarHBondContact O-N 2.85Å; V488-V492 HydrophobicContact CG1-CB 4.32Å; V488-V492 WeakPolarHBondContact O-CA 3.47Å; V488-V492 VanDerWaalsContact O-CB 3.26Å; V488-V492 WeakPolarHBondContact O-CB 3.48Å; V488-V492 PolarHBondContact O-N 3.45Å; V488-V492 VanDerWaalsContact O-N 3.12Å; V492-L587 HydrophobicContact CG1-CB 3.88Å; V492-L587 HydrophobicContact CG1-CD2 3.44Å; V492-L587 VanDerWaalsContact CG1-CD2 3.44Å; V492-L587 HydrophobicContact CG1-CG 4.2Å; V492-L587 WeakPolarHBondContact CG1-O 3.24Å; V492-L587 HydrophobicContact CG2-CD2 4.32Å
493	Y	90.1	Very high	94.6	Very high	24 Å²	24	36.3 Å²	36.3	9%	0.094	17%	0.172	C	C	.	.	I	π-helix	trans	-69.9	-38.2	176	-179.3	-109.5	0	0	0	111.6	I131 V488 Q497 F498 D501 P589 W593	I131-Y493 HydrophobicContact CD1-CD1 3.6Å; I131-Y493 HydrophobicContact CD1-CD2 3.68Å; I131-Y493 HydrophobicContact CD1-CE1 3.84Å; I131-Y493 HydrophobicContact CD1-CE2 3.91Å; I131-Y493 HydrophobicContact CD1-CG 3.49Å; I131-Y493 VanDerWaalsContact CD1-CG 3.49Å; I131-Y493 HydrophobicContact CG1-CD1 4.24Å; I131-Y493 HydrophobicContact CG1-CD2 3.32Å; I131-Y493 HydrophobicContact CG1-CE1 4.44Å; I131-Y493 HydrophobicContact CG1-CE2 3.58Å; I131-Y493 HydrophobicContact CG1-CG 3.66Å; V488-Y493 PolarHBondContact O-N 3.16Å; Y493-Q497 HydrophobicContact CD1-CB 4.47Å; Y493-Q497 HydrophobicContact CE1-CB 3.99Å; Y493-Q497 HydrophobicContact CE1-CG 3.7Å; Y493-Q497 HydrophobicContact CE2-CG 4.32Å; Y493-Q497 WeakPolarHBondContact OH-CG 3.3Å; Y493-F498 HydrophobicContact CD1-CB 4.08Å; Y493-F498 HydrophobicContact CD1-CD2 4.5Å; Y493-F498 HydrophobicContact CE1-CB 4.09Å; Y493-F498 HydrophobicContact CE1-CD2 4.31Å; Y493-D501 WeakPolarHBondContact CE1-OD2 3.2Å; Y493-D501 VanDerWaalsContact CZ-OD2 3.24Å; Y493-D501 PolarHBondContact OH-OD2 3.44Å; Y493-P589 HydrophobicContact CD2-CG 4.47Å; Y493-P589 HydrophobicContact CE2-CB 4.3Å; Y493-P589 HydrophobicContact CE2-CG 3.99Å; Y493-W593 AromaticContact CE2-NE1 3.8Å; Y493-W593 AromaticContact CZ-NE1 3.77Å; Y493-W593 PolarHBondContact OH-NE1 3.34Å
494	G	91.5	Very high	94.4	Very high	22 Å²	22	35.4 Å²	35.4	23%	0.227	17%	0.167	C	C	.	.	I	π-helix	trans	101	117.5	173	0	0	0	0	0	112.2	I489 C490 K496 Q497 F498	I489-G494 PolarHBondContact O-N 3.09Å; I489-G494 VanDerWaalsContact O-N 3.11Å; C490-G494 CarbonylContact O-C 3.27Å; C490-G494 WeakPolarHBondContact O-CA 3.23Å; G494-K496 PolarHBondContact O-N 3.33Å; G494-Q497 PolarHBondContact O-N 3.37Å; G494-F498 PolarHBondContact O-N 2.95Å; G494-F498 VanDerWaalsContact O-N 3.11Å
495	L	94.6	Very high	94.3	Very high	14 Å²	14	33.9 Å²	33.9	7%	0.073	16%	0.157	C	C	.	.	H	α-helix	trans	-57.9	-28.4	-177.1	178.8	56.7	0	0	0	114.1	C490 R499 R515 W518 L519	C490-L495 HydrophobicContact CB-CB 4.37Å; C490-L495 PolarHBondContact O-N 3.14Å; L495-R499 HydrophobicContact CD1-CG 3.91Å; L495-R499 HydrophobicContact CG-CG 4.4Å; L495-R499 WeakPolarHBondContact O-CB 3.3Å; L495-R499 VanDerWaalsContact O-CG 3.27Å; L495-R499 WeakPolarHBondContact O-CG 3.42Å; L495-R499 PolarHBondContact O-N 3.18Å; L495-R515 HydrophobicContact CD2-CB 4.43Å; L495-R515 HydrophobicContact CD2-CG 3.74Å; L495-W518 HydrophobicContact CD1-CE3 3.59Å; L495-W518 HydrophobicContact CD1-CZ3 4.12Å; L495-L519 HydrophobicContact CD2-CB 4.11Å; L495-L519 HydrophobicContact CD2-CD1 4.39Å
496	K	92.1	Very high	94.2	Very high	165 Å²	165	34.5 Å²	34.5	72%	0.717	16%	0.16	S	C	*	.	H	α-helix	trans	-65.3	-40.2	175.5	-71.4	-177.9	-178.2	175	0	111.9	G494 R500	G494-K496 PolarHBondContact O-N 3.33Å; K496-R500 WeakPolarHBondContact O-CG 3.37Å; K496-R500 PolarHBondContact O-N 2.99Å
497	Q	90	Very high	94.1	Very high	38 Å²	38	40 Å²	40	18%	0.178	19%	0.19	C	C	.	.	H	α-helix	trans	-71.5	-49	177	-176.4	57.8	42.4	0	0	109.8	Y493 G494 R499 R500 D501	Y493-Q497 HydrophobicContact CD1-CB 4.47Å; Y493-Q497 HydrophobicContact CE1-CB 3.99Å; Y493-Q497 HydrophobicContact CE1-CG 3.7Å; Y493-Q497 HydrophobicContact CE2-CG 4.32Å; Y493-Q497 WeakPolarHBondContact OH-CG 3.3Å; G494-Q497 PolarHBondContact O-N 3.37Å; Q497-R499 VanDerWaalsContact C-N 3.28Å; Q497-R499 PolarHBondContact O-N 3.01Å; Q497-R500 WeakPolarHBondContact O-CA 3.28Å; Q497-R500 WeakPolarHBondContact O-CB 3.48Å; Q497-R500 PolarHBondContact O-N 3.23Å; Q497-D501 PolarHBondContact NE2-OD1 3.46Å; Q497-D501 VanDerWaalsContact O-CG 3.31Å; Q497-D501 PolarHBondContact O-N 3.16Å
498	F	95.4	Very high	94	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-56.6	-38.8	179.3	-168.6	-115.2	0	0	0	113.4	L113 A116 F117 I489 Y493 G494 R500 D501 I502 W518	L113-F498 HydrophobicContact CG-CE1 4.28Å; L113-F498 HydrophobicContact CG-CZ 4.5Å; A116-F498 HydrophobicContact CB-CE1 4.43Å; A116-F498 HydrophobicContact CB-CZ 3.92Å; F117-F498 HydrophobicContact CB-CE2 4.5Å; F117-F498 HydrophobicContact CB-CZ 4.37Å; I489-F498 HydrophobicContact CG2-CB 4.26Å; I489-F498 HydrophobicContact CG2-CD1 3.72Å; I489-F498 HydrophobicContact CG2-CD2 3.85Å; I489-F498 HydrophobicContact CG2-CE1 3.94Å; I489-F498 HydrophobicContact CG2-CE2 4.07Å; I489-F498 HydrophobicContact CG2-CG 3.67Å; I489-F498 HydrophobicContact CG2-CZ 4.11Å; Y493-F498 HydrophobicContact CD1-CB 4.08Å; Y493-F498 HydrophobicContact CD1-CD2 4.5Å; Y493-F498 HydrophobicContact CE1-CB 4.09Å; Y493-F498 HydrophobicContact CE1-CD2 4.31Å; G494-F498 PolarHBondContact O-N 2.95Å; G494-F498 VanDerWaalsContact O-N 3.11Å; F498-R500 VanDerWaalsContact C-N 3.3Å; F498-R500 PolarHBondContact O-N 3.19Å; F498-D501 WeakPolarHBondContact O-CB 3.46Å; F498-D501 PolarHBondContact O-N 3.04Å; F498-I502 HydrophobicContact CD1-CD1 3.87Å; F498-I502 HydrophobicContact CE1-CD1 3.63Å; F498-I502 HydrophobicContact CE1-CG1 4.47Å; F498-I502 HydrophobicContact CZ-CD1 4.2Å; F498-I502 WeakPolarHBondContact O-CG1 3.45Å; F498-I502 PolarHBondContact O-N 3.04Å; F498-W518 HydrophobicContact CD1-CZ3 4.44Å; F498-W518 HydrophobicContact CE1-CH2 4.41Å
499	R	96.3	Very high	94	Very high	49 Å²	49	48.7 Å²	48.7	19%	0.185	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-29.3	174.8	-75.2	175.1	67.9	-138.9	-0.2	113.7	L495 Q497 E503 P510 W518	L495-R499 HydrophobicContact CD1-CG 3.91Å; L495-R499 HydrophobicContact CG-CG 4.4Å; L495-R499 WeakPolarHBondContact O-CB 3.3Å; L495-R499 VanDerWaalsContact O-CG 3.27Å; L495-R499 WeakPolarHBondContact O-CG 3.42Å; L495-R499 PolarHBondContact O-N 3.18Å; Q497-R499 VanDerWaalsContact C-N 3.28Å; Q497-R499 PolarHBondContact O-N 3.01Å; R499-E503 PolarHBondContact O-N 3.23Å; R499-P510 HydrophobicContact CB-CG 4.49Å; R499-P510 HydrophobicContact CG-CB 4.18Å; R499-P510 HydrophobicContact CG-CG 4.09Å; R499-P510 PolarHBondContact NE-O 3.46Å; R499-P510 PolarHBondContact NH2-O 3.32Å; R499-W518 HydrophobicContact CG-CZ3 4.47Å
500	R	93	Very high	94	Very high	72 Å²	72	48.9 Å²	48.9	27%	0.272	22%	0.224	S	C	.	.	H	α-helix	trans	-76.3	-36.3	174.1	-70.9	170.4	168.7	178.8	-12.9	111.2	K496 Q497 F498 I502 E503 L504 M607 N611	K496-R500 WeakPolarHBondContact O-CG 3.37Å; K496-R500 PolarHBondContact O-N 2.99Å; Q497-R500 WeakPolarHBondContact O-CA 3.28Å; Q497-R500 WeakPolarHBondContact O-CB 3.48Å; Q497-R500 PolarHBondContact O-N 3.23Å; F498-R500 VanDerWaalsContact C-N 3.3Å; F498-R500 PolarHBondContact O-N 3.19Å; R500-I502 PolarHBondContact O-N 2.77Å; R500-E503 WeakPolarHBondContact O-CB 3.42Å; R500-E503 PolarHBondContact O-N 2.94Å; R500-L504 WeakPolarHBondContact O-CB 3.29Å; R500-L504 PolarHBondContact O-N 3.24Å; R500-M607 HydrophobicContact CB-CE 4.29Å; R500-M607 HydrophobicContact CB-SD 3.77Å; R500-M607 HydrophobicContact CG-SD 4.44Å; R500-N611 PolarHBondContact NH1-ND2 3.26Å; R500-N611 PolarHBondContact NH1-OD1 3.21Å; R500-N611 PolarHBondContact NH2-OD1 3.19Å
501	D	94.7	Very high	94	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-39.3	172.8	-57.9	-16.6	0	0	0	110.6	F120 Y493 Q497 F498 L504 M505 F604	F120-D501 HydrophobicContact CD2-CB 3.84Å; F120-D501 HydrophobicContact CE1-CB 4.35Å; F120-D501 HydrophobicContact CE2-CB 3.52Å; F120-D501 HydrophobicContact CG-CB 4.4Å; F120-D501 HydrophobicContact CZ-CB 3.79Å; Y493-D501 WeakPolarHBondContact CE1-OD2 3.2Å; Y493-D501 VanDerWaalsContact CZ-OD2 3.24Å; Y493-D501 PolarHBondContact OH-OD2 3.44Å; Q497-D501 PolarHBondContact NE2-OD1 3.46Å; Q497-D501 VanDerWaalsContact O-CG 3.31Å; Q497-D501 PolarHBondContact O-N 3.16Å; F498-D501 WeakPolarHBondContact O-CB 3.46Å; F498-D501 PolarHBondContact O-N 3.04Å; D501-L504 WeakPolarHBondContact O-CB 3.39Å; D501-L504 PolarHBondContact O-N 3.45Å; D501-M505 PolarHBondContact O-N 3.1Å; D501-M505 VanDerWaalsContact O-N 3.17Å; D501-F604 WeakPolarHBondContact OD1-CE2 3.11Å
502	I	97.1	Very high	94.3	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-45.9	172.6	-67.5	167.6	0	0	0	112	F112 A116 F498 R500 L504 M505 I506 P510 W518	F112-I502 HydrophobicContact CE1-CD1 4.47Å; F112-I502 HydrophobicContact CZ-CD1 4.18Å; F112-I502 HydrophobicContact CZ-CG2 3.85Å; A116-I502 HydrophobicContact CB-CD1 3.79Å; A116-I502 HydrophobicContact CB-CG1 3.71Å; F498-I502 HydrophobicContact CD1-CD1 3.87Å; F498-I502 HydrophobicContact CE1-CD1 3.63Å; F498-I502 HydrophobicContact CE1-CG1 4.47Å; F498-I502 HydrophobicContact CZ-CD1 4.2Å; F498-I502 WeakPolarHBondContact O-CG1 3.45Å; F498-I502 PolarHBondContact O-N 3.04Å; R500-I502 PolarHBondContact O-N 2.77Å; I502-L504 PolarHBondContact O-N 3.5Å; I502-M505 HydrophobicContact CB-CE 4.28Å; I502-M505 HydrophobicContact CG1-CE 3.84Å; I502-M505 WeakPolarHBondContact O-CA 3.18Å; I502-M505 WeakPolarHBondContact O-CB 3.32Å; I502-M505 PolarHBondContact O-N 2.94Å; I502-I506 HydrophobicContact CG2-CD1 3.75Å; I502-I506 HydrophobicContact CG2-CG1 3.82Å; I502-I506 WeakPolarHBondContact O-CG1 3.41Å; I502-I506 PolarHBondContact O-N 3.2Å; I502-P510 HydrophobicContact CB-CG 3.94Å; I502-P510 HydrophobicContact CD1-CG 3.68Å; I502-P510 HydrophobicContact CG1-CG 4.41Å; I502-P510 HydrophobicContact CG2-CG 3.63Å; I502-W518 HydrophobicContact CD1-CH2 3.77Å; I502-W518 HydrophobicContact CD1-CZ3 4.21Å
503	E	96.3	Very high	94.6	Very high	57 Å²	57	55.1 Å²	55.1	27%	0.266	25%	0.247	S	C	.	.	H	α-helix	trans	-57.5	-38.4	175.2	-179.4	-174.6	-142.6	0	0	111.6	R499 R500 M505 D507 R509	R499-E503 PolarHBondContact O-N 3.23Å; R500-E503 WeakPolarHBondContact O-CB 3.42Å; R500-E503 PolarHBondContact O-N 2.94Å; E503-M505 VanDerWaalsContact C-N 3.29Å; E503-M505 PolarHBondContact O-N 3.19Å; E503-D507 WeakPolarHBondContact O-CA 3.48Å; E503-D507 PolarHBondContact O-N 2.8Å; E503-R509 HydrophobicContact CB-CG 3.66Å; E503-R509 VanDerWaalsContact CD-CZ 3.46Å; E503-R509 HydrophobicContact CG-CG 3.74Å; E503-R509 WeakPolarHBondContact OE1-CD 3.38Å; E503-R509 WeakPolarHBondContact OE1-CG 3.21Å; E503-R509 IonicContact OE1-CZ 2.73Å; E503-R509 IonicContact OE1-NE 3.75Å; E503-R509 PolarHBondContact OE1-NE 3.26Å; E503-R509 VanDerWaalsContact OE1-NE 3.09Å; E503-R509 IonicContact OE1-NH1 2.82Å; E503-R509 IonicContact OE1-NH2 2.75Å; E503-R509 PolarHBondContact OE1-NH2 2.9Å; E503-R509 WeakPolarHBondContact OE2-CG 3.35Å; E503-R509 IonicContact OE2-CZ 2.64Å; E503-R509 IonicContact OE2-NE 3.69Å; E503-R509 PolarHBondContact OE2-NE 3.29Å; E503-R509 IonicContact OE2-NH2 3.41Å; E503-R509 PolarHBondContact OE2-NH2 2.88Å
504	L	93.8	Very high	95	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-33.5	173.9	-179.5	63.2	0	0	0	112.3	F120 F327 K328 R500 D501 I502 P595 E603 F604	F120-L504 HydrophobicContact CE2-CD2 4.38Å; F327-L504 HydrophobicContact CE1-CG 4.04Å; F327-L504 HydrophobicContact CZ-CD2 4.18Å; F327-L504 HydrophobicContact CZ-CG 4.01Å; K328-L504 WeakPolarHBondContact CE-O 3.3Å; K328-L504 PolarHBondContact NZ-O 3.07Å; R500-L504 WeakPolarHBondContact O-CB 3.29Å; R500-L504 PolarHBondContact O-N 3.24Å; D501-L504 WeakPolarHBondContact O-CB 3.39Å; D501-L504 PolarHBondContact O-N 3.45Å; I502-L504 PolarHBondContact O-N 3.5Å; L504-P595 HydrophobicContact CD2-CG 4.34Å; L504-E603 HydrophobicContact CD1-CB 4.22Å; L504-E603 HydrophobicContact CD1-CG 3.72Å; L504-E603 WeakPolarHBondContact CD1-OE1 3.35Å; L504-E603 VanDerWaalsContact CD1-OE2 3.3Å; L504-E603 WeakPolarHBondContact CD1-OE2 3.38Å; L504-F604 HydrophobicContact CD2-CB 3.83Å; L504-F604 HydrophobicContact CD2-CD2 4.37Å
505	M	95	Very high	95.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-78.7	-47.9	177	-72.9	-174.5	-69.2	0	0	113.6	A116 Q119 F120 F327 K328 D501 I502 E503	A116-M505 HydrophobicContact CB-CE 3.95Å; A116-M505 WeakPolarHBondContact O-CE 3.35Å; Q119-M505 HydrophobicContact CB-SD 4.14Å; Q119-M505 HydrophobicContact CG-SD 4.21Å; F120-M505 WeakPolarHBondContact CA-SD 3.48Å; F120-M505 HydrophobicContact CB-CE 3.9Å; F120-M505 HydrophobicContact CB-SD 3.56Å; F120-M505 VanDerWaalsContact CB-SD 3.56Å; F120-M505 HydrophobicContact CD2-CE 4.22Å; F120-M505 HydrophobicContact CD2-CG 3.93Å; F120-M505 HydrophobicContact CD2-SD 3.98Å; F120-M505 HydrophobicContact CG-SD 4.29Å; F120-M505 PolarHBondContact N-SD 3.25Å; F120-M505 VanDerWaalsContact N-SD 3.39Å; F327-M505 HydrophobicContact CD1-CG 4.41Å; F327-M505 HydrophobicContact CD2-CG 4.16Å; F327-M505 HydrophobicContact CE1-CB 4.46Å; F327-M505 HydrophobicContact CE1-CG 3.95Å; F327-M505 HydrophobicContact CE2-CG 3.65Å; F327-M505 HydrophobicContact CE2-SD 4.47Å; F327-M505 HydrophobicContact CZ-CB 4.48Å; F327-M505 HydrophobicContact CZ-CG 3.53Å; K328-M505 VanDerWaalsContact CA-O 3.26Å; K328-M505 WeakPolarHBondContact CA-O 3.43Å; K328-M505 WeakPolarHBondContact CD-O 3.42Å; D501-M505 PolarHBondContact O-N 3.1Å; D501-M505 VanDerWaalsContact O-N 3.17Å; I502-M505 HydrophobicContact CB-CE 4.28Å; I502-M505 HydrophobicContact CG1-CE 3.84Å; I502-M505 WeakPolarHBondContact O-CA 3.18Å; I502-M505 WeakPolarHBondContact O-CB 3.32Å; I502-M505 PolarHBondContact O-N 2.94Å; E503-M505 VanDerWaalsContact C-N 3.29Å; E503-M505 PolarHBondContact O-N 3.19Å
506	I	96.1	Very high	95.5	Very high	14 Å²	14	62 Å²	62	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-115.7	7.1	-167.4	69.8	171.2	0	0	0	113.6	F112 N329 C332 I502 E508	F112-I506 HydrophobicContact CZ-CD1 4.28Å; N329-I506 WeakPolarHBondContact O-CG2 3.26Å; C332-I506 HydrophobicContact CB-CD1 3.65Å; I502-I506 HydrophobicContact CG2-CD1 3.75Å; I502-I506 HydrophobicContact CG2-CG1 3.82Å; I502-I506 WeakPolarHBondContact O-CG1 3.41Å; I502-I506 PolarHBondContact O-N 3.2Å; I506-E508 HydrophobicContact CD1-CB 4.38Å; I506-E508 HydrophobicContact CG1-CB 4.22Å; I506-E508 PolarHBondContact O-N 3.27Å
507	D	95.1	Very high	95.8	Very high	116 Å²	116	54.2 Å²	54.2	62%	0.62	24%	0.236	S	C	*	.	S	Bend	trans	58.6	16.4	-179	-52.6	-47.7	0	0	0	113.9	K328 E503	K328-D507 IonicContact NZ-OD1 2.76Å; K328-D507 PolarHBondContact NZ-OD1 2.91Å; K328-D507 IonicContact NZ-OD2 3.34Å; E503-D507 WeakPolarHBondContact O-CA 3.48Å; E503-D507 PolarHBondContact O-N 2.8Å
508	E	94	Very high	96.2	Very high	120 Å²	120	52.4 Å²	52.4	56%	0.561	23%	0.228	S	C	*	.	S	Bend	trans	-135	130	178.7	-68.2	-175.7	-179.2	0	0	110.9	I506	I506-E508 HydrophobicContact CD1-CB 4.38Å; I506-E508 HydrophobicContact CG1-CB 4.22Å; I506-E508 PolarHBondContact O-N 3.27Å
509	R	94.5	Very high	96.3	Very high	133 Å²	133	54.8 Å²	54.8	50%	0.502	24%	0.24	S	C	.	.			trans	-76.7	130.6	171.6	-82	-175.8	174.3	137	17.6	110.6	E503 N511	E503-R509 HydrophobicContact CB-CG 3.66Å; E503-R509 VanDerWaalsContact CD-CZ 3.46Å; E503-R509 HydrophobicContact CG-CG 3.74Å; E503-R509 WeakPolarHBondContact OE1-CD 3.38Å; E503-R509 WeakPolarHBondContact OE1-CG 3.21Å; E503-R509 IonicContact OE1-CZ 2.73Å; E503-R509 IonicContact OE1-NE 3.75Å; E503-R509 PolarHBondContact OE1-NE 3.26Å; E503-R509 VanDerWaalsContact OE1-NE 3.09Å; E503-R509 IonicContact OE1-NH1 2.82Å; E503-R509 IonicContact OE1-NH2 2.75Å; E503-R509 PolarHBondContact OE1-NH2 2.9Å; E503-R509 WeakPolarHBondContact OE2-CG 3.35Å; E503-R509 IonicContact OE2-CZ 2.64Å; E503-R509 IonicContact OE2-NE 3.69Å; E503-R509 PolarHBondContact OE2-NE 3.29Å; E503-R509 IonicContact OE2-NH2 3.41Å; E503-R509 PolarHBondContact OE2-NH2 2.88Å; R509-N511 PolarHBondContact O-N 3.39Å
510	P	96.9	Very high	96.3	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.032	25%	0.248	C	C	.	.			trans	-52	126.6	170.3	-27.3	34.7	0	0	0	110.8	F112 R499 I502 W514 W518	F112-P510 HydrophobicContact CE1-CB 4.35Å; F112-P510 HydrophobicContact CE1-CG 4.12Å; F112-P510 HydrophobicContact CZ-CG 4.35Å; R499-P510 HydrophobicContact CB-CG 4.49Å; R499-P510 HydrophobicContact CG-CB 4.18Å; R499-P510 HydrophobicContact CG-CG 4.09Å; R499-P510 PolarHBondContact NE-O 3.46Å; R499-P510 PolarHBondContact NH2-O 3.32Å; I502-P510 HydrophobicContact CB-CG 3.94Å; I502-P510 HydrophobicContact CD1-CG 3.68Å; I502-P510 HydrophobicContact CG1-CG 4.41Å; I502-P510 HydrophobicContact CG2-CG 3.63Å; P510-W514 HydrophobicContact CB-CB 3.9Å; P510-W514 HydrophobicContact CB-CG 4.1Å; P510-W518 HydrophobicContact CB-CH2 4.23Å; P510-W518 HydrophobicContact CB-CZ3 4.05Å; P510-W518 HydrophobicContact CG-CH2 4.23Å; P510-W518 HydrophobicContact CG-CZ3 4.23Å
511	N	96.1	Very high	96.5	Very high	80 Å²	80	56 Å²	56	43%	0.428	25%	0.254	S	S	.	.			trans	-68.8	-170.2	-177.1	68.6	23.5	0	0	0	113.4	R509 Y513 W514 R515	R509-N511 PolarHBondContact O-N 3.39Å; N511-Y513 VanDerWaalsContact C-N 3.32Å; N511-Y513 PolarHBondContact O-N 3.21Å; N511-Y513 WeakPolarHBondContact OD1-CB 3.46Å; N511-Y513 PolarHBondContact OD1-N 3.02Å; N511-W514 VanDerWaalsContact OD1-CD1 3.23Å; N511-W514 PolarHBondContact OD1-N 2.88Å; N511-R515 PolarHBondContact O-N 3.39Å
512	W	96.7	Very high	96.6	Very high	187 Å²	187	56 Å²	56	71%	0.708	25%	0.254	S	S	*	.	H	α-helix	trans	-65.3	-31.4	-178.3	68.9	-93.9	0	0	0	113.6	R515 I516	W512-R515 WeakPolarHBondContact O-CB 3.19Å; W512-R515 PolarHBondContact O-N 3.45Å; W512-I516 HydrophobicContact CE3-CD1 3.7Å; W512-I516 HydrophobicContact CE3-CG1 4.46Å; W512-I516 HydrophobicContact CZ3-CD1 4.08Å; W512-I516 WeakPolarHBondContact O-CG1 3.46Å; W512-I516 PolarHBondContact O-N 2.77Å
513	Y	98.1	Very high	96.6	Very high	47 Å²	47	56.5 Å²	56.5	18%	0.184	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-51.9	-178.8	153.9	-98.7	0	0	0	110.8	I104 N511 R515 I516 C517	I104-Y513 HydrophobicContact CG2-CE2 3.9Å; I104-Y513 PolarHBondContact O-OH 3.19Å; N511-Y513 VanDerWaalsContact C-N 3.32Å; N511-Y513 PolarHBondContact O-N 3.21Å; N511-Y513 WeakPolarHBondContact OD1-CB 3.46Å; N511-Y513 PolarHBondContact OD1-N 3.02Å; Y513-R515 VanDerWaalsContact C-N 3.25Å; Y513-R515 PolarHBondContact O-N 3.26Å; Y513-I516 PolarHBondContact O-N 2.82Å; Y513-C517 WeakPolarHBondContact CE2-SG 3.33Å; Y513-C517 PolarHBondContact O-N 3.38Å; Y513-C517 PolarHBondContact O-SG 3.48Å
514	W	98	Very high	96.7	Very high	16 Å²	16	58 Å²	58	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-42.2	176.7	-58.9	113	0	0	0	111.4	L108 F112 V336 P510 N511 I516 C517 W518	L108-W514 HydrophobicContact CD1-CH2 3.93Å; L108-W514 HydrophobicContact CD1-CZ3 4.45Å; L108-W514 HydrophobicContact CD2-CH2 4Å; L108-W514 HydrophobicContact CD2-CZ3 4.5Å; L108-W514 HydrophobicContact CG-CH2 3.62Å; L108-W514 HydrophobicContact CG-CZ3 3.85Å; F112-W514 HydrophobicContact CB-CE3 4.32Å; F112-W514 HydrophobicContact CB-CH2 3.91Å; F112-W514 HydrophobicContact CB-CZ3 3.7Å; F112-W514 AromaticContact CD1-CD2 3.64Å; F112-W514 HydrophobicContact CD1-CD2 3.64Å; F112-W514 AromaticContact CD1-CE2 3.79Å; F112-W514 AromaticContact CD1-CE3 3.62Å; F112-W514 HydrophobicContact CD1-CE3 3.62Å; F112-W514 HydrophobicContact CD1-CG 4.27Å; F112-W514 AromaticContact CD1-CH2 3.88Å; F112-W514 HydrophobicContact CD1-CH2 3.88Å; F112-W514 AromaticContact CD1-CZ2 3.94Å; F112-W514 HydrophobicContact CD1-CZ2 3.94Å; F112-W514 AromaticContact CD1-CZ3 3.74Å; F112-W514 HydrophobicContact CD1-CZ3 3.74Å; F112-W514 HydrophobicContact CE1-CD2 4.07Å; F112-W514 HydrophobicContact CE1-CE3 4.48Å; F112-W514 HydrophobicContact CE1-CG 4.29Å; F112-W514 HydrophobicContact CE1-CZ2 4.48Å; F112-W514 HydrophobicContact CG-CE3 4.45Å; F112-W514 HydrophobicContact CG-CH2 4.2Å; F112-W514 HydrophobicContact CG-CZ3 4.16Å; V336-W514 HydrophobicContact CG2-CH2 4.19Å; V336-W514 HydrophobicContact CG2-CZ2 4.17Å; P510-W514 HydrophobicContact CB-CB 3.9Å; P510-W514 HydrophobicContact CB-CG 4.1Å; N511-W514 VanDerWaalsContact OD1-CD1 3.23Å; N511-W514 PolarHBondContact OD1-N 2.88Å; W514-I516 PolarHBondContact O-N 2.92Å; W514-C517 PolarHBondContact O-N 3.33Å; W514-W518 HydrophobicContact CB-CD2 4.37Å; W514-W518 HydrophobicContact CB-CE3 4.09Å; W514-W518 HydrophobicContact CB-CH2 4.04Å; W514-W518 HydrophobicContact CB-CZ2 4.28Å; W514-W518 HydrophobicContact CB-CZ3 3.94Å; W514-W518 HydrophobicContact CE3-CZ2 4.2Å; W514-W518 WeakPolarHBondContact O-CB 3.14Å; W514-W518 VanDerWaalsContact O-CD2 3.29Å; W514-W518 VanDerWaalsContact O-CG 3.26Å; W514-W518 PolarHBondContact O-N 2.69Å
515	R	97.9	Very high	96.8	Very high	120 Å²	120	58.6 Å²	58.6	45%	0.453	27%	0.269	S	S	.	.	H	α-helix	trans	-59.9	-48.1	179.1	-177.4	-174.2	175.8	-172.1	-4.4	112.2	L495 N511 W512 Y513 L519	L495-R515 HydrophobicContact CD2-CB 4.43Å; L495-R515 HydrophobicContact CD2-CG 3.74Å; N511-R515 PolarHBondContact O-N 3.39Å; W512-R515 WeakPolarHBondContact O-CB 3.19Å; W512-R515 PolarHBondContact O-N 3.45Å; Y513-R515 VanDerWaalsContact C-N 3.25Å; Y513-R515 PolarHBondContact O-N 3.26Å; R515-L519 WeakPolarHBondContact O-CB 3.22Å; R515-L519 PolarHBondContact O-N 2.98Å; R515-L519 VanDerWaalsContact O-N 3.1Å
516	I	98.1	Very high	96.8	Very high	68 Å²	68	58.6 Å²	58.6	35%	0.349	27%	0.269	S	S	.	.	H	α-helix	trans	-71.1	-37.7	-178.7	-64	180	0	0	0	110.6	W512 Y513 W514 V520 F521	W512-I516 HydrophobicContact CE3-CD1 3.7Å; W512-I516 HydrophobicContact CE3-CG1 4.46Å; W512-I516 HydrophobicContact CZ3-CD1 4.08Å; W512-I516 WeakPolarHBondContact O-CG1 3.46Å; W512-I516 PolarHBondContact O-N 2.77Å; Y513-I516 PolarHBondContact O-N 2.82Å; W514-I516 PolarHBondContact O-N 2.92Å; I516-V520 HydrophobicContact CG2-CB 4.42Å; I516-V520 WeakPolarHBondContact O-CA 3.11Å; I516-V520 WeakPolarHBondContact O-CB 3.28Å; I516-V520 PolarHBondContact O-N 3.46Å; I516-F521 HydrophobicContact CG2-CD2 3.67Å; I516-F521 HydrophobicContact CG2-CE2 3.46Å; I516-F521 VanDerWaalsContact CG2-CE2 3.46Å; I516-F521 HydrophobicContact CG2-CZ 4.46Å; I516-F521 PolarHBondContact O-N 2.92Å
517	C	98.4	Very high	96.8	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.014	29%	0.288	C	S	.	.	I	π-helix	trans	-61.3	-55	177.5	-66.2	0	0	0	0	111.4	P109 Y513 W514 L519 V520 F521 T522	P109-C517 HydrophobicContact CB-CB 3.71Å; P109-C517 HydrophobicContact CG-CB 3.46Å; P109-C517 VanDerWaalsContact CG-CB 3.46Å; Y513-C517 WeakPolarHBondContact CE2-SG 3.33Å; Y513-C517 PolarHBondContact O-N 3.38Å; Y513-C517 PolarHBondContact O-SG 3.48Å; W514-C517 PolarHBondContact O-N 3.33Å; C517-L519 VanDerWaalsContact C-N 3.33Å; C517-L519 PolarHBondContact O-N 3.45Å; C517-V520 PolarHBondContact O-N 2.89Å; C517-F521 PolarHBondContact O-N 3.37Å; C517-T522 VanDerWaalsContact O-CB 3.3Å; C517-T522 WeakPolarHBondContact O-CB 3.45Å; C517-T522 PolarHBondContact O-N 2.9Å; C517-T522 PolarHBondContact O-OG1 3.02Å
518	W	98.3	Very high	96.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-66.2	-32.9	-177.8	-61.8	-33.7	0	0	0	114	P109 F112 L113 C490 L495 F498 R499 I502 P510 W514	P109-W518 PolarHBondContact O-NE1 3.27Å; F112-W518 HydrophobicContact CB-CZ2 4.44Å; F112-W518 AromaticContact CD1-CH2 3.67Å; F112-W518 HydrophobicContact CD1-CH2 3.67Å; F112-W518 AromaticContact CD1-CZ2 3.44Å; F112-W518 HydrophobicContact CD1-CZ2 3.44Å; F112-W518 VanDerWaalsContact CD1-CZ2 3.44Å; F112-W518 AromaticContact CE1-CH2 3.65Å; F112-W518 HydrophobicContact CE1-CH2 3.65Å; F112-W518 AromaticContact CE1-CZ2 3.95Å; F112-W518 HydrophobicContact CE1-CZ2 3.95Å; F112-W518 HydrophobicContact CG-CZ2 4.14Å; L113-W518 HydrophobicContact CB-CZ2 4.07Å; L113-W518 HydrophobicContact CD1-CD2 4.27Å; L113-W518 HydrophobicContact CD1-CG 4.04Å; C490-W518 VanDerWaalsContact SG-CB 3.59Å; C490-W518 PolarHBondContact SG-O 3.27Å; L495-W518 HydrophobicContact CD1-CE3 3.59Å; L495-W518 HydrophobicContact CD1-CZ3 4.12Å; F498-W518 HydrophobicContact CD1-CZ3 4.44Å; F498-W518 HydrophobicContact CE1-CH2 4.41Å; R499-W518 HydrophobicContact CG-CZ3 4.47Å; I502-W518 HydrophobicContact CD1-CH2 3.77Å; I502-W518 HydrophobicContact CD1-CZ3 4.21Å; P510-W518 HydrophobicContact CB-CH2 4.23Å; P510-W518 HydrophobicContact CB-CZ3 4.05Å; P510-W518 HydrophobicContact CG-CH2 4.23Å; P510-W518 HydrophobicContact CG-CZ3 4.23Å; W514-W518 HydrophobicContact CB-CD2 4.37Å; W514-W518 HydrophobicContact CB-CE3 4.09Å; W514-W518 HydrophobicContact CB-CH2 4.04Å; W514-W518 HydrophobicContact CB-CZ2 4.28Å; W514-W518 HydrophobicContact CB-CZ3 3.94Å; W514-W518 HydrophobicContact CE3-CZ2 4.2Å; W514-W518 WeakPolarHBondContact O-CB 3.14Å; W514-W518 VanDerWaalsContact O-CD2 3.29Å; W514-W518 VanDerWaalsContact O-CG 3.26Å; W514-W518 PolarHBondContact O-N 2.69Å
519	L	97.4	Very high	96.6	Very high	52 Å²	52	57.4 Å²	57.4	27%	0.272	26%	0.261	S	S	.	.	I	π-helix	trans	-85.3	-27.3	-179.2	-167.9	71.7	0	0	0	112.9	Y491 L495 R515 C517	Y491-L519 HydrophobicContact CD1-CD1 4.34Å; Y491-L519 HydrophobicContact CE1-CD1 3.69Å; Y491-L519 HydrophobicContact CE2-CD1 4.17Å; Y491-L519 PolarHBondContact OH-O 3.4Å; L495-L519 HydrophobicContact CD2-CB 4.11Å; L495-L519 HydrophobicContact CD2-CD1 4.39Å; R515-L519 WeakPolarHBondContact O-CB 3.22Å; R515-L519 PolarHBondContact O-N 2.98Å; R515-L519 VanDerWaalsContact O-N 3.1Å; C517-L519 VanDerWaalsContact C-N 3.33Å; C517-L519 PolarHBondContact O-N 3.45Å
520	V	97.1	Very high	96.6	Very high	58 Å²	58	52.1 Å²	52.1	35%	0.352	24%	0.242	S	C	.	.	I	π-helix	trans	-131	-66.5	-169.1	-175.2	0	0	0	0	111.2	I516 C517 P523 I524	I516-V520 HydrophobicContact CG2-CB 4.42Å; I516-V520 WeakPolarHBondContact O-CA 3.11Å; I516-V520 WeakPolarHBondContact O-CB 3.28Å; I516-V520 PolarHBondContact O-N 3.46Å; C517-V520 PolarHBondContact O-N 2.89Å; V520-P523 WeakPolarHBondContact O-CD 3.2Å; V520-P523 WeakPolarHBondContact O-CG 3.38Å; V520-I524 HydrophobicContact CG1-CD1 3.65Å; V520-I524 VanDerWaalsContact O-CB 3.28Å; V520-I524 WeakPolarHBondContact O-CB 3.28Å; V520-I524 WeakPolarHBondContact O-CD1 3.5Å; V520-I524 WeakPolarHBondContact O-CG1 3.45Å; V520-I524 PolarHBondContact O-N 3.36Å
521	F	97.3	Very high	96.4	Very high	90 Å²	90	55 Å²	55	40%	0.395	26%	0.256	S	S	.	.	I	π-helix	trans	-65.6	-51.7	-168.7	-70.1	-64.4	0	0	0	113	L105 I516 C517 I524 I525	L105-F521 HydrophobicContact CB-CB 4.5Å; L105-F521 HydrophobicContact CD2-CD2 4.08Å; L105-F521 HydrophobicContact CD2-CE2 4.43Å; L105-F521 HydrophobicContact CD2-CG 4.16Å; I516-F521 HydrophobicContact CG2-CD2 3.67Å; I516-F521 HydrophobicContact CG2-CE2 3.46Å; I516-F521 VanDerWaalsContact CG2-CE2 3.46Å; I516-F521 HydrophobicContact CG2-CZ 4.46Å; I516-F521 PolarHBondContact O-N 2.92Å; C517-F521 PolarHBondContact O-N 3.37Å; F521-I524 PolarHBondContact O-N 3.03Å; F521-I525 HydrophobicContact CB-CD1 4.23Å; F521-I525 VanDerWaalsContact O-CB 3.3Å; F521-I525 WeakPolarHBondContact O-CB 3.46Å; F521-I525 WeakPolarHBondContact O-CD1 3.15Å; F521-I525 WeakPolarHBondContact O-CG1 3.15Å; F521-I525 PolarHBondContact O-N 2.74Å
522	T	97.5	Very high	96	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.1	-55.3	-176.9	-53.4	0	0	0	0	112.2	L105 L106 L110 T486 C517 I524 I525 C526	L105-T522 PolarHBondContact O-OG1 3.38Å; L105-T522 VanDerWaalsContact O-OG1 3.11Å; L106-T522 HydrophobicContact CD1-CG2 3.98Å; L110-T522 HydrophobicContact CD1-CG2 4.06Å; L110-T522 HydrophobicContact CD2-CG2 3.6Å; L110-T522 HydrophobicContact CG-CG2 3.64Å; T486-T522 HydrophobicContact CG2-CG2 3.74Å; C517-T522 VanDerWaalsContact O-CB 3.3Å; C517-T522 WeakPolarHBondContact O-CB 3.45Å; C517-T522 PolarHBondContact O-N 2.9Å; C517-T522 PolarHBondContact O-OG1 3.02Å; T522-I524 PolarHBondContact O-N 2.96Å; T522-I525 PolarHBondContact O-N 3.11Å; T522-C526 PolarHBondContact O-N 3.47Å; T522-C526 PolarHBondContact O-SG 3.4Å
523	P	97	Very high	95.5	Very high	11 Å²	11	45.3 Å²	45.3	7%	0.071	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-38	179.6	24.3	-33.9	0	0	0	113.1	L483 V520 F527	L483-P523 HydrophobicContact CD1-CB 3.89Å; L483-P523 WeakPolarHBondContact CD1-O 3.47Å; V520-P523 WeakPolarHBondContact O-CD 3.2Å; V520-P523 WeakPolarHBondContact O-CG 3.38Å; P523-F527 WeakPolarHBondContact O-CB 3.41Å; P523-F527 PolarHBondContact O-N 3.02Å
524	I	97.2	Very high	95	Very high	88 Å²	88	48.7 Å²	48.7	45%	0.451	24%	0.235	S	C	.	.	H	α-helix	trans	-65.6	-45.8	178	-69.3	174.1	0	0	0	110.8	V520 F521 T522 F527 L528	V520-I524 HydrophobicContact CG1-CD1 3.65Å; V520-I524 VanDerWaalsContact O-CB 3.28Å; V520-I524 WeakPolarHBondContact O-CB 3.28Å; V520-I524 WeakPolarHBondContact O-CD1 3.5Å; V520-I524 WeakPolarHBondContact O-CG1 3.45Å; V520-I524 PolarHBondContact O-N 3.36Å; F521-I524 PolarHBondContact O-N 3.03Å; T522-I524 PolarHBondContact O-N 2.96Å; I524-F527 PolarHBondContact O-N 3.38Å; I524-L528 HydrophobicContact CG2-CD1 3.84Å; I524-L528 HydrophobicContact CG2-CG 4.22Å; I524-L528 WeakPolarHBondContact O-CB 3.42Å; I524-L528 VanDerWaalsContact O-CG 3.28Å; I524-L528 WeakPolarHBondContact O-CG 3.35Å; I524-L528 PolarHBondContact O-N 3.25Å
525	I	95.6	Very high	94.6	Very high	24 Å²	24	53.3 Å²	53.3	12%	0.123	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-46.6	178.5	-69.4	167.2	0	0	0	110	M102 L105 L106 F521 T522 F527 L528 L529	M102-I525 HydrophobicContact CE-CG2 4.31Å; M102-I525 HydrophobicContact SD-CG2 3.97Å; L105-I525 HydrophobicContact CB-CD1 3.73Å; L105-I525 HydrophobicContact CD1-CD1 4.28Å; L106-I525 HydrophobicContact CD1-CG2 4.2Å; L106-I525 HydrophobicContact CD2-CG2 3.89Å; L106-I525 HydrophobicContact CG-CG2 4.48Å; F521-I525 HydrophobicContact CB-CD1 4.23Å; F521-I525 VanDerWaalsContact O-CB 3.3Å; F521-I525 WeakPolarHBondContact O-CB 3.46Å; F521-I525 WeakPolarHBondContact O-CD1 3.15Å; F521-I525 WeakPolarHBondContact O-CG1 3.15Å; F521-I525 PolarHBondContact O-N 2.74Å; T522-I525 PolarHBondContact O-N 3.11Å; I525-F527 VanDerWaalsContact C-N 3.33Å; I525-F527 PolarHBondContact O-N 2.9Å; I525-L528 PolarHBondContact O-N 3.14Å; I525-L529 HydrophobicContact CG2-CD1 3.73Å; I525-L529 HydrophobicContact CG2-CG 4.21Å; I525-L529 WeakPolarHBondContact O-CB 3.33Å; I525-L529 VanDerWaalsContact O-CG 3.25Å; I525-L529 WeakPolarHBondContact O-CG 3.22Å; I525-L529 PolarHBondContact O-N 3.41Å
526	C	95.7	Very high	94	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-47	175.4	-70.6	0	0	0	0	111.8	L483 T522 L529 I530	L483-C526 HydrophobicContact CB-CB 4.17Å; L483-C526 HydrophobicContact CD1-CB 4.43Å; T522-C526 PolarHBondContact O-N 3.47Å; T522-C526 PolarHBondContact O-SG 3.4Å; C526-L529 PolarHBondContact O-N 3.42Å; C526-I530 WeakPolarHBondContact O-CD1 3.27Å; C526-I530 VanDerWaalsContact O-CG1 3.26Å; C526-I530 WeakPolarHBondContact O-CG1 3.14Å; C526-I530 PolarHBondContact O-N 3Å
527	F	95.8	Very high	93	Very high	110 Å²	110	54.6 Å²	54.6	48%	0.482	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-45.6	178.5	-179.5	-104.6	0	0	0	112.5	L483 P523 I524 I525 I530 I531	L483-F527 HydrophobicContact CD2-CB 4.46Å; L483-F527 HydrophobicContact CD2-CD2 4.32Å; P523-F527 WeakPolarHBondContact O-CB 3.41Å; P523-F527 PolarHBondContact O-N 3.02Å; I524-F527 PolarHBondContact O-N 3.38Å; I525-F527 VanDerWaalsContact C-N 3.33Å; I525-F527 PolarHBondContact O-N 2.9Å; F527-I530 PolarHBondContact O-N 3.38Å; F527-I531 HydrophobicContact CD1-CD1 3.83Å; F527-I531 HydrophobicContact CE1-CD1 3.28Å; F527-I531 HydrophobicContact CE1-CG1 4.45Å; F527-I531 HydrophobicContact CE2-CD1 4.16Å; F527-I531 HydrophobicContact CG-CD1 4.47Å; F527-I531 HydrophobicContact CZ-CD1 3.48Å; F527-I531 VanDerWaalsContact CZ-CD1 3.48Å; F527-I531 HydrophobicContact CZ-CG1 4.43Å; F527-I531 WeakPolarHBondContact O-CG1 3.2Å; F527-I531 PolarHBondContact O-N 2.82Å
528	L	94	Very high	92.2	Very high	100 Å²	100	60.6 Å²	60.6	52%	0.524	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-38.2	177.7	-69	177.3	0	0	0	112.3	I524 I525 I531 S532	I524-L528 HydrophobicContact CG2-CD1 3.84Å; I524-L528 HydrophobicContact CG2-CG 4.22Å; I524-L528 WeakPolarHBondContact O-CB 3.42Å; I524-L528 VanDerWaalsContact O-CG 3.28Å; I524-L528 WeakPolarHBondContact O-CG 3.35Å; I524-L528 PolarHBondContact O-N 3.25Å; I525-L528 PolarHBondContact O-N 3.14Å; L528-I531 PolarHBondContact O-N 2.96Å; L528-S532 VanDerWaalsContact O-CB 3.27Å; L528-S532 WeakPolarHBondContact O-CB 3.5Å; L528-S532 PolarHBondContact O-N 3.32Å
529	L	92.1	Very high	91.6	Very high	15 Å²	15	66.8 Å²	66.8	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-41	176	-72.4	171.1	0	0	0	111.8	L106 A301 A304 L479 I525 C526 S532 I533	L106-L529 HydrophobicContact CD2-CD1 4.11Å; A301-L529 HydrophobicContact CB-CD2 4.1Å; A304-L529 HydrophobicContact CB-CD1 3.38Å; A304-L529 HydrophobicContact CB-CD2 4.01Å; A304-L529 HydrophobicContact CB-CG 4.35Å; L479-L529 HydrophobicContact CD1-CB 3.64Å; L479-L529 HydrophobicContact CD2-CB 4.44Å; L479-L529 HydrophobicContact CD2-CD1 4.04Å; I525-L529 HydrophobicContact CG2-CD1 3.73Å; I525-L529 HydrophobicContact CG2-CG 4.21Å; I525-L529 WeakPolarHBondContact O-CB 3.33Å; I525-L529 VanDerWaalsContact O-CG 3.25Å; I525-L529 WeakPolarHBondContact O-CG 3.22Å; I525-L529 PolarHBondContact O-N 3.41Å; C526-L529 PolarHBondContact O-N 3.42Å; L529-S532 PolarHBondContact O-N 3.07Å; L529-I533 VanDerWaalsContact O-CG1 3.28Å; L529-I533 WeakPolarHBondContact O-CG1 3.26Å; L529-I533 PolarHBondContact O-N 3.2Å
530	I	93	Very high	91.2	Very high	22 Å²	22	66.5 Å²	66.5	11%	0.113	34%	0.337	C	S	.	.	H	α-helix	trans	-58.6	-50.3	173.9	-68.6	162.1	0	0	0	109.8	L479 V480 L483 C526 F527 S532 I533 F534	L479-I530 HydrophobicContact CB-CD1 4.01Å; L479-I530 HydrophobicContact CB-CG1 3.63Å; L479-I530 HydrophobicContact CD1-CG1 4.13Å; V480-I530 HydrophobicContact CG2-CD1 3.83Å; V480-I530 HydrophobicContact CG2-CG1 4.4Å; L483-I530 HydrophobicContact CD2-CD1 4.09Å; C526-I530 WeakPolarHBondContact O-CD1 3.27Å; C526-I530 VanDerWaalsContact O-CG1 3.26Å; C526-I530 WeakPolarHBondContact O-CG1 3.14Å; C526-I530 PolarHBondContact O-N 3Å; F527-I530 PolarHBondContact O-N 3.38Å; I530-S532 VanDerWaalsContact C-N 3.34Å; I530-S532 PolarHBondContact O-N 2.98Å; I530-I533 PolarHBondContact O-N 3.32Å; I530-F534 HydrophobicContact CG2-CD2 4.05Å; I530-F534 HydrophobicContact CG2-CE2 3.89Å; I530-F534 WeakPolarHBondContact O-CD2 3.22Å; I530-F534 PolarHBondContact O-N 3.35Å
531	I	92.5	Very high	90.9	Very high	64 Å²	64	67.6 Å²	67.6	33%	0.328	34%	0.337	S	S	.	.	H	α-helix	trans	-59.6	-45.5	177.5	-69.8	174.6	0	0	0	111.1	F527 L528 I533 F534 I535	F527-I531 HydrophobicContact CD1-CD1 3.83Å; F527-I531 HydrophobicContact CE1-CD1 3.28Å; F527-I531 HydrophobicContact CE1-CG1 4.45Å; F527-I531 HydrophobicContact CE2-CD1 4.16Å; F527-I531 HydrophobicContact CG-CD1 4.47Å; F527-I531 HydrophobicContact CZ-CD1 3.48Å; F527-I531 VanDerWaalsContact CZ-CD1 3.48Å; F527-I531 HydrophobicContact CZ-CG1 4.43Å; F527-I531 WeakPolarHBondContact O-CG1 3.2Å; F527-I531 PolarHBondContact O-N 2.82Å; L528-I531 PolarHBondContact O-N 2.96Å; I531-I533 VanDerWaalsContact C-N 3.34Å; I531-I533 PolarHBondContact O-N 2.81Å; I531-F534 PolarHBondContact O-N 3.17Å; I531-F534 VanDerWaalsContact O-N 3.12Å; I531-I535 HydrophobicContact CG2-CD1 3.42Å; I531-I535 VanDerWaalsContact CG2-CD1 3.42Å; I531-I535 HydrophobicContact CG2-CG1 4.08Å; I531-I535 WeakPolarHBondContact O-CG1 3.47Å; I531-I535 PolarHBondContact O-N 3.09Å
532	S	89.2	Confident	90.4	Very high	16 Å²	16	66 Å²	66	11%	0.112	33%	0.331	C	S	.	.	H	α-helix	trans	-58	-44.8	179.5	-173.5	0	0	0	0	111.8	L528 L529 I530 F534 I535 Y536	L528-S532 VanDerWaalsContact O-CB 3.27Å; L528-S532 WeakPolarHBondContact O-CB 3.5Å; L528-S532 PolarHBondContact O-N 3.32Å; L529-S532 PolarHBondContact O-N 3.07Å; I530-S532 VanDerWaalsContact C-N 3.34Å; I530-S532 PolarHBondContact O-N 2.98Å; S532-F534 VanDerWaalsContact C-N 3.27Å; S532-F534 PolarHBondContact O-N 2.81Å; S532-I535 PolarHBondContact O-N 3.31Å; S532-Y536 WeakPolarHBondContact O-CB 3.3Å; S532-Y536 WeakPolarHBondContact O-CD2 3.37Å; S532-Y536 PolarHBondContact O-N 3.32Å; S532-Y536 WeakPolarHBondContact OG-CD2 3.12Å
533	I	86.7	Confident	89.7	Confident	48 Å²	48	69.4 Å²	69.4	25%	0.246	37%	0.366	C	S	.	.	H	α-helix	trans	-59.4	-37.9	177.4	-71.6	166.7	0	0	0	111.4	L479 L529 I530 I531 S537	L479-I533 HydrophobicContact CD1-CD1 3.54Å; L529-I533 VanDerWaalsContact O-CG1 3.28Å; L529-I533 WeakPolarHBondContact O-CG1 3.26Å; L529-I533 PolarHBondContact O-N 3.2Å; I530-I533 PolarHBondContact O-N 3.32Å; I531-I533 VanDerWaalsContact C-N 3.34Å; I531-I533 PolarHBondContact O-N 2.81Å; I533-S537 VanDerWaalsContact O-CB 3.29Å; I533-S537 WeakPolarHBondContact O-CB 3.3Å; I533-S537 PolarHBondContact O-N 3.38Å
534	F	87.6	Confident	89.2	Confident	118 Å²	118	77.1 Å²	77.1	52%	0.518	41%	0.406	S	S	.	.	H	α-helix	trans	-79.2	-30.3	178.3	-75.8	-70.2	0	0	0	113.9	Y476 I530 I531 S532	Y476-F534 HydrophobicContact CD1-CE2 4.34Å; Y476-F534 AromaticContact CD1-CZ 3.83Å; Y476-F534 HydrophobicContact CD1-CZ 3.83Å; Y476-F534 HydrophobicContact CE1-CZ 4.05Å; Y476-F534 HydrophobicContact CG-CE2 4.29Å; Y476-F534 HydrophobicContact CG-CZ 4.14Å; I530-F534 HydrophobicContact CG2-CD2 4.05Å; I530-F534 HydrophobicContact CG2-CE2 3.89Å; I530-F534 WeakPolarHBondContact O-CD2 3.22Å; I530-F534 PolarHBondContact O-N 3.35Å; I531-F534 PolarHBondContact O-N 3.17Å; I531-F534 VanDerWaalsContact O-N 3.12Å; S532-F534 VanDerWaalsContact C-N 3.27Å; S532-F534 PolarHBondContact O-N 2.81Å
535	I	89.4	Confident	88.9	Confident	114 Å²	114	74 Å²	74	59%	0.585	39%	0.389	S	S	*	.	H	α-helix	trans	-80.3	-43	179.6	-68.3	178.6	0	0	0	111.5	I531 S532	I531-I535 HydrophobicContact CG2-CD1 3.42Å; I531-I535 VanDerWaalsContact CG2-CD1 3.42Å; I531-I535 HydrophobicContact CG2-CG1 4.08Å; I531-I535 WeakPolarHBondContact O-CG1 3.47Å; I531-I535 PolarHBondContact O-N 3.09Å; S532-I535 PolarHBondContact O-N 3.31Å
536	Y	83.8	Confident	88.9	Confident	129 Å²	129	76.3 Å²	76.3	51%	0.506	40%	0.404	S	S	.	.	S	Bend	trans	-102.4	18.9	-174.2	-60.1	-71.8	0	0	0	113	P297 S532 T538	P297-Y536 HydrophobicContact CB-CD2 4.47Å; P297-Y536 HydrophobicContact CB-CE2 4.17Å; P297-Y536 HydrophobicContact CG-CE2 4.21Å; S532-Y536 WeakPolarHBondContact O-CB 3.3Å; S532-Y536 WeakPolarHBondContact O-CD2 3.37Å; S532-Y536 PolarHBondContact O-N 3.32Å; S532-Y536 WeakPolarHBondContact OG-CD2 3.12Å; Y536-T538 PolarHBondContact O-N 2.86Å; Y536-T538 VanDerWaalsContact O-N 3.09Å
537	S	77.6	Confident	88.9	Confident	86 Å²	86	76.7 Å²	76.7	60%	0.601	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-60.5	116.2	177.5	58.7	0	0	0	0	110.5	I533	I533-S537 VanDerWaalsContact O-CB 3.29Å; I533-S537 WeakPolarHBondContact O-CB 3.3Å; I533-S537 PolarHBondContact O-N 3.38Å
538	T	81.7	Confident	88.9	Confident	127 Å²	127	73 Å²	73	78%	0.779	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-77.8	157.1	166.8	56.2	0	0	0	0	110.2	Y536 F540	Y536-T538 PolarHBondContact O-N 2.86Å; Y536-T538 VanDerWaalsContact O-N 3.09Å; T538-F540 PolarHBondContact O-N 2.8Å
539	E	85.3	Confident	89	Confident	130 Å²	130	74.4 Å²	74.4	61%	0.607	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-57.8	128.7	174	-162.4	-179.3	165.4	0	0	109.7	K541	E539-K541 HydrophobicContact CG-CG 4.33Å; E539-K541 PolarHBondContact O-N 3.49Å; E539-K541 WeakPolarHBondContact OE1-CE 3.23Å; E539-K541 IonicContact OE1-NZ 3.48Å; E539-K541 PolarHBondContact OE1-NZ 2.83Å; E539-K541 VanDerWaalsContact OE1-NZ 3.11Å; E539-K541 WeakPolarHBondContact OE2-CE 3.44Å; E539-K541 IonicContact OE2-NZ 2.72Å; E539-K541 PolarHBondContact OE2-NZ 3.02Å
540	F	90.2	Very high	89.2	Confident	47 Å²	47	80.4 Å²	80.4	21%	0.206	42%	0.418	C	S	.	.			trans	-75.1	107	-178	-175	-106.3	0	0	0	109.7	S467 I468 T538 Y547 L552	S467-F540 WeakPolarHBondContact OG-CZ 3.43Å; I468-F540 HydrophobicContact CG1-CE1 3.98Å; I468-F540 HydrophobicContact CG1-CZ 4.49Å; T538-F540 PolarHBondContact O-N 2.8Å; F540-Y547 AromaticContact CD1-CD2 3.6Å; F540-Y547 HydrophobicContact CD1-CD2 3.6Å; F540-Y547 AromaticContact CD1-CE2 3.57Å; F540-Y547 HydrophobicContact CD1-CE2 3.57Å; F540-Y547 HydrophobicContact CD1-CG 4.13Å; F540-Y547 HydrophobicContact CE1-CD1 4.36Å; F540-Y547 AromaticContact CE1-CD2 3.86Å; F540-Y547 HydrophobicContact CE1-CD2 3.86Å; F540-Y547 AromaticContact CE1-CE1 3.96Å; F540-Y547 HydrophobicContact CE1-CE1 3.96Å; F540-Y547 AromaticContact CE1-CE2 3.4Å; F540-Y547 HydrophobicContact CE1-CE2 3.4Å; F540-Y547 VanDerWaalsContact CE1-CE2 3.4Å; F540-Y547 HydrophobicContact CE1-CG 4.32Å; F540-Y547 AromaticContact CE1-CZ 3.46Å; F540-Y547 VanDerWaalsContact CE1-CZ 3.46Å; F540-Y547 HydrophobicContact CZ-CE2 4.29Å; F540-Y547 WeakPolarHBondContact O-CD2 3.45Å; F540-L552 HydrophobicContact CB-CD2 4.35Å; F540-L552 HydrophobicContact CD1-CD2 4.15Å
541	K	89.8	Confident	89.3	Confident	81 Å²	81	79.3 Å²	79.3	35%	0.352	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	156.8	-177	-66.5	-166.7	-174.5	175.1	0	111.8	E539 Y545 T546	E539-K541 HydrophobicContact CG-CG 4.33Å; E539-K541 PolarHBondContact O-N 3.49Å; E539-K541 WeakPolarHBondContact OE1-CE 3.23Å; E539-K541 IonicContact OE1-NZ 3.48Å; E539-K541 PolarHBondContact OE1-NZ 2.83Å; E539-K541 VanDerWaalsContact OE1-NZ 3.11Å; E539-K541 WeakPolarHBondContact OE2-CE 3.44Å; E539-K541 IonicContact OE2-NZ 2.72Å; E539-K541 PolarHBondContact OE2-NZ 3.02Å; K541-Y545 WeakPolarHBondContact CB-O 3.3Å; K541-T546 VanDerWaalsContact CE-OG1 3.28Å; K541-T546 WeakPolarHBondContact CE-OG1 3.27Å; K541-T546 PolarHBondContact NZ-OG1 3.36Å
542	E	86.7	Confident	89.5	Confident	56 Å²	56	78.5 Å²	78.5	26%	0.262	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	102.4	170.9	-73.5	-65.8	161.6	0	0	108.8	Y463 Y464 S467 N544 Y545 Y547	Y463-E542 HydrophobicContact CE1-CG 4.32Å; Y463-E542 PolarHBondContact OH-OE2 3.32Å; Y464-E542 HydrophobicContact CD1-CB 4.34Å; Y464-E542 HydrophobicContact CD1-CG 4.37Å; Y464-E542 HydrophobicContact CE1-CB 4.14Å; S467-E542 WeakPolarHBondContact CB-OE1 3.34Å; S467-E542 PolarHBondContact OG-OE1 3.27Å; E542-N544 PolarHBondContact O-N 2.89Å; E542-Y545 PolarHBondContact N-O 3.49Å; E542-Y545 WeakPolarHBondContact O-CB 3.29Å; E542-Y545 PolarHBondContact O-N 3.38Å; E542-Y547 HydrophobicContact CG-CE2 4.01Å; E542-Y547 VanDerWaalsContact CG-OH 3.3Å; E542-Y547 WeakPolarHBondContact CG-OH 3.5Å
543	G	83.2	Confident	89.8	Confident	71 Å²	71	81.9 Å²	81.9	73%	0.732	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	-120.5	-172.3	0	0	0	0	0	111.7
544	N	86	Confident	90.3	Very high	173 Å²	173	83.8 Å²	83.8	93%	0.925	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-7	177.6	-67.5	-18.3	0	0	0	113.6	E542	E542-N544 PolarHBondContact O-N 2.89Å
545	Y	92.1	Very high	90.7	Very high	24 Å²	24	80.5 Å²	80.5	9%	0.094	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	130.5	-178	172.8	-102.3	0	0	0	111.2	S217 L219 E220 Y464 K541 E542 Y547 P548	S217-Y545 WeakPolarHBondContact O-CD2 3.32Å; L219-Y545 VanDerWaalsContact CB-OH 3.3Å; L219-Y545 WeakPolarHBondContact CB-OH 3.38Å; L219-Y545 PolarHBondContact N-OH 2.93Å; E220-Y545 PolarHBondContact OE2-OH 3.01Å; Y464-Y545 AromaticContact CD1-CD1 3.51Å; Y464-Y545 HydrophobicContact CD1-CD1 3.51Å; Y464-Y545 AromaticContact CD1-CE1 3.54Å; Y464-Y545 HydrophobicContact CD1-CE1 3.54Å; Y464-Y545 HydrophobicContact CD1-CG 4.33Å; Y464-Y545 AromaticContact CE1-CD1 3.32Å; Y464-Y545 HydrophobicContact CE1-CD1 3.32Å; Y464-Y545 HydrophobicContact CE1-CD2 4.46Å; Y464-Y545 AromaticContact CE1-CE1 3.76Å; Y464-Y545 HydrophobicContact CE1-CE1 3.76Å; Y464-Y545 AromaticContact CE1-CG 3.7Å; Y464-Y545 HydrophobicContact CE1-CG 3.7Å; Y464-Y545 HydrophobicContact CG-CD1 4.42Å; Y464-Y545 HydrophobicContact CG-CE1 4.04Å; K541-Y545 WeakPolarHBondContact CB-O 3.3Å; E542-Y545 PolarHBondContact N-O 3.49Å; E542-Y545 WeakPolarHBondContact O-CB 3.29Å; E542-Y545 PolarHBondContact O-N 3.38Å; Y545-Y547 HydrophobicContact CD1-CD2 4.13Å; Y545-Y547 HydrophobicContact CD1-CE2 4.09Å; Y545-Y547 HydrophobicContact CD1-CG 4.45Å; Y545-Y547 AromaticContact CE1-CD1 3.78Å; Y545-Y547 HydrophobicContact CE1-CD1 3.78Å; Y545-Y547 AromaticContact CE1-CD2 3.9Å; Y545-Y547 HydrophobicContact CE1-CD2 3.9Å; Y545-Y547 AromaticContact CE1-CE1 3.93Å; Y545-Y547 HydrophobicContact CE1-CE1 3.93Å; Y545-Y547 HydrophobicContact CE1-CE2 4.04Å; Y545-Y547 AromaticContact CE1-CG 3.77Å; Y545-Y547 HydrophobicContact CE1-CG 3.77Å; Y545-P548 WeakPolarHBondContact OH-CD 3.21Å
546	T	94.7	Very high	90.9	Very high	71 Å²	71	79 Å²	79	44%	0.436	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.9	175.9	-57.2	0	0	0	0	108.8	K541	K541-T546 VanDerWaalsContact CE-OG1 3.28Å; K541-T546 WeakPolarHBondContact CE-OG1 3.27Å; K541-T546 PolarHBondContact NZ-OG1 3.36Å
547	Y	95.8	Very high	91.5	Very high	8 Å²	8	77.2 Å²	77.2	3%	0.031	40%	0.404	C	S	.	.			trans	-67.3	139.8	-176.2	-75.3	-99.1	0	0	0	112	Y464 S467 I468 F540 E542 Y545 A551 L552	Y464-Y547 HydrophobicContact CD1-CE1 4.41Å; Y464-Y547 PolarHBondContact O-OH 2.94Å; S467-Y547 WeakPolarHBondContact CB-OH 3.46Å; S467-Y547 PolarHBondContact OG-OH 3.48Å; I468-Y547 HydrophobicContact CD1-CD1 4.06Å; I468-Y547 HydrophobicContact CD1-CE1 3.85Å; I468-Y547 HydrophobicContact CG1-CD1 4.39Å; I468-Y547 HydrophobicContact CG1-CE1 3.88Å; F540-Y547 AromaticContact CD1-CD2 3.6Å; F540-Y547 HydrophobicContact CD1-CD2 3.6Å; F540-Y547 AromaticContact CD1-CE2 3.57Å; F540-Y547 HydrophobicContact CD1-CE2 3.57Å; F540-Y547 HydrophobicContact CD1-CG 4.13Å; F540-Y547 HydrophobicContact CE1-CD1 4.36Å; F540-Y547 AromaticContact CE1-CD2 3.86Å; F540-Y547 HydrophobicContact CE1-CD2 3.86Å; F540-Y547 AromaticContact CE1-CE1 3.96Å; F540-Y547 HydrophobicContact CE1-CE1 3.96Å; F540-Y547 AromaticContact CE1-CE2 3.4Å; F540-Y547 HydrophobicContact CE1-CE2 3.4Å; F540-Y547 VanDerWaalsContact CE1-CE2 3.4Å; F540-Y547 HydrophobicContact CE1-CG 4.32Å; F540-Y547 AromaticContact CE1-CZ 3.46Å; F540-Y547 VanDerWaalsContact CE1-CZ 3.46Å; F540-Y547 HydrophobicContact CZ-CE2 4.29Å; F540-Y547 WeakPolarHBondContact O-CD2 3.45Å; E542-Y547 HydrophobicContact CG-CE2 4.01Å; E542-Y547 VanDerWaalsContact CG-OH 3.3Å; E542-Y547 WeakPolarHBondContact CG-OH 3.5Å; Y545-Y547 HydrophobicContact CD1-CD2 4.13Å; Y545-Y547 HydrophobicContact CD1-CE2 4.09Å; Y545-Y547 HydrophobicContact CD1-CG 4.45Å; Y545-Y547 AromaticContact CE1-CD1 3.78Å; Y545-Y547 HydrophobicContact CE1-CD1 3.78Å; Y545-Y547 AromaticContact CE1-CD2 3.9Å; Y545-Y547 HydrophobicContact CE1-CD2 3.9Å; Y545-Y547 AromaticContact CE1-CE1 3.93Å; Y545-Y547 HydrophobicContact CE1-CE1 3.93Å; Y545-Y547 HydrophobicContact CE1-CE2 4.04Å; Y545-Y547 AromaticContact CE1-CG 3.77Å; Y545-Y547 HydrophobicContact CE1-CG 3.77Å; Y547-A551 HydrophobicContact CD1-CB 4.16Å; Y547-L552 HydrophobicContact CG-CD2 4.42Å
548	P	96	Very high	92.4	Very high	32 Å²	32	74.3 Å²	74.3	21%	0.208	38%	0.382	C	S	.	.			trans	-67	153.1	172.7	29	-35.4	0	0	0	110.9	Y545 W550 A551 L552	Y545-P548 WeakPolarHBondContact OH-CD 3.21Å; P548-W550 VanDerWaalsContact C-N 3.26Å; P548-W550 HydrophobicContact CG-CD2 4.42Å; P548-W550 HydrophobicContact CG-CZ2 4.04Å; P548-W550 VanDerWaalsContact CG-NE1 3.28Å; P548-W550 PolarHBondContact O-N 3.32Å; P548-W550 VanDerWaalsContact O-N 3.15Å; P548-A551 HydrophobicContact CG-CB 3.93Å; P548-A551 WeakPolarHBondContact O-CB 3.46Å; P548-A551 PolarHBondContact O-N 2.89Å; P548-L552 PolarHBondContact O-N 3.36Å
549	Q	95.5	Very high	93.1	Very high	131 Å²	131	68.4 Å²	68.4	61%	0.612	35%	0.346	S	S	*	.	H	α-helix	trans	-58.2	-36	-172.6	-171.7	62.6	12.3	0	0	113.6	A551 L552 I553	Q549-A551 VanDerWaalsContact C-N 3.27Å; Q549-A551 PolarHBondContact O-N 3.03Å; Q549-L552 PolarHBondContact O-N 3.17Å; Q549-I553 HydrophobicContact CG-CD1 4.08Å; Q549-I553 VanDerWaalsContact O-CG1 3.3Å; Q549-I553 WeakPolarHBondContact O-CG1 3.46Å; Q549-I553 PolarHBondContact O-N 3.04Å
550	W	96	Very high	93.6	Very high	140 Å²	140	63.3 Å²	63.3	53%	0.53	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-34.5	177.4	68.3	-100.7	0	0	0	112	L219 P548 I553 F554	L219-W550 HydrophobicContact CB-CZ2 4.49Å; L219-W550 HydrophobicContact CD2-CH2 3.22Å; L219-W550 HydrophobicContact CD2-CZ2 3.75Å; L219-W550 HydrophobicContact CD2-CZ3 3.87Å; L219-W550 HydrophobicContact CG-CH2 3.58Å; L219-W550 HydrophobicContact CG-CZ2 3.92Å; P548-W550 VanDerWaalsContact C-N 3.26Å; P548-W550 HydrophobicContact CG-CD2 4.42Å; P548-W550 HydrophobicContact CG-CZ2 4.04Å; P548-W550 VanDerWaalsContact CG-NE1 3.28Å; P548-W550 PolarHBondContact O-N 3.32Å; P548-W550 VanDerWaalsContact O-N 3.15Å; W550-I553 PolarHBondContact O-N 3.45Å; W550-F554 WeakPolarHBondContact O-CB 3.48Å; W550-F554 PolarHBondContact O-N 3.48Å
551	A	96.4	Very high	94	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-73.3	-37	178.6	0	0	0	0	0	111	L219 I468 Y547 P548 Q549 F554 R555	L219-A551 HydrophobicContact CD2-CB 3.59Å; I468-A551 HydrophobicContact CD1-CB 4.15Å; Y547-A551 HydrophobicContact CD1-CB 4.16Å; P548-A551 HydrophobicContact CG-CB 3.93Å; P548-A551 WeakPolarHBondContact O-CB 3.46Å; P548-A551 PolarHBondContact O-N 2.89Å; Q549-A551 VanDerWaalsContact C-N 3.27Å; Q549-A551 PolarHBondContact O-N 3.03Å; A551-F554 PolarHBondContact O-N 2.99Å; A551-R555 WeakPolarHBondContact O-CB 3.4Å; A551-R555 PolarHBondContact O-N 3.35Å
552	L	95.8	Very high	94.3	Very high	47 Å²	47	60.6 Å²	60.6	25%	0.246	32%	0.317	C	S	.	.	H	α-helix	trans	-65.4	-41.1	172.2	-63.7	178.4	0	0	0	111.8	F540 Y547 P548 Q549 R555 Q556	F540-L552 HydrophobicContact CB-CD2 4.35Å; F540-L552 HydrophobicContact CD1-CD2 4.15Å; Y547-L552 HydrophobicContact CG-CD2 4.42Å; P548-L552 PolarHBondContact O-N 3.36Å; Q549-L552 PolarHBondContact O-N 3.17Å; L552-R555 PolarHBondContact O-N 3.08Å; L552-Q556 WeakPolarHBondContact O-CG 3.44Å; L552-Q556 PolarHBondContact O-N 3Å; L552-Q556 VanDerWaalsContact O-N 3.11Å
553	I	96.5	Very high	94.8	Very high	87 Å²	87	59.2 Å²	59.2	45%	0.446	31%	0.312	S	S	.	.	H	α-helix	trans	-62.5	-45.6	172.9	-68.8	165.7	0	0	0	110	Q549 W550 R555 Q556 I557	Q549-I553 HydrophobicContact CG-CD1 4.08Å; Q549-I553 VanDerWaalsContact O-CG1 3.3Å; Q549-I553 WeakPolarHBondContact O-CG1 3.46Å; Q549-I553 PolarHBondContact O-N 3.04Å; W550-I553 PolarHBondContact O-N 3.45Å; I553-R555 PolarHBondContact O-N 3.39Å; I553-Q556 PolarHBondContact O-N 3.14Å; I553-Q556 VanDerWaalsContact O-N 3.17Å; I553-I557 HydrophobicContact CG2-CD1 3.78Å; I553-I557 HydrophobicContact CG2-CG1 4.35Å; I553-I557 WeakPolarHBondContact O-CG1 3.5Å; I553-I557 PolarHBondContact O-N 2.82Å
554	F	96	Very high	95.4	Very high	87 Å²	87	60.5 Å²	60.5	38%	0.382	30%	0.302	S	S	.	.	H	α-helix	trans	-58.6	-45.3	177.3	177.6	-103.8	0	0	0	112.1	L465 I468 W550 A551 Q556 I557 L558	L465-F554 HydrophobicContact CD1-CE1 3.74Å; I468-F554 HydrophobicContact CG2-CD1 4.15Å; I468-F554 HydrophobicContact CG2-CE1 4.29Å; W550-F554 WeakPolarHBondContact O-CB 3.48Å; W550-F554 PolarHBondContact O-N 3.48Å; A551-F554 PolarHBondContact O-N 2.99Å; F554-Q556 VanDerWaalsContact C-N 3.32Å; F554-Q556 PolarHBondContact O-N 3.37Å; F554-I557 PolarHBondContact O-N 3.34Å; F554-L558 WeakPolarHBondContact O-CB 3.24Å; F554-L558 PolarHBondContact O-N 2.93Å
555	R	95.5	Very high	96	Very high	50 Å²	50	53.9 Å²	53.9	19%	0.189	27%	0.267	C	S	.	.	H	α-helix	trans	-55.5	-45.9	173.9	-175.7	-175.4	79.6	79.2	-2.8	112	I468 S471 A551 L552 I553 L558 A559	I468-R555 HydrophobicContact CG1-CB 4.44Å; I468-R555 HydrophobicContact CG2-CB 3.83Å; I468-R555 HydrophobicContact CG2-CG 4Å; S471-R555 WeakPolarHBondContact OG-CD 3.21Å; A551-R555 WeakPolarHBondContact O-CB 3.4Å; A551-R555 PolarHBondContact O-N 3.35Å; L552-R555 PolarHBondContact O-N 3.08Å; I553-R555 PolarHBondContact O-N 3.39Å; R555-L558 PolarHBondContact O-N 3.24Å; R555-A559 PolarHBondContact O-N 3.36Å
556	Q	95.1	Very high	96.2	Very high	81 Å²	81	53.4 Å²	53.4	38%	0.379	27%	0.266	S	S	.	.	H	α-helix	trans	-68.4	-38	179.5	-66.6	-67.7	7.4	0	0	112.4	L552 I553 F554 A559 A560	L552-Q556 WeakPolarHBondContact O-CG 3.44Å; L552-Q556 PolarHBondContact O-N 3Å; L552-Q556 VanDerWaalsContact O-N 3.11Å; I553-Q556 PolarHBondContact O-N 3.14Å; I553-Q556 VanDerWaalsContact O-N 3.17Å; F554-Q556 VanDerWaalsContact C-N 3.32Å; F554-Q556 PolarHBondContact O-N 3.37Å; Q556-A559 PolarHBondContact O-N 3.34Å; Q556-A560 WeakPolarHBondContact O-CB 3.39Å; Q556-A560 PolarHBondContact O-N 3.1Å
557	I	96.6	Very high	96.3	Very high	93 Å²	93	54.1 Å²	54.1	48%	0.477	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-47.9	173.3	-69.7	169	0	0	0	110	I553 F554 A559 A560 I561	I553-I557 HydrophobicContact CG2-CD1 3.78Å; I553-I557 HydrophobicContact CG2-CG1 4.35Å; I553-I557 WeakPolarHBondContact O-CG1 3.5Å; I553-I557 PolarHBondContact O-N 2.82Å; F554-I557 PolarHBondContact O-N 3.34Å; I557-A559 VanDerWaalsContact C-N 3.33Å; I557-A559 PolarHBondContact O-N 2.76Å; I557-A560 PolarHBondContact O-N 3.34Å; I557-A560 VanDerWaalsContact O-N 3.11Å; I557-I561 HydrophobicContact CG2-CD1 3.98Å; I557-I561 HydrophobicContact CG2-CG1 4.31Å; I557-I561 VanDerWaalsContact O-CG1 3.3Å; I557-I561 WeakPolarHBondContact O-CG1 3.21Å; I557-I561 PolarHBondContact O-N 3.21Å
558	L	96.2	Very high	96.3	Very high	25 Å²	25	56.5 Å²	56.5	13%	0.131	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-41.4	-179.8	-170.8	62.5	0	0	0	112	I148 I468 V472 F554 R555 P562	I148-L558 HydrophobicContact CD1-CD1 3.67Å; I148-L558 HydrophobicContact CD1-CG 4.08Å; I148-L558 HydrophobicContact CG1-CD1 4.18Å; I468-L558 HydrophobicContact CG2-CD2 4.48Å; V472-L558 HydrophobicContact CG2-CB 4.11Å; V472-L558 HydrophobicContact CG2-CD2 3.98Å; V472-L558 HydrophobicContact CG2-CG 4Å; F554-L558 WeakPolarHBondContact O-CB 3.24Å; F554-L558 PolarHBondContact O-N 2.93Å; R555-L558 PolarHBondContact O-N 3.24Å; L558-P562 WeakPolarHBondContact O-CD 3.29Å
559	A	95.7	Very high	96.2	Very high	2 Å²	2	57 Å²	57	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-34.7	173.8	0	0	0	0	0	113.5	V472 Y476 T477 R555 Q556 I557	V472-A559 HydrophobicContact CG1-CB 4.14Å; V472-A559 HydrophobicContact CG2-CB 4.07Å; Y476-A559 HydrophobicContact CE1-CB 4.08Å; Y476-A559 VanDerWaalsContact OH-CB 3.32Å; Y476-A559 WeakPolarHBondContact OH-CB 3.26Å; T477-A559 PolarHBondContact OG1-O 3.01Å; R555-A559 PolarHBondContact O-N 3.36Å; Q556-A559 PolarHBondContact O-N 3.34Å; I557-A559 VanDerWaalsContact C-N 3.33Å; I557-A559 PolarHBondContact O-N 2.76Å
560	A	96.4	Very high	96.1	Very high	23 Å²	23	53.6 Å²	53.6	19%	0.19	27%	0.269	C	S	.	.	H	α-helix	trans	-75.7	-30.7	-178.9	0	0	0	0	0	113	Q556 I557 V563 L564	Q556-A560 WeakPolarHBondContact O-CB 3.39Å; Q556-A560 PolarHBondContact O-N 3.1Å; I557-A560 PolarHBondContact O-N 3.34Å; I557-A560 VanDerWaalsContact O-N 3.11Å; A560-V563 PolarHBondContact O-N 3.3Å; A560-V563 VanDerWaalsContact O-N 3.11Å; A560-L564 HydrophobicContact CB-CD1 3.95Å; A560-L564 HydrophobicContact CB-CG 4.23Å; A560-L564 WeakPolarHBondContact O-CB 3.41Å; A560-L564 VanDerWaalsContact O-CG 3.28Å; A560-L564 WeakPolarHBondContact O-CG 3.36Å; A560-L564 PolarHBondContact O-N 3.43Å
561	I	97.4	Very high	95.9	Very high	71 Å²	71	51.2 Å²	51.2	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-52.9	-51.5	-175	-76.1	162.7	0	0	0	113	I144 I557 V563 L564 T565	I144-I561 HydrophobicContact CD1-CG2 4.37Å; I144-I561 HydrophobicContact CG2-CG2 4.1Å; I557-I561 HydrophobicContact CG2-CD1 3.98Å; I557-I561 HydrophobicContact CG2-CG1 4.31Å; I557-I561 VanDerWaalsContact O-CG1 3.3Å; I557-I561 WeakPolarHBondContact O-CG1 3.21Å; I557-I561 PolarHBondContact O-N 3.21Å; I561-V563 PolarHBondContact O-N 3.39Å; I561-L564 PolarHBondContact O-N 3.03Å; I561-T565 PolarHBondContact O-N 3.4Å; I561-T565 PolarHBondContact O-OG1 3.5Å
562	P	96.5	Very high	95.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-44.2	177.3	-25.6	35.8	0	0	0	112.3	A141 I144 T477 L558 T565 I566	A141-P562 HydrophobicContact CB-CB 3.96Å; A141-P562 WeakPolarHBondContact CB-O 3.47Å; I144-P562 HydrophobicContact CB-CG 4.43Å; I144-P562 HydrophobicContact CG2-CG 3.91Å; T477-P562 HydrophobicContact CG2-CB 3.73Å; T477-P562 HydrophobicContact CG2-CG 3.82Å; L558-P562 WeakPolarHBondContact O-CD 3.29Å; P562-T565 WeakPolarHBondContact O-CB 3.5Å; P562-T565 PolarHBondContact O-N 3.2Å; P562-I566 PolarHBondContact O-N 2.97Å
563	V	96.6	Very high	95.2	Very high	27 Å²	27	54.9 Å²	54.9	16%	0.164	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-45	-180	177.5	0	0	0	0	111.7	Y476 T477 V480 A560 I561 T565 I566 I567	Y476-V563 HydrophobicContact CE2-CG2 4.12Å; T477-V563 HydrophobicContact CG2-CG2 4.36Å; V480-V563 HydrophobicContact CB-CG2 4.12Å; V480-V563 HydrophobicContact CG1-CG1 4.05Å; V480-V563 HydrophobicContact CG1-CG2 3.95Å; V480-V563 HydrophobicContact CG2-CG2 4.39Å; A560-V563 PolarHBondContact O-N 3.3Å; A560-V563 VanDerWaalsContact O-N 3.11Å; I561-V563 PolarHBondContact O-N 3.39Å; V563-T565 PolarHBondContact O-N 3.39Å; V563-I566 WeakPolarHBondContact O-CB 3.24Å; V563-I566 PolarHBondContact O-N 2.94Å; V563-I566 VanDerWaalsContact O-N 3.11Å; V563-I567 HydrophobicContact CG1-CD1 4.45Å; V563-I567 PolarHBondContact O-N 3.24Å
564	L	97.1	Very high	94.7	Very high	99 Å²	99	54 Å²	54	52%	0.518	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-29.9	176.8	-71.1	176.1	0	0	0	111.4	A560 I561 I566 I567 A568	A560-L564 HydrophobicContact CB-CD1 3.95Å; A560-L564 HydrophobicContact CB-CG 4.23Å; A560-L564 WeakPolarHBondContact O-CB 3.41Å; A560-L564 VanDerWaalsContact O-CG 3.28Å; A560-L564 WeakPolarHBondContact O-CG 3.36Å; A560-L564 PolarHBondContact O-N 3.43Å; I561-L564 PolarHBondContact O-N 3.03Å; L564-I566 VanDerWaalsContact C-N 3.32Å; L564-I566 PolarHBondContact O-N 3.16Å; L564-I567 PolarHBondContact O-N 3.46Å; L564-A568 WeakPolarHBondContact O-CB 3.46Å; L564-A568 PolarHBondContact O-N 3.23Å
565	T	97.2	Very high	94.3	Very high	33 Å²	33	54.5 Å²	54.5	20%	0.202	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-36.7	174.7	-56.9	0	0	0	0	111.7	Y140 I144 I561 P562 V563 W569	Y140-T565 HydrophobicContact CG-CG2 4.45Å; I144-T565 HydrophobicContact CD1-CG2 4.24Å; I561-T565 PolarHBondContact O-N 3.4Å; I561-T565 PolarHBondContact O-OG1 3.5Å; P562-T565 WeakPolarHBondContact O-CB 3.5Å; P562-T565 PolarHBondContact O-N 3.2Å; V563-T565 PolarHBondContact O-N 3.39Å; T565-W569 WeakPolarHBondContact O-CB 3.37Å; T565-W569 PolarHBondContact O-N 3.32Å
566	I	97.2	Very high	93.6	Very high	14 Å²	14	58.8 Å²	58.8	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-60.7	-50.8	173.3	-54.9	176.4	0	0	0	110	I138 A141 I481 P562 V563 L564 F570	I138-I566 HydrophobicContact CG1-CD1 4.24Å; I138-I566 HydrophobicContact CG1-CG1 4.27Å; I138-I566 HydrophobicContact CG1-CG2 3.92Å; A141-I566 HydrophobicContact CB-CD1 4.03Å; A141-I566 HydrophobicContact CB-CG1 3.76Å; I481-I566 HydrophobicContact CG1-CD1 4.33Å; P562-I566 PolarHBondContact O-N 2.97Å; V563-I566 WeakPolarHBondContact O-CB 3.24Å; V563-I566 PolarHBondContact O-N 2.94Å; V563-I566 VanDerWaalsContact O-N 3.11Å; L564-I566 VanDerWaalsContact C-N 3.32Å; L564-I566 PolarHBondContact O-N 3.16Å; I566-F570 WeakPolarHBondContact O-CB 3.17Å; I566-F570 PolarHBondContact O-N 2.98Å; I566-F570 VanDerWaalsContact O-N 3.13Å
567	I	95.9	Very high	92.7	Very high	87 Å²	87	58 Å²	58	45%	0.446	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-48.8	-176.9	-59.5	172.6	0	0	0	111	V563 L564 W569 F570 L571	V563-I567 HydrophobicContact CG1-CD1 4.45Å; V563-I567 PolarHBondContact O-N 3.24Å; L564-I567 PolarHBondContact O-N 3.46Å; I567-W569 VanDerWaalsContact C-N 3.34Å; I567-W569 PolarHBondContact O-N 3.37Å; I567-F570 WeakPolarHBondContact O-CB 3.4Å; I567-F570 PolarHBondContact O-N 3.39Å; I567-L571 HydrophobicContact CG2-CD1 3.96Å; I567-L571 HydrophobicContact CG2-CG 4.37Å; I567-L571 WeakPolarHBondContact O-CG 3.38Å; I567-L571 PolarHBondContact O-N 3.17Å
568	A	95.8	Very high	91.2	Very high	58 Å²	58	54.3 Å²	54.3	48%	0.479	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-40.9	-177.9	0	0	0	0	0	111.6	L564 L571 Y572	L564-A568 WeakPolarHBondContact O-CB 3.46Å; L564-A568 PolarHBondContact O-N 3.23Å; A568-L571 PolarHBondContact O-N 2.99Å; A568-Y572 VanDerWaalsContact O-CB 3.23Å; A568-Y572 WeakPolarHBondContact O-CB 3.49Å; A568-Y572 PolarHBondContact O-N 3.32Å
569	W	94.4	Very high	90.1	Very high	41 Å²	41	54 Å²	54	16%	0.155	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-45.3	175.6	-175.8	-85.7	0	0	0	111.9	P133 K136 G137 Y140 T565 I567 L571 Y572 K573	P133-W569 PolarHBondContact O-NE1 2.68Å; K136-W569 HydrophobicContact CB-CZ2 4.16Å; K136-W569 HydrophobicContact CD-CZ2 3.92Å; K136-W569 HydrophobicContact CG-CZ2 4.14Å; G137-W569 VanDerWaalsContact N-CD1 3.32Å; Y140-W569 HydrophobicContact CD2-CD2 4.49Å; Y140-W569 HydrophobicContact CD2-CE3 4.12Å; Y140-W569 HydrophobicContact CD2-CZ3 4.34Å; Y140-W569 HydrophobicContact CE2-CD2 4.2Å; Y140-W569 AromaticContact CE2-CE3 3.69Å; Y140-W569 HydrophobicContact CE2-CE3 3.69Å; Y140-W569 AromaticContact CE2-CH2 3.8Å; Y140-W569 HydrophobicContact CE2-CH2 3.8Å; Y140-W569 HydrophobicContact CE2-CZ2 4.31Å; Y140-W569 AromaticContact CE2-CZ3 3.47Å; Y140-W569 HydrophobicContact CE2-CZ3 3.47Å; Y140-W569 VanDerWaalsContact CE2-CZ3 3.47Å; Y140-W569 AromaticContact CZ-CZ3 3.99Å; T565-W569 WeakPolarHBondContact O-CB 3.37Å; T565-W569 PolarHBondContact O-N 3.32Å; I567-W569 VanDerWaalsContact C-N 3.34Å; I567-W569 PolarHBondContact O-N 3.37Å; W569-L571 VanDerWaalsContact C-N 3.35Å; W569-L571 PolarHBondContact O-N 2.94Å; W569-Y572 PolarHBondContact O-N 3.3Å; W569-K573 HydrophobicContact CZ2-CG 4.28Å; W569-K573 WeakPolarHBondContact O-CB 3.49Å; W569-K573 PolarHBondContact O-N 2.79Å
570	F	93	Very high	88.8	Confident	60 Å²	60	61 Å²	61	26%	0.263	32%	0.318	S	S	.	.	H	α-helix	trans	-56.3	-51	176.3	-179.9	-84.5	0	0	0	110.7	L134 F135 I566 I567 K573 Y574	L134-F570 HydrophobicContact CB-CD2 4.05Å; L134-F570 HydrophobicContact CB-CE2 4.19Å; L134-F570 HydrophobicContact CD1-CE2 4.15Å; L134-F570 HydrophobicContact CD2-CD2 4.06Å; L134-F570 HydrophobicContact CD2-CE2 4.09Å; L134-F570 HydrophobicContact CG-CD2 4.49Å; L134-F570 HydrophobicContact CG-CE2 4.36Å; L134-F570 WeakPolarHBondContact O-CA 3.5Å; F135-F570 HydrophobicContact CD1-CD2 4.37Å; F135-F570 AromaticContact CE1-CD2 3.96Å; F135-F570 HydrophobicContact CE1-CD2 3.96Å; F135-F570 HydrophobicContact CE1-CE2 4.14Å; F135-F570 HydrophobicContact CZ-CD2 4.18Å; F135-F570 AromaticContact CZ-CE2 3.93Å; F135-F570 HydrophobicContact CZ-CE2 3.93Å; I566-F570 WeakPolarHBondContact O-CB 3.17Å; I566-F570 PolarHBondContact O-N 2.98Å; I566-F570 VanDerWaalsContact O-N 3.13Å; I567-F570 WeakPolarHBondContact O-CB 3.4Å; I567-F570 PolarHBondContact O-N 3.39Å; F570-K573 PolarHBondContact O-N 3.42Å; F570-Y574 WeakPolarHBondContact O-CB 3.26Å; F570-Y574 PolarHBondContact O-N 2.91Å
571	L	92.4	Very high	87.3	Confident	90 Å²	90	63.4 Å²	63.4	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-63.3	-42.8	178.8	-68.2	176.5	0	0	0	112.1	I567 A568 W569 Y574 C575	I567-L571 HydrophobicContact CG2-CD1 3.96Å; I567-L571 HydrophobicContact CG2-CG 4.37Å; I567-L571 WeakPolarHBondContact O-CG 3.38Å; I567-L571 PolarHBondContact O-N 3.17Å; A568-L571 PolarHBondContact O-N 2.99Å; W569-L571 VanDerWaalsContact C-N 3.35Å; W569-L571 PolarHBondContact O-N 2.94Å; L571-Y574 PolarHBondContact O-N 2.99Å; L571-C575 VanDerWaalsContact O-CB 3.23Å; L571-C575 WeakPolarHBondContact O-CB 3.3Å; L571-C575 PolarHBondContact O-N 3.47Å; L571-C575 PolarHBondContact O-SG 3.46Å
572	Y	91	Very high	85.9	Confident	102 Å²	102	60.1 Å²	60.1	40%	0.4	31%	0.313	S	S	.	.	H	α-helix	trans	-58.7	-51.8	176.8	166.5	-102.7	0	0	0	111.8	A568 W569 K576	A568-Y572 VanDerWaalsContact O-CB 3.23Å; A568-Y572 WeakPolarHBondContact O-CB 3.49Å; A568-Y572 PolarHBondContact O-N 3.32Å; W569-Y572 PolarHBondContact O-N 3.3Å; Y572-K576 HydrophobicContact CD2-CD 4.25Å; Y572-K576 HydrophobicContact CE2-CB 4.39Å; Y572-K576 HydrophobicContact CE2-CD 3.36Å; Y572-K576 WeakPolarHBondContact O-CB 3.4Å; Y572-K576 PolarHBondContact O-N 3.36Å; Y572-K576 WeakPolarHBondContact OH-CD 3.29Å; Y572-K576 PolarHBondContact OH-NZ 2.89Å
573	K	86.1	Confident	84.8	Confident	22 Å²	22	62.8 Å²	62.8	10%	0.096	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-43.9	178.8	-81.4	-63.6	-162.3	171.8	0	111.7	L134 W569 F570 E577	L134-K573 HydrophobicContact CD2-CB 3.96Å; W569-K573 HydrophobicContact CZ2-CG 4.28Å; W569-K573 WeakPolarHBondContact O-CB 3.49Å; W569-K573 PolarHBondContact O-N 2.79Å; F570-K573 PolarHBondContact O-N 3.42Å; K573-E577 VanDerWaalsContact CD-CD 3.43Å; K573-E577 HydrophobicContact CD-CG 4.33Å; K573-E577 WeakPolarHBondContact CD-OE1 3.3Å; K573-E577 VanDerWaalsContact CD-OE2 3.24Å; K573-E577 WeakPolarHBondContact CD-OE2 3.27Å; K573-E577 WeakPolarHBondContact CE-OE1 3.27Å; K573-E577 IonicContact NZ-OE1 3.93Å; K573-E577 PolarHBondContact NZ-OE1 2.81Å; K573-E577 IonicContact NZ-OE2 2.96Å; K573-E577 PolarHBondContact NZ-OE2 3.01Å; K573-E577 PolarHBondContact O-N 2.9Å; K573-E577 VanDerWaalsContact O-N 3.09Å
574	Y	85.5	Confident	83.6	Confident	68 Å²	68	68.1 Å²	68.1	27%	0.267	35%	0.347	S	S	.	.	H	α-helix	trans	-59.2	-52.6	176.6	-177.8	-94.1	0	0	0	111.3	F570 L571 G579 F580 M583	F570-Y574 WeakPolarHBondContact O-CB 3.26Å; F570-Y574 PolarHBondContact O-N 2.91Å; L571-Y574 PolarHBondContact O-N 2.99Å; Y574-G579 VanDerWaalsContact CE2-C 3.47Å; Y574-G579 WeakPolarHBondContact O-CA 3.5Å; Y574-G579 PolarHBondContact O-N 3.06Å; Y574-F580 PolarHBondContact OH-N 3.12Å; Y574-M583 HydrophobicContact CE2-CB 4.38Å; Y574-M583 HydrophobicContact CE2-SD 4.25Å
575	C	87.9	Confident	82.4	Confident	99 Å²	99	65.8 Å²	65.8	67%	0.669	33%	0.333	S	S	*	.	H	α-helix	trans	-71.3	-40.1	-176.3	-67.6	0	0	0	0	113.2	L571	L571-C575 VanDerWaalsContact O-CB 3.23Å; L571-C575 WeakPolarHBondContact O-CB 3.3Å; L571-C575 PolarHBondContact O-N 3.47Å; L571-C575 PolarHBondContact O-SG 3.46Å
576	K	82.4	Confident	81.1	Confident	139 Å²	139	65.3 Å²	65.3	60%	0.604	33%	0.328	S	S	*	.	H	α-helix	trans	-85	-36.4	-171.6	-171.6	175.7	175.4	177.2	0	113.9	Y572	Y572-K576 HydrophobicContact CD2-CD 4.25Å; Y572-K576 HydrophobicContact CE2-CB 4.39Å; Y572-K576 HydrophobicContact CE2-CD 3.36Å; Y572-K576 WeakPolarHBondContact O-CB 3.4Å; Y572-K576 PolarHBondContact O-N 3.36Å; Y572-K576 WeakPolarHBondContact OH-CD 3.29Å; Y572-K576 PolarHBondContact OH-NZ 2.89Å
577	E	74.6	Confident	80.1	Confident	64 Å²	64	67.1 Å²	67.1	30%	0.299	34%	0.338	S	S	.	.	H	α-helix	trans	-107.3	-4.9	-167.2	-61.7	-178.4	-170.5	0	0	114.4	K573 F586	K573-E577 VanDerWaalsContact CD-CD 3.43Å; K573-E577 HydrophobicContact CD-CG 4.33Å; K573-E577 WeakPolarHBondContact CD-OE1 3.3Å; K573-E577 VanDerWaalsContact CD-OE2 3.24Å; K573-E577 WeakPolarHBondContact CD-OE2 3.27Å; K573-E577 WeakPolarHBondContact CE-OE1 3.27Å; K573-E577 IonicContact NZ-OE1 3.93Å; K573-E577 PolarHBondContact NZ-OE1 2.81Å; K573-E577 IonicContact NZ-OE2 2.96Å; K573-E577 PolarHBondContact NZ-OE2 3.01Å; K573-E577 PolarHBondContact O-N 2.9Å; K573-E577 VanDerWaalsContact O-N 3.09Å; E577-F586 HydrophobicContact CB-CE2 3.99Å; E577-F586 HydrophobicContact CB-CZ 3.49Å; E577-F586 VanDerWaalsContact CB-CZ 3.49Å
578	G	66.8	Low	79	Confident	17 Å²	17	66.3 Å²	66.3	18%	0.175	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	156	12.6	162.1	0	0	0	0	0	119.4	V581 L582	G578-V581 PolarHBondContact O-N 3.47Å; G578-L582 PolarHBondContact O-N 3.1Å
579	G	71.7	Confident	77.9	Confident	17 Å²	17	66 Å²	66	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	54.7	-146.3	172.5	0	0	0	0	0	113.6	Y574 V581 L582 M583	Y574-G579 VanDerWaalsContact CE2-C 3.47Å; Y574-G579 WeakPolarHBondContact O-CA 3.5Å; Y574-G579 PolarHBondContact O-N 3.06Å; G579-V581 PolarHBondContact O-N 3.25Å; G579-L582 PolarHBondContact O-N 3.47Å; G579-M583 PolarHBondContact O-N 3.24Å
580	F	68.2	Low	76.9	Confident	150 Å²	150	65.9 Å²	65.9	66%	0.658	33%	0.328	S	S	*	.	H	α-helix	trans	-58.5	-30.9	178.6	-166.1	-96.9	0	0	0	113.4	Y574 M583	Y574-F580 PolarHBondContact OH-N 3.12Å; F580-M583 HydrophobicContact CD2-CE 3.8Å; F580-M583 HydrophobicContact CD2-SD 4.25Å; F580-M583 HydrophobicContact CE2-CE 3.58Å; F580-M583 HydrophobicContact CZ-CE 4.31Å; F580-M583 WeakPolarHBondContact O-CB 3.16Å; F580-M583 PolarHBondContact O-N 2.75Å
581	V	65.4	Low	75.8	Confident	73 Å²	73	70.2 Å²	70.2	44%	0.442	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-42	-178.3	-179.4	0	0	0	0	111.3	G578 G579	G578-V581 PolarHBondContact O-N 3.47Å; G579-V581 PolarHBondContact O-N 3.25Å
582	L	67.2	Low	74.6	Confident	3 Å²	3	71.9 Å²	71.9	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-93.7	-6.5	175.9	-102.3	88.5	0	0	0	114.1	G578 G579 K584 E585 F586 V673 K676	G578-L582 PolarHBondContact O-N 3.1Å; G579-L582 PolarHBondContact O-N 3.47Å; L582-K584 PolarHBondContact O-N 2.92Å; L582-E585 CarbonylContact O-C 3.52Å; L582-E585 WeakPolarHBondContact O-CA 3.24Å; L582-E585 PolarHBondContact O-N 3.14Å; L582-F586 HydrophobicContact CB-CD2 4Å; L582-F586 HydrophobicContact CB-CE1 4.4Å; L582-F586 HydrophobicContact CB-CE2 3.62Å; L582-F586 HydrophobicContact CB-CZ 3.82Å; L582-F586 HydrophobicContact CD2-CD1 4.26Å; L582-F586 HydrophobicContact CD2-CE1 3.45Å; L582-F586 VanDerWaalsContact CD2-CE1 3.45Å; L582-F586 HydrophobicContact CD2-CE2 4.03Å; L582-F586 HydrophobicContact CD2-CZ 3.29Å; L582-F586 HydrophobicContact CG-CE1 4.49Å; L582-F586 HydrophobicContact CG-CE2 4.46Å; L582-F586 HydrophobicContact CG-CZ 4.17Å; L582-F586 PolarHBondContact O-N 3.48Å; L582-V673 HydrophobicContact CD1-CG2 4.37Å; L582-K676 HydrophobicContact CD1-CB 3.9Å; L582-K676 HydrophobicContact CD1-CD 3.49Å; L582-K676 VanDerWaalsContact CD1-CD 3.49Å; L582-K676 HydrophobicContact CD1-CG 4.34Å
583	M	73.6	Confident	74.3	Confident	56 Å²	56	67.3 Å²	67.3	28%	0.276	34%	0.336	S	S	.	.	H	α-helix	trans	-52.3	-45.7	-179.6	-174.1	-178.5	74.4	0	0	111.5	L134 Y574 G579 F580 E585 F586 L587	L134-M583 HydrophobicContact CD1-CG 4.39Å; Y574-M583 HydrophobicContact CE2-CB 4.38Å; Y574-M583 HydrophobicContact CE2-SD 4.25Å; G579-M583 PolarHBondContact O-N 3.24Å; F580-M583 HydrophobicContact CD2-CE 3.8Å; F580-M583 HydrophobicContact CD2-SD 4.25Å; F580-M583 HydrophobicContact CE2-CE 3.58Å; F580-M583 HydrophobicContact CZ-CE 4.31Å; F580-M583 WeakPolarHBondContact O-CB 3.16Å; F580-M583 PolarHBondContact O-N 2.75Å; M583-E585 PolarHBondContact O-N 3.4Å; M583-F586 PolarHBondContact O-N 2.87Å; M583-L587 HydrophobicContact CG-CD1 4.36Å; M583-L587 VanDerWaalsContact O-CG 3.23Å; M583-L587 WeakPolarHBondContact O-CG 3.48Å; M583-L587 PolarHBondContact O-N 2.62Å; M583-L587 VanDerWaalsContact O-N 3.08Å
584	K	71.9	Confident	74.3	Confident	139 Å²	139	66.5 Å²	66.5	60%	0.604	33%	0.334	S	S	*	.	H	α-helix	trans	-62.6	-29.3	177.7	-170.9	175.1	-178.8	178	0	113.1	L582	L582-K584 PolarHBondContact O-N 2.92Å
585	E	71.8	Confident	74.5	Confident	49 Å²	49	63.3 Å²	63.3	23%	0.229	32%	0.322	C	S	.	.	H	α-helix	trans	-82.4	-38.3	178	-156.2	64	-164.9	0	0	111.9	L582 M583 L587 K588 V673 L677	L582-E585 CarbonylContact O-C 3.52Å; L582-E585 WeakPolarHBondContact O-CA 3.24Å; L582-E585 PolarHBondContact O-N 3.14Å; M583-E585 PolarHBondContact O-N 3.4Å; E585-L587 PolarHBondContact O-N 3.49Å; E585-K588 VanDerWaalsContact O-CB 3.29Å; E585-K588 WeakPolarHBondContact O-CB 3.29Å; E585-K588 PolarHBondContact O-N 2.85Å; E585-K588 IonicContact OE1-NZ 3.38Å; E585-K588 IonicContact OE2-NZ 3.81Å; E585-K588 PolarHBondContact OE2-NZ 3.13Å; E585-V673 HydrophobicContact CB-CG1 3.97Å; E585-V673 HydrophobicContact CG-CG1 3.64Å; E585-L677 HydrophobicContact CG-CD1 4.2Å
586	F	70.8	Confident	74.3	Confident	23 Å²	23	61.7 Å²	61.7	10%	0.101	32%	0.315	C	S	.	.	H	α-helix	trans	-73.8	-15	177.1	-61.7	-37.7	0	0	0	114.7	S132 P133 L134 E577 L582 M583	S132-F586 PolarHBondContact OG-O 3.32Å; S132-F586 VanDerWaalsContact OG-O 3.08Å; P133-F586 WeakPolarHBondContact CD-O 3.39Å; L134-F586 HydrophobicContact CB-CB 4.35Å; L134-F586 HydrophobicContact CD1-CB 3.44Å; L134-F586 VanDerWaalsContact CD1-CB 3.44Å; L134-F586 HydrophobicContact CD1-CD2 4.25Å; L134-F586 HydrophobicContact CD1-CG 4.35Å; L134-F586 HydrophobicContact CD2-CB 4.5Å; L134-F586 HydrophobicContact CD2-CD2 4.21Å; L134-F586 HydrophobicContact CG-CB 3.45Å; L134-F586 VanDerWaalsContact CG-CB 3.45Å; L134-F586 HydrophobicContact CG-CD2 4.03Å; L134-F586 HydrophobicContact CG-CG 4.13Å; E577-F586 HydrophobicContact CB-CE2 3.99Å; E577-F586 HydrophobicContact CB-CZ 3.49Å; E577-F586 VanDerWaalsContact CB-CZ 3.49Å; L582-F586 HydrophobicContact CB-CD2 4Å; L582-F586 HydrophobicContact CB-CE1 4.4Å; L582-F586 HydrophobicContact CB-CE2 3.62Å; L582-F586 HydrophobicContact CB-CZ 3.82Å; L582-F586 HydrophobicContact CD2-CD1 4.26Å; L582-F586 HydrophobicContact CD2-CE1 3.45Å; L582-F586 VanDerWaalsContact CD2-CE1 3.45Å; L582-F586 HydrophobicContact CD2-CE2 4.03Å; L582-F586 HydrophobicContact CD2-CZ 3.29Å; L582-F586 HydrophobicContact CG-CE1 4.49Å; L582-F586 HydrophobicContact CG-CE2 4.46Å; L582-F586 HydrophobicContact CG-CZ 4.17Å; L582-F586 PolarHBondContact O-N 3.48Å; M583-F586 PolarHBondContact O-N 2.87Å
587	L	74.5	Confident	74.3	Confident	53 Å²	53	59.1 Å²	59.1	28%	0.277	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-13.4	167.2	-68.5	171.4	0	0	0	112	L134 F135 V492 M583 E585	L134-L587 HydrophobicContact CD1-CD2 4.42Å; F135-L587 HydrophobicContact CE2-CD2 3.84Å; V492-L587 HydrophobicContact CG1-CB 3.88Å; V492-L587 HydrophobicContact CG1-CD2 3.44Å; V492-L587 VanDerWaalsContact CG1-CD2 3.44Å; V492-L587 HydrophobicContact CG1-CG 4.2Å; V492-L587 WeakPolarHBondContact CG1-O 3.24Å; V492-L587 HydrophobicContact CG2-CD2 4.32Å; M583-L587 HydrophobicContact CG-CD1 4.36Å; M583-L587 VanDerWaalsContact O-CG 3.23Å; M583-L587 WeakPolarHBondContact O-CG 3.48Å; M583-L587 PolarHBondContact O-N 2.62Å; M583-L587 VanDerWaalsContact O-N 3.08Å; E585-L587 PolarHBondContact O-N 3.49Å
588	K	74.5	Confident	74.7	Confident	70 Å²	70	62.6 Å²	62.6	30%	0.304	32%	0.32	S	S	.	.	S	Bend	trans	-93.1	155.3	175.8	-60.4	176.6	-168.5	161.7	0	111.2	I131 E585	I131-K588 CarbonylContact O-C 3.57Å; E585-K588 VanDerWaalsContact O-CB 3.29Å; E585-K588 WeakPolarHBondContact O-CB 3.29Å; E585-K588 PolarHBondContact O-N 2.85Å; E585-K588 IonicContact OE1-NZ 3.38Å; E585-K588 IonicContact OE2-NZ 3.81Å; E585-K588 PolarHBondContact OE2-NZ 3.13Å
589	P	72.4	Confident	75.5	Confident	50 Å²	50	68.3 Å²	68.3	33%	0.325	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-60.3	146.1	170	26.9	-37.1	0	0	0	111.8	I131 Y493 W593	I131-P589 WeakPolarHBondContact O-CA 3.39Å; Y493-P589 HydrophobicContact CD2-CG 4.47Å; Y493-P589 HydrophobicContact CE2-CB 4.3Å; Y493-P589 HydrophobicContact CE2-CG 3.99Å; P589-W593 HydrophobicContact CB-CB 3.7Å; P589-W593 HydrophobicContact CB-CG 3.62Å
590	V	74	Confident	76.3	Confident	40 Å²	40	69 Å²	69	24%	0.242	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-68	160.8	170.2	-59.3	0	0	0	0	111.1	N130 P133 E592 W593	N130-V590 HydrophobicContact CB-CG2 3.72Å; N130-V590 PolarHBondContact O-N 2.99Å; P133-V590 HydrophobicContact CG-CG1 3.3Å; V590-E592 WeakPolarHBondContact CB-OE2 3.18Å; V590-E592 HydrophobicContact CG2-CB 4.19Å; V590-E592 WeakPolarHBondContact CG2-OE2 3.47Å; V590-E592 PolarHBondContact O-N 3.06Å; V590-E592 VanDerWaalsContact O-N 3.16Å; V590-W593 HydrophobicContact CG2-CB 4.16Å; V590-W593 VanDerWaalsContact O-CB 3.24Å; V590-W593 WeakPolarHBondContact O-CB 3.43Å; V590-W593 PolarHBondContact O-N 3.31Å
591	H	68.2	Low	77.2	Confident	150 Å²	150	65.2 Å²	65.2	69%	0.694	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.4	179.7	-66.8	-58.9	0	0	0	113	W593 R601	H591-W593 VanDerWaalsContact C-N 3.33Å; H591-R601 PolarHBondContact O-NH2 3.02Å
592	E	68.9	Low	78.2	Confident	125 Å²	125	66.3 Å²	66.3	58%	0.584	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-17.7	176.6	-57.9	81.1	-176.4	0	0	113.2	V590 R601	V590-E592 WeakPolarHBondContact CB-OE2 3.18Å; V590-E592 HydrophobicContact CG2-CB 4.19Å; V590-E592 WeakPolarHBondContact CG2-OE2 3.47Å; V590-E592 PolarHBondContact O-N 3.06Å; V590-E592 VanDerWaalsContact O-N 3.16Å; E592-R601 PolarHBondContact O-NH1 3.48Å
593	W	83.8	Confident	79.1	Confident	7 Å²	7	70.6 Å²	70.6	3%	0.027	35%	0.348	C	S	.	.			trans	-63.9	137	178.5	175.8	-105.2	0	0	0	111.5	F117 F120 A121 V128 N130 I131 Y493 P589 V590 H591	F117-W593 AromaticContact CD2-CH2 3.85Å; F117-W593 HydrophobicContact CD2-CH2 3.85Å; F117-W593 HydrophobicContact CD2-CZ2 4.46Å; F117-W593 AromaticContact CE2-CH2 3.52Å; F117-W593 HydrophobicContact CE2-CH2 3.52Å; F117-W593 HydrophobicContact CE2-CZ2 4.19Å; F117-W593 HydrophobicContact CE2-CZ3 4.23Å; F120-W593 HydrophobicContact CD1-CH2 4.1Å; F120-W593 AromaticContact CD1-CZ2 3.59Å; F120-W593 HydrophobicContact CD1-CZ2 3.59Å; F120-W593 AromaticContact CE1-CE2 3.93Å; F120-W593 AromaticContact CE1-CZ2 3.88Å; F120-W593 HydrophobicContact CE1-CZ2 3.88Å; F120-W593 AromaticContact CE1-NE1 3.89Å; A121-W593 HydrophobicContact CB-CE3 4.13Å; A121-W593 HydrophobicContact CB-CH2 3.83Å; A121-W593 HydrophobicContact CB-CZ3 3.46Å; A121-W593 VanDerWaalsContact CB-CZ3 3.46Å; V128-W593 HydrophobicContact CG2-CH2 3.99Å; V128-W593 HydrophobicContact CG2-CZ3 3.94Å; V128-W593 WeakPolarHBondContact O-CZ3 3.39Å; N130-W593 HydrophobicContact CB-CE3 4.26Å; I131-W593 HydrophobicContact CB-CD2 3.88Å; I131-W593 HydrophobicContact CB-CE3 4.02Å; I131-W593 HydrophobicContact CB-CH2 3.95Å; I131-W593 HydrophobicContact CB-CZ2 3.79Å; I131-W593 HydrophobicContact CB-CZ3 4.05Å; I131-W593 HydrophobicContact CD1-CH2 4.19Å; I131-W593 HydrophobicContact CD1-CZ2 3.53Å; I131-W593 HydrophobicContact CG1-CD2 4.18Å; I131-W593 HydrophobicContact CG1-CH2 4.34Å; I131-W593 HydrophobicContact CG1-CZ2 3.7Å; Y493-W593 AromaticContact CE2-NE1 3.8Å; Y493-W593 AromaticContact CZ-NE1 3.77Å; Y493-W593 PolarHBondContact OH-NE1 3.34Å; P589-W593 HydrophobicContact CB-CB 3.7Å; P589-W593 HydrophobicContact CB-CG 3.62Å; V590-W593 HydrophobicContact CG2-CB 4.16Å; V590-W593 VanDerWaalsContact O-CB 3.24Å; V590-W593 WeakPolarHBondContact O-CB 3.43Å; V590-W593 PolarHBondContact O-N 3.31Å; H591-W593 VanDerWaalsContact C-N 3.33Å
594	G	87.2	Confident	79.8	Confident	5 Å²	5	68.3 Å²	68.3	5%	0.052	34%	0.336	C	S	.	.	S	Bend	trans	139.8	-172.8	-179.1	0	0	0	0	0	111.3
595	P	87.9	Confident	80.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.324	C	S	.	.			trans	-56.9	142.8	174.8	-24.3	35.3	0	0	0	112.2	F120 F327 L504 R601 F604	F120-P595 HydrophobicContact CE2-CG 3.96Å; F120-P595 HydrophobicContact CZ-CG 4.07Å; F120-P595 WeakPolarHBondContact O-CA 3.46Å; F327-P595 HydrophobicContact CD2-CB 4.14Å; F327-P595 HydrophobicContact CE2-CB 3.6Å; F327-P595 HydrophobicContact CE2-CG 3.62Å; F327-P595 HydrophobicContact CZ-CB 4.02Å; F327-P595 HydrophobicContact CZ-CG 3.67Å; L504-P595 HydrophobicContact CD2-CG 4.34Å; P595-R601 HydrophobicContact CB-CB 4.47Å; P595-F604 HydrophobicContact CG-CB 4.14Å
596	A	83.8	Confident	81.1	Confident	65 Å²	65	65.7 Å²	65.7	54%	0.537	34%	0.335	S	S	.	.	S	Bend	trans	-72.5	-37	176.1	0	0	0	0	0	112
597	E	83.6	Confident	81.7	Confident	86 Å²	86	66.3 Å²	66.3	40%	0.402	34%	0.338	S	S	.	.	S	Bend	trans	-78.8	134.2	-179.1	-59.7	178	-131.5	0	0	111.3	E599 Y600 R601	E597-E599 VanDerWaalsContact C-N 3.31Å; E597-E599 PolarHBondContact O-N 3.35Å; E597-Y600 HydrophobicContact CB-CD2 3.88Å; E597-Y600 HydrophobicContact CB-CE2 4.34Å; E597-Y600 PolarHBondContact O-N 2.96Å; E597-R601 VanDerWaalsContact O-CB 3.32Å; E597-R601 WeakPolarHBondContact O-CB 3.29Å; E597-R601 PolarHBondContact O-N 3.24Å
598	K	82.5	Confident	82	Confident	137 Å²	137	66.3 Å²	66.3	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-58.2	-38.6	-173.3	-71.3	174.7	176.5	167.6	0	113.5	E52 R601 T602	E52-K598 IonicContact OE1-NZ 3.13Å; E52-K598 PolarHBondContact OE1-NZ 3.28Å; K598-R601 PolarHBondContact O-N 3.13Å; K598-T602 PolarHBondContact O-N 2.78Å; K598-T602 PolarHBondContact O-OG1 2.81Å
599	E	82.8	Confident	82.4	Confident	136 Å²	136	69.4 Å²	69.4	64%	0.636	35%	0.351	S	S	*	.	H	α-helix	trans	-57.5	-60.4	179.1	-177.1	-178	169.9	0	0	110.7	E597 R601 T602 E603	E597-E599 VanDerWaalsContact C-N 3.31Å; E597-E599 PolarHBondContact O-N 3.35Å; E599-R601 VanDerWaalsContact C-N 3.3Å; E599-R601 PolarHBondContact O-N 2.84Å; E599-T602 PolarHBondContact O-N 3.44Å; E599-E603 PolarHBondContact O-N 2.75Å
600	Y	88.4	Confident	82.7	Confident	33 Å²	33	70 Å²	70	13%	0.129	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-30	-179.8	-52.1	-50.8	0	0	0	112.8	F327 K328 E597 T602 E603 F604	F327-Y600 HydrophobicContact CB-CD2 3.66Å; F327-Y600 HydrophobicContact CB-CE2 3.61Å; F327-Y600 AromaticContact CD1-CD1 3.87Å; F327-Y600 HydrophobicContact CD1-CD1 3.87Å; F327-Y600 AromaticContact CD1-CD2 3.16Å; F327-Y600 HydrophobicContact CD1-CD2 3.16Å; F327-Y600 HydrophobicContact CD1-CE1 4.2Å; F327-Y600 AromaticContact CD1-CE2 3.54Å; F327-Y600 HydrophobicContact CD1-CE2 3.54Å; F327-Y600 AromaticContact CD1-CG 3.35Å; F327-Y600 HydrophobicContact CD1-CG 3.35Å; F327-Y600 HydrophobicContact CD2-CD2 4.26Å; F327-Y600 AromaticContact CE1-CD1 3.93Å; F327-Y600 HydrophobicContact CE1-CD1 3.93Å; F327-Y600 AromaticContact CE1-CD2 3.81Å; F327-Y600 HydrophobicContact CE1-CD2 3.81Å; F327-Y600 HydrophobicContact CE1-CE2 4.49Å; F327-Y600 AromaticContact CE1-CG 3.49Å; F327-Y600 HydrophobicContact CE1-CG 3.49Å; F327-Y600 VanDerWaalsContact CE1-CG 3.49Å; F327-Y600 AromaticContact CG-CD2 3.43Å; F327-Y600 HydrophobicContact CG-CD2 3.43Å; F327-Y600 VanDerWaalsContact CG-CD2 3.43Å; F327-Y600 AromaticContact CG-CE2 3.83Å; F327-Y600 HydrophobicContact CG-CE2 3.83Å; F327-Y600 HydrophobicContact CG-CG 4.03Å; F327-Y600 HydrophobicContact CZ-CG 4.27Å; K328-Y600 HydrophobicContact CD-CE1 4.39Å; K328-Y600 HydrophobicContact CG-CE1 4.18Å; E597-Y600 HydrophobicContact CB-CD2 3.88Å; E597-Y600 HydrophobicContact CB-CE2 4.34Å; E597-Y600 PolarHBondContact O-N 2.96Å; Y600-T602 VanDerWaalsContact C-N 3.32Å; Y600-T602 PolarHBondContact O-N 3.36Å; Y600-E603 PolarHBondContact O-N 3.13Å; Y600-F604 VanDerWaalsContact O-CB 3.29Å; Y600-F604 WeakPolarHBondContact O-CB 3.03Å; Y600-F604 PolarHBondContact O-N 3.33Å
601	R	87.8	Confident	82.7	Confident	70 Å²	70	70.3 Å²	70.3	26%	0.264	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-39.1	174.6	-172.4	176	-179.7	82.5	7	111.8	H591 E592 P595 E597 K598 E599 F604 I605	H591-R601 PolarHBondContact O-NH2 3.02Å; E592-R601 PolarHBondContact O-NH1 3.48Å; P595-R601 HydrophobicContact CB-CB 4.47Å; E597-R601 VanDerWaalsContact O-CB 3.32Å; E597-R601 WeakPolarHBondContact O-CB 3.29Å; E597-R601 PolarHBondContact O-N 3.24Å; K598-R601 PolarHBondContact O-N 3.13Å; E599-R601 VanDerWaalsContact C-N 3.3Å; E599-R601 PolarHBondContact O-N 2.84Å; R601-F604 PolarHBondContact O-N 3.23Å; R601-I605 HydrophobicContact CG-CD1 4.15Å; R601-I605 VanDerWaalsContact O-CG1 3.27Å; R601-I605 WeakPolarHBondContact O-CG1 3.25Å; R601-I605 PolarHBondContact O-N 3.03Å
602	T	86.7	Confident	83	Confident	96 Å²	96	68.9 Å²	68.9	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-67.2	-43.8	177.7	-55.9	0	0	0	0	110.9	K598 E599 Y600 I605 S606	K598-T602 PolarHBondContact O-N 2.78Å; K598-T602 PolarHBondContact O-OG1 2.81Å; E599-T602 PolarHBondContact O-N 3.44Å; Y600-T602 VanDerWaalsContact C-N 3.32Å; Y600-T602 PolarHBondContact O-N 3.36Å; T602-I605 PolarHBondContact O-N 3.11Å; T602-S606 PolarHBondContact O-N 3.29Å
603	E	86.7	Confident	83.3	Confident	93 Å²	93	66.2 Å²	66.2	44%	0.435	35%	0.346	S	S	.	.	H	α-helix	trans	-62	-42.5	174.5	-170.1	179.5	173.9	0	0	112.2	L504 E599 Y600 I605 S606 M607	L504-E603 HydrophobicContact CD1-CB 4.22Å; L504-E603 HydrophobicContact CD1-CG 3.72Å; L504-E603 WeakPolarHBondContact CD1-OE1 3.35Å; L504-E603 VanDerWaalsContact CD1-OE2 3.3Å; L504-E603 WeakPolarHBondContact CD1-OE2 3.38Å; E599-E603 PolarHBondContact O-N 2.75Å; Y600-E603 PolarHBondContact O-N 3.13Å; E603-I605 PolarHBondContact O-N 3.37Å; E603-S606 PolarHBondContact O-N 2.99Å; E603-S606 PolarHBondContact O-OG 3.1Å; E603-M607 WeakPolarHBondContact O-CB 2.74Å; E603-M607 PolarHBondContact O-N 3.41Å
604	F	88.2	Confident	82.7	Confident	8 Å²	8	69.8 Å²	69.8	4%	0.035	37%	0.365	C	S	.	.	H	α-helix	trans	-59.7	-45.9	174.6	173.9	-111.7	0	0	0	112.4	F120 D501 L504 P595 Y600 R601 M607 I608	F120-F604 HydrophobicContact CE1-CE2 4.4Å; F120-F604 AromaticContact CZ-CD2 3.81Å; F120-F604 HydrophobicContact CZ-CD2 3.81Å; F120-F604 AromaticContact CZ-CE2 3.72Å; F120-F604 HydrophobicContact CZ-CE2 3.72Å; F120-F604 HydrophobicContact CZ-CG 4.39Å; F120-F604 HydrophobicContact CZ-CZ 4.21Å; D501-F604 WeakPolarHBondContact OD1-CE2 3.11Å; L504-F604 HydrophobicContact CD2-CB 3.83Å; L504-F604 HydrophobicContact CD2-CD2 4.37Å; P595-F604 HydrophobicContact CG-CB 4.14Å; Y600-F604 VanDerWaalsContact O-CB 3.29Å; Y600-F604 WeakPolarHBondContact O-CB 3.03Å; Y600-F604 PolarHBondContact O-N 3.33Å; R601-F604 PolarHBondContact O-N 3.23Å; F604-M607 HydrophobicContact CD2-CE 3.69Å; F604-M607 HydrophobicContact CE2-CE 4.15Å; F604-M607 WeakPolarHBondContact O-CB 3.26Å; F604-M607 PolarHBondContact O-N 2.96Å; F604-I608 HydrophobicContact CD1-CD1 4.1Å; F604-I608 HydrophobicContact CD2-CD1 4.32Å; F604-I608 HydrophobicContact CE1-CD1 3.53Å; F604-I608 HydrophobicContact CE2-CD1 3.76Å; F604-I608 HydrophobicContact CE2-CG1 4.34Å; F604-I608 HydrophobicContact CG-CD1 4.48Å; F604-I608 HydrophobicContact CZ-CD1 3.35Å; F604-I608 HydrophobicContact CZ-CG1 4.39Å; F604-I608 WeakPolarHBondContact O-CG1 3.37Å; F604-I608 PolarHBondContact O-N 2.87Å
605	I	86.1	Confident	81.7	Confident	67 Å²	67	75.4 Å²	75.4	34%	0.344	39%	0.39	S	S	.	.	H	α-helix	trans	-65.3	-40.4	178.7	-69.4	167	0	0	0	111	R601 T602 E603 M607 I608 K609	R601-I605 HydrophobicContact CG-CD1 4.15Å; R601-I605 VanDerWaalsContact O-CG1 3.27Å; R601-I605 WeakPolarHBondContact O-CG1 3.25Å; R601-I605 PolarHBondContact O-N 3.03Å; T602-I605 PolarHBondContact O-N 3.11Å; E603-I605 PolarHBondContact O-N 3.37Å; I605-M607 VanDerWaalsContact C-N 3.35Å; I605-I608 PolarHBondContact O-N 3.34Å; I605-K609 HydrophobicContact CG2-CD 4.09Å; I605-K609 HydrophobicContact CG2-CG 4.43Å; I605-K609 WeakPolarHBondContact O-CG 3.02Å; I605-K609 PolarHBondContact O-N 3.41Å
606	S	83.6	Confident	80.9	Confident	65 Å²	65	81.9 Å²	81.9	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-65.8	-38.9	177.4	76.7	0	0	0	0	111.6	T602 E603 I608 K609 S610	T602-S606 PolarHBondContact O-N 3.29Å; E603-S606 PolarHBondContact O-N 2.99Å; E603-S606 PolarHBondContact O-OG 3.1Å; S606-I608 PolarHBondContact O-N 3.3Å; S606-K609 PolarHBondContact O-N 3.48Å; S606-S610 WeakPolarHBondContact O-CB 3.42Å; S606-S610 PolarHBondContact O-N 2.93Å; S606-S610 PolarHBondContact O-OG 3.26Å; S606-S610 VanDerWaalsContact O-OG 3.08Å
607	M	83.2	Confident	80.1	Confident	36 Å²	36	81.2 Å²	81.2	18%	0.177	41%	0.406	C	S	.	.	H	α-helix	trans	-60.8	-42.1	172.9	-179.3	-173.2	55.6	0	0	111.8	R500 E603 F604 I605 S610 N611	R500-M607 HydrophobicContact CB-CE 4.29Å; R500-M607 HydrophobicContact CB-SD 3.77Å; R500-M607 HydrophobicContact CG-SD 4.44Å; E603-M607 WeakPolarHBondContact O-CB 2.74Å; E603-M607 PolarHBondContact O-N 3.41Å; F604-M607 HydrophobicContact CD2-CE 3.69Å; F604-M607 HydrophobicContact CE2-CE 4.15Å; F604-M607 WeakPolarHBondContact O-CB 3.26Å; F604-M607 PolarHBondContact O-N 2.96Å; I605-M607 VanDerWaalsContact C-N 3.35Å; M607-S610 PolarHBondContact O-OG 3.44Å; M607-N611 PolarHBondContact O-N 2.89Å; M607-N611 PolarHBondContact O-ND2 3.19Å
608	I	82.3	Confident	79.1	Confident	53 Å²	53	84.6 Å²	84.6	27%	0.272	42%	0.415	S	S	.	.	H	α-helix	trans	-65.8	-49.9	176.4	-69.2	173.1	0	0	0	110.6	F604 I605 S606 S610 N611 E612	F604-I608 HydrophobicContact CD1-CD1 4.1Å; F604-I608 HydrophobicContact CD2-CD1 4.32Å; F604-I608 HydrophobicContact CE1-CD1 3.53Å; F604-I608 HydrophobicContact CE2-CD1 3.76Å; F604-I608 HydrophobicContact CE2-CG1 4.34Å; F604-I608 HydrophobicContact CG-CD1 4.48Å; F604-I608 HydrophobicContact CZ-CD1 3.35Å; F604-I608 HydrophobicContact CZ-CG1 4.39Å; F604-I608 WeakPolarHBondContact O-CG1 3.37Å; F604-I608 PolarHBondContact O-N 2.87Å; I605-I608 PolarHBondContact O-N 3.34Å; S606-I608 PolarHBondContact O-N 3.3Å; I608-S610 VanDerWaalsContact C-N 3.34Å; I608-S610 PolarHBondContact O-N 3.19Å; I608-N611 PolarHBondContact O-N 2.76Å; I608-N611 VanDerWaalsContact O-N 3.11Å; I608-E612 PolarHBondContact O-N 3.25Å
609	K	81.5	Confident	78	Confident	135 Å²	135	82.7 Å²	82.7	59%	0.587	41%	0.41	S	S	*	.	H	α-helix	trans	-58.3	-43	-178.8	-74.9	177.6	179.1	178.2	0	112.6	I605 S606 N611 E612 S613	I605-K609 HydrophobicContact CG2-CD 4.09Å; I605-K609 HydrophobicContact CG2-CG 4.43Å; I605-K609 WeakPolarHBondContact O-CG 3.02Å; I605-K609 PolarHBondContact O-N 3.41Å; S606-K609 PolarHBondContact O-N 3.48Å; K609-N611 VanDerWaalsContact C-N 3.32Å; K609-N611 PolarHBondContact O-N 3.14Å; K609-E612 PolarHBondContact O-N 3.43Å; K609-S613 PolarHBondContact O-N 3.34Å; K609-S613 PolarHBondContact O-OG 3.15Å
610	S	79.3	Confident	76.5	Confident	62 Å²	62	82.4 Å²	82.4	43%	0.434	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-33.7	177.6	60.9	0	0	0	0	113	S606 M607 I608 S613 L614	S606-S610 WeakPolarHBondContact O-CB 3.42Å; S606-S610 PolarHBondContact O-N 2.93Å; S606-S610 PolarHBondContact O-OG 3.26Å; S606-S610 VanDerWaalsContact O-OG 3.08Å; M607-S610 PolarHBondContact O-OG 3.44Å; I608-S610 VanDerWaalsContact C-N 3.34Å; I608-S610 PolarHBondContact O-N 3.19Å; S610-S613 WeakPolarHBondContact CA-OG 3.31Å; S610-S613 PolarHBondContact O-OG 2.63Å; S610-L614 VanDerWaalsContact O-CB 3.25Å; S610-L614 WeakPolarHBondContact O-CB 3.24Å; S610-L614 PolarHBondContact O-N 3.18Å; S610-L614 VanDerWaalsContact O-N 3.08Å
611	N	74.2	Confident	74.7	Confident	48 Å²	48	86.7 Å²	86.7	26%	0.257	43%	0.429	S	S	.	.	H	α-helix	trans	-71.9	-40	174.4	-77.9	-68.3	0	0	0	112.1	R500 M607 I608 K609 L614 H615	R500-N611 PolarHBondContact NH1-ND2 3.26Å; R500-N611 PolarHBondContact NH1-OD1 3.21Å; R500-N611 PolarHBondContact NH2-OD1 3.19Å; M607-N611 PolarHBondContact O-N 2.89Å; M607-N611 PolarHBondContact O-ND2 3.19Å; I608-N611 PolarHBondContact O-N 2.76Å; I608-N611 VanDerWaalsContact O-N 3.11Å; K609-N611 VanDerWaalsContact C-N 3.32Å; K609-N611 PolarHBondContact O-N 3.14Å; N611-L614 PolarHBondContact O-N 3.03Å; N611-H615 WeakPolarHBondContact O-CB 3.16Å; N611-H615 PolarHBondContact O-N 3.14Å
612	E	75.4	Confident	72.6	Confident	119 Å²	119	89.2 Å²	89.2	56%	0.556	45%	0.447	S	S	*	.	H	α-helix	trans	-64.1	-41.1	175.8	-70.3	-169.5	159.5	0	0	111.7	I608 K609 H615 R616	I608-E612 PolarHBondContact O-N 3.25Å; K609-E612 PolarHBondContact O-N 3.43Å; E612-H615 PolarHBondContact O-N 3.34Å; E612-R616 VanDerWaalsContact O-CB 3.32Å; E612-R616 WeakPolarHBondContact O-CB 3.25Å; E612-R616 PolarHBondContact O-N 2.85Å
613	S	74.7	Confident	70.3	Confident	69 Å²	69	85.7 Å²	85.7	48%	0.483	43%	0.43	S	S	.	.	H	α-helix	trans	-65	-43	176.4	66.7	0	0	0	0	111.7	K609 S610 H615 R616 S617	K609-S613 PolarHBondContact O-N 3.34Å; K609-S613 PolarHBondContact O-OG 3.15Å; S610-S613 WeakPolarHBondContact CA-OG 3.31Å; S610-S613 PolarHBondContact O-OG 2.63Å; S613-H615 VanDerWaalsContact C-N 3.34Å; S613-H615 PolarHBondContact O-N 3.36Å; S613-R616 WeakPolarHBondContact O-CB 3.4Å; S613-R616 PolarHBondContact O-N 3.13Å; S613-S617 PolarHBondContact O-N 2.91Å
614	L	70.4	Confident	68.1	Low	83 Å²	83	87.5 Å²	87.5	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-70.5	-29.8	179	-160.6	146.3	0	0	0	112.4	S610 N611 S617 R618	S610-L614 VanDerWaalsContact O-CB 3.25Å; S610-L614 WeakPolarHBondContact O-CB 3.24Å; S610-L614 PolarHBondContact O-N 3.18Å; S610-L614 VanDerWaalsContact O-N 3.08Å; N611-L614 PolarHBondContact O-N 3.03Å; L614-S617 PolarHBondContact O-OG 3.35Å; L614-R618 VanDerWaalsContact CD2-NE 3.33Å; L614-R618 WeakPolarHBondContact O-CG 3.05Å; L614-R618 PolarHBondContact O-N 3.23Å
615	H	67.6	Low	65.8	Low	122 Å²	122	89.9 Å²	89.9	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-70.2	-41.4	169.9	-167.3	55.3	0	0	0	111.3	N611 E612 S613 R618 I619	N611-H615 WeakPolarHBondContact O-CB 3.16Å; N611-H615 PolarHBondContact O-N 3.14Å; E612-H615 PolarHBondContact O-N 3.34Å; S613-H615 VanDerWaalsContact C-N 3.34Å; S613-H615 PolarHBondContact O-N 3.36Å; H615-R618 PolarHBondContact O-N 3.3Å; H615-I619 WeakPolarHBondContact O-CG1 3.39Å; H615-I619 PolarHBondContact O-N 2.85Å
616	R	69.5	Low	63.3	Low	136 Å²	136	91.3 Å²	91.3	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-64.2	-41.3	176.8	-166.5	-174.2	-64.8	-158.8	1.3	111.8	E612 S613 I619 Y620	E612-R616 VanDerWaalsContact O-CB 3.32Å; E612-R616 WeakPolarHBondContact O-CB 3.25Å; E612-R616 PolarHBondContact O-N 2.85Å; S613-R616 WeakPolarHBondContact O-CB 3.4Å; S613-R616 PolarHBondContact O-N 3.13Å; R616-I619 PolarHBondContact O-N 3.39Å; R616-Y620 HydrophobicContact CG-CD2 3.92Å; R616-Y620 HydrophobicContact CG-CE2 3.57Å; R616-Y620 WeakPolarHBondContact O-CD2 3.33Å; R616-Y620 PolarHBondContact O-N 2.83Å; R616-Y620 VanDerWaalsContact O-N 3.11Å
617	S	66.9	Low	61	Low	51 Å²	51	90.1 Å²	90.1	36%	0.357	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-43.4	177.4	71	0	0	0	0	112	S613 L614 I619 Y620 D621	S613-S617 PolarHBondContact O-N 2.91Å; L614-S617 PolarHBondContact O-OG 3.35Å; S617-I619 PolarHBondContact O-N 3.25Å; S617-Y620 PolarHBondContact O-N 3.07Å; S617-D621 PolarHBondContact O-N 3.43Å
618	R	63.7	Low	58.6	Low	157 Å²	157	92.5 Å²	92.5	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-60.5	-33.1	174.9	-72.3	-174.2	-140	-175.7	2.5	113.3	L614 H615 I622	L614-R618 VanDerWaalsContact CD2-NE 3.33Å; L614-R618 WeakPolarHBondContact O-CG 3.05Å; L614-R618 PolarHBondContact O-N 3.23Å; H615-R618 PolarHBondContact O-N 3.3Å; R618-I622 WeakPolarHBondContact O-CD1 3.41Å; R618-I622 VanDerWaalsContact O-CG1 3.29Å; R618-I622 WeakPolarHBondContact O-CG1 3.35Å; R618-I622 PolarHBondContact O-N 3.46Å
619	I	58.2	Low	56.3	Low	97 Å²	97	93.8 Å²	93.8	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-70.1	-39.3	175.4	-66.6	166.7	0	0	0	110.2	H615 R616 S617 I622	H615-I619 WeakPolarHBondContact O-CG1 3.39Å; H615-I619 PolarHBondContact O-N 2.85Å; R616-I619 PolarHBondContact O-N 3.39Å; S617-I619 PolarHBondContact O-N 3.25Å; I619-I622 CarbonylContact O-C 3.58Å; I619-I622 PolarHBondContact O-N 3.35Å
620	Y	51.2	Low	54	Low	130 Å²	130	91.9 Å²	91.9	51%	0.51	51%	0.509	S	S	.	.	H	α-helix	trans	-70.4	-35.8	176.9	-79.4	-63.7	0	0	0	114	R616 S617 I622 G623 K725	R616-Y620 HydrophobicContact CG-CD2 3.92Å; R616-Y620 HydrophobicContact CG-CE2 3.57Å; R616-Y620 WeakPolarHBondContact O-CD2 3.33Å; R616-Y620 PolarHBondContact O-N 2.83Å; R616-Y620 VanDerWaalsContact O-N 3.11Å; S617-Y620 PolarHBondContact O-N 3.07Å; Y620-I622 PolarHBondContact O-N 3.17Å; Y620-G623 PolarHBondContact O-N 3.27Å; Y620-K725 WeakPolarHBondContact OH-CE 3.28Å; Y620-K725 PolarHBondContact OH-NZ 2.84Å
621	D	51.5	Low	51.6	Low	124 Å²	124	93.5 Å²	93.5	66%	0.663	51%	0.511	S	S	*	.	H	α-helix	trans	-65.8	-24.6	174.8	-70.1	-28.4	0	0	0	112	S617 G623	S617-D621 PolarHBondContact O-N 3.43Å; D621-G623 PolarHBondContact O-N 3.03Å
622	I	43	Very low	49.5	Very low	122 Å²	122	94.2 Å²	94.2	63%	0.626	52%	0.523	S	S	*	.	S	Bend	trans	-84.2	58.1	167.3	-52.9	163.9	0	0	0	108.2	R618 I619 Y620	R618-I622 WeakPolarHBondContact O-CD1 3.41Å; R618-I622 VanDerWaalsContact O-CG1 3.29Å; R618-I622 WeakPolarHBondContact O-CG1 3.35Å; R618-I622 PolarHBondContact O-N 3.46Å; I619-I622 CarbonylContact O-C 3.58Å; I619-I622 PolarHBondContact O-N 3.35Å; Y620-I622 PolarHBondContact O-N 3.17Å
623	G	38.6	Very low	47.3	Very low	23 Å²	23	95.5 Å²	95.5	24%	0.237	53%	0.529	C	S	.	.			trans	-65.3	158.6	172.6	0	0	0	0	0	111.7	Y620 D621 G625 N626	Y620-G623 PolarHBondContact O-N 3.27Å; D621-G623 PolarHBondContact O-N 3.03Å; G623-G625 PolarHBondContact O-N 3.03Å; G623-N626 PolarHBondContact O-N 2.81Å; G623-N626 VanDerWaalsContact O-N 3.1Å
624	P	41.8	Very low	45.3	Very low	131 Å²	131	95.4 Å²	95.4	85%	0.851	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-16	-173	21.2	-31.4	0	0	0	114.8
625	G	39.1	Very low	43.3	Very low	57 Å²	57	97.5 Å²	97.5	59%	0.588	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-24.7	177	0	0	0	0	0	115.6	G623	G623-G625 PolarHBondContact O-N 3.03Å
626	N	34	Very low	41.4	Very low	97 Å²	97	95.5 Å²	95.5	52%	0.519	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-6.8	-173.5	-75.8	-7.8	0	0	0	114.2	G623 S628 T630	G623-N626 PolarHBondContact O-N 2.81Å; G623-N626 VanDerWaalsContact O-N 3.1Å; N626-S628 PolarHBondContact O-N 2.92Å; N626-T630 WeakPolarHBondContact O-CB 3.27Å; N626-T630 PolarHBondContact O-N 3.22Å; N626-T630 VanDerWaalsContact O-N 3.11Å; N626-T630 PolarHBondContact O-OG1 2.62Å
627	A	36.1	Very low	39.3	Very low	40 Å²	40	95.8 Å²	95.8	33%	0.331	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-34.1	173.6	0	0	0	0	0	111.9	M631	A627-M631 WeakPolarHBondContact O-CB 3.26Å; A627-M631 WeakPolarHBondContact O-CG 3.34Å; A627-M631 PolarHBondContact O-N 2.6Å
628	S	32.8	Very low	37.4	Very low	86 Å²	86	97.5 Å²	97.5	60%	0.601	57%	0.567	S	S	*	*	H	α-helix	trans	-74.5	-41.3	-179	-50.4	0	0	0	0	112.9	N626 A632	N626-S628 PolarHBondContact O-N 2.92Å; S628-A632 VanDerWaalsContact O-CB 3.28Å; S628-A632 WeakPolarHBondContact O-CB 3.23Å; S628-A632 PolarHBondContact O-N 2.91Å
629	T	32.3	Very low	35.5	Very low	80 Å²	80	99.3 Å²	99.3	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-77.5	-37	-178.2	20.2	0	0	0	0	112.7	A632 H633	T629-A632 PolarHBondContact O-N 2.85Å; T629-H633 PolarHBondContact O-N 2.78Å; T629-H633 VanDerWaalsContact O-N 3.07Å
630	T	34.2	Very low	33.8	Very low	96 Å²	96	103.6 Å²	103.6	59%	0.589	60%	0.602	S	S	*	*	H	α-helix	trans	-71.9	-34.1	177.9	-31.9	0	0	0	0	111.4	N626 A634	N626-T630 WeakPolarHBondContact O-CB 3.27Å; N626-T630 PolarHBondContact O-N 3.22Å; N626-T630 VanDerWaalsContact O-N 3.11Å; N626-T630 PolarHBondContact O-OG1 2.62Å; T630-A634 WeakPolarHBondContact O-CB 3.39Å; T630-A634 PolarHBondContact O-N 3.39Å
631	M	28.3	Very low	32.3	Very low	96 Å²	96	105.9 Å²	105.9	47%	0.473	62%	0.618	S	S	.	*	H	α-helix	trans	-73.1	-36.8	171.8	-76.9	-159.6	-78	0	0	113	A627 H633 A634 L635	A627-M631 WeakPolarHBondContact O-CB 3.26Å; A627-M631 WeakPolarHBondContact O-CG 3.34Å; A627-M631 PolarHBondContact O-N 2.6Å; M631-H633 VanDerWaalsContact C-N 3.34Å; M631-H633 PolarHBondContact O-N 3.45Å; M631-A634 PolarHBondContact O-N 3.38Å; M631-L635 WeakPolarHBondContact O-CB 3.44Å; M631-L635 WeakPolarHBondContact O-CD1 3.4Å; M631-L635 WeakPolarHBondContact O-CG 3.46Å; M631-L635 PolarHBondContact O-N 2.79Å
632	A	30.7	Very low	30.9	Very low	62 Å²	62	108.4 Å²	108.4	51%	0.512	63%	0.627	S	S	.	*	H	α-helix	trans	-63.4	-38.7	175.5	0	0	0	0	0	112.3	S628 T629 S636	S628-A632 VanDerWaalsContact O-CB 3.28Å; S628-A632 WeakPolarHBondContact O-CB 3.23Å; S628-A632 PolarHBondContact O-N 2.91Å; T629-A632 PolarHBondContact O-N 2.85Å; A632-S636 PolarHBondContact O-N 3.46Å
633	H	29.8	Very low	29.8	Very low	146 Å²	146	109.3 Å²	109.3	68%	0.676	63%	0.634	S	S	*	*	H	α-helix	trans	-72.8	-31	175.5	-105.7	-78.2	0	0	0	113.8	T629 M631	T629-H633 PolarHBondContact O-N 2.78Å; T629-H633 VanDerWaalsContact O-N 3.07Å; M631-H633 VanDerWaalsContact C-N 3.34Å; M631-H633 PolarHBondContact O-N 3.45Å
634	A	31.6	Very low	29	Very low	67 Å²	67	117.8 Å²	117.8	55%	0.554	66%	0.664	S	S	*	*	H	α-helix	trans	-76.2	-32.3	176.7	0	0	0	0	0	112.6	T630 M631	T630-A634 WeakPolarHBondContact O-CB 3.39Å; T630-A634 PolarHBondContact O-N 3.39Å; M631-A634 PolarHBondContact O-N 3.38Å
635	L	28.6	Very low	28	Very low	128 Å²	128	119.3 Å²	119.3	67%	0.67	67%	0.665	S	S	*	*	H	α-helix	trans	-83.3	-20.4	-178.4	-72	164.7	0	0	0	113.7	M631 N637	M631-L635 WeakPolarHBondContact O-CB 3.44Å; M631-L635 WeakPolarHBondContact O-CD1 3.4Å; M631-L635 WeakPolarHBondContact O-CG 3.46Å; M631-L635 PolarHBondContact O-N 2.79Å; L635-N637 VanDerWaalsContact C-N 3.27Å; L635-N637 PolarHBondContact O-N 3.39Å
636	S	27.8	Very low	27.3	Very low	80 Å²	80	124.8 Å²	124.8	56%	0.559	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-17.5	177.9	87.8	0	0	0	0	114	A632	A632-S636 PolarHBondContact O-N 3.46Å
637	N	25.8	Very low	26.7	Very low	141 Å²	141	123.9 Å²	123.9	75%	0.754	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	17.2	-171.6	-78.5	-0.5	0	0	0	115.1	L635	L635-N637 VanDerWaalsContact C-N 3.27Å; L635-N637 PolarHBondContact O-N 3.39Å
638	S	27.4	Very low	26.1	Very low	87 Å²	87	125.9 Å²	125.9	61%	0.608	72%	0.718	S	S	*	*			trans	-133.1	74.4	173.8	43.2	0	0	0	0	112.1	M640	S638-M640 PolarHBondContact O-N 3.29Å; S638-M640 VanDerWaalsContact O-N 3.16Å
639	Q	22.5	Very low	25.7	Very low	195 Å²	195	126.4 Å²	126.4	91%	0.911	72%	0.722	S	S	*	*			trans	-65.9	102.7	158.9	-72.4	-175.4	-20.3	0	0	109.5
640	M	22.7	Very low	25.3	Very low	187 Å²	187	129.2 Å²	129.2	92%	0.921	73%	0.732	S	S	*	*			trans	-158.1	99.2	142.3	-112.8	-171.4	-162.8	0	0	109	S638	S638-M640 PolarHBondContact O-N 3.29Å; S638-M640 VanDerWaalsContact O-N 3.16Å
641	Q	20.7	Very low	25	Very low	179 Å²	179	131 Å²	131	84%	0.836	74%	0.743	S	S	*	*			trans	-69.5	126.2	168.1	-70.9	172.8	-35.9	0	0	109.5
642	M	20.6	Very low	24.9	Very low	176 Å²	176	130.8 Å²	130.8	87%	0.867	75%	0.751	S	S	*	*			trans	-138.8	105.8	149.7	-77.3	-62.3	-87.9	0	0	108
643	N	19.9	Very low	24.6	Very low	142 Å²	142	129.8 Å²	129.8	76%	0.759	75%	0.747	S	S	*	*			trans	-70.1	122.4	178.3	-82.9	-24.1	0	0	0	111
644	F	22.7	Very low	24.3	Very low	201 Å²	201	128.8 Å²	128.8	88%	0.882	75%	0.746	S	S	*	*			trans	-131.9	107.3	147.1	-93	-82.9	0	0	0	108.8	L646	F644-L646 PolarHBondContact O-N 2.81Å
645	N	20.3	Very low	24	Very low	163 Å²	163	128.8 Å²	128.8	87%	0.872	75%	0.746	S	S	*	*			trans	-65	111.4	169.6	-95.1	-20.3	0	0	0	109.3
646	L	24.8	Very low	23.9	Very low	171 Å²	171	128.6 Å²	128.6	90%	0.895	75%	0.75	S	S	*	*			trans	-131.5	113.4	155.5	-148.6	78.7	0	0	0	108	F644	F644-L646 PolarHBondContact O-N 2.81Å
647	G	21.2	Very low	23.9	Very low	78 Å²	78	128 Å²	128	80%	0.804	75%	0.75	S	S	*	*			trans	-67.3	144.9	-170.3	0	0	0	0	0	113.9
648	G	23.1	Very low	23.9	Very low	82 Å²	82	125.4 Å²	125.4	85%	0.845	74%	0.739	S	S	*	*	S	Bend	trans	64.9	74.3	142.2	0	0	0	0	0	117.3
649	S	24.7	Very low	23.9	Very low	98 Å²	98	124.9 Å²	124.9	69%	0.685	75%	0.748	S	S	*	*			trans	170.6	44.5	133.3	-173.3	0	0	0	0	112.3
650	I	25.1	Very low	24.1	Very low	138 Å²	138	122 Å²	122	71%	0.708	74%	0.743	S	S	*	*			trans	-104.3	1.1	170.3	-57.6	177.2	0	0	0	111.5	S652 G653 L654	I650-S652 PolarHBondContact O-N 2.62Å; I650-G653 WeakPolarHBondContact O-CA 3.46Å; I650-G653 PolarHBondContact O-N 2.77Å; I650-L654 PolarHBondContact O-N 3.07Å; I650-L654 VanDerWaalsContact O-N 3.08Å
651	V	26.4	Very low	24.4	Very low	133 Å²	133	120 Å²	120	81%	0.806	73%	0.733	S	S	*	*	H	α-helix	trans	-66.4	-23.6	174.8	-176.9	0	0	0	0	111.9	G653	V651-G653 VanDerWaalsContact C-N 3.33Å
652	S	26.7	Very low	24.8	Very low	92 Å²	92	115 Å²	115	64%	0.643	71%	0.712	S	S	*	*	H	α-helix	trans	-76.7	-17	167.5	51.7	0	0	0	0	113.9	I650	I650-S652 PolarHBondContact O-N 2.62Å
653	G	23.7	Very low	25.2	Very low	41 Å²	41	111.2 Å²	111.2	42%	0.423	70%	0.695	S	S	.	*	H	α-helix	trans	-85.1	-26.9	173.5	0	0	0	0	0	113.5	I650 V651 V656	I650-G653 WeakPolarHBondContact O-CA 3.46Å; I650-G653 PolarHBondContact O-N 2.77Å; V651-G653 VanDerWaalsContact C-N 3.33Å; G653-V656 WeakPolarHBondContact O-CB 3.14Å; G653-V656 PolarHBondContact O-N 3.38Å
654	L	23.2	Very low	25.7	Very low	125 Å²	125	108.8 Å²	108.8	65%	0.654	69%	0.686	S	S	*	*	H	α-helix	trans	-82.5	-17.8	-177.2	-153	67.8	0	0	0	113.7	I650 V656 A657	I650-L654 PolarHBondContact O-N 3.07Å; I650-L654 VanDerWaalsContact O-N 3.08Å; L654-V656 PolarHBondContact O-N 3.08Å; L654-A657 HydrophobicContact CD1-CB 4.33Å; L654-A657 WeakPolarHBondContact O-CB 3.25Å; L654-A657 PolarHBondContact O-N 3.37Å
655	A	26.6	Very low	26.3	Very low	68 Å²	68	106.4 Å²	106.4	56%	0.562	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-11.6	168.3	0	0	0	0	0	113.1	A657	A655-A657 VanDerWaalsContact C-N 3.33Å
656	V	26.5	Very low	27.1	Very low	123 Å²	123	102.5 Å²	102.5	75%	0.745	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-17.2	170.6	-176.9	0	0	0	0	111.6	G653 L654	G653-V656 WeakPolarHBondContact O-CB 3.14Å; G653-V656 PolarHBondContact O-N 3.38Å; L654-V656 PolarHBondContact O-N 3.08Å
657	A	27.2	Very low	27.5	Very low	68 Å²	68	98.5 Å²	98.5	56%	0.562	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-18	179.8	0	0	0	0	0	113.9	L654 A655	L654-A657 HydrophobicContact CD1-CB 4.33Å; L654-A657 WeakPolarHBondContact O-CB 3.25Å; L654-A657 PolarHBondContact O-N 3.37Å; A655-A657 VanDerWaalsContact C-N 3.33Å
658	T	25.5	Very low	28.2	Very low	86 Å²	86	100.5 Å²	100.5	53%	0.528	61%	0.614	S	S	.	*	S	Bend	trans	-105.6	91.3	171.2	53.6	0	0	0	0	108.8	V660	T658-V660 PolarHBondContact O-N 2.99Å
659	G	28.2	Very low	29.1	Very low	77 Å²	77	99.3 Å²	99.3	79%	0.794	59%	0.593	S	S	*	*			trans	-66.3	55.6	-173.4	0	0	0	0	0	116.4	M661	G659-M661 VanDerWaalsContact C-N 3.26Å; G659-M661 PolarHBondContact O-N 2.72Å
660	V	27.1	Very low	29.7	Very low	133 Å²	133	99.5 Å²	99.5	81%	0.806	58%	0.582	S	S	*	*			trans	-84.8	80.3	156.7	-173	0	0	0	0	106.4	T658 D662	T658-V660 PolarHBondContact O-N 2.99Å; V660-D662 PolarHBondContact O-N 3.17Å
661	M	28.1	Very low	30.5	Very low	147 Å²	147	96.9 Å²	96.9	72%	0.724	57%	0.569	S	S	*	*			trans	-59.1	123.9	157.9	-78.4	-170.1	175.8	0	0	106.3	G659 D663	G659-M661 VanDerWaalsContact C-N 3.26Å; G659-M661 PolarHBondContact O-N 2.72Å; M661-D663 VanDerWaalsContact C-N 3.31Å; M661-D663 PolarHBondContact O-N 3.1Å
662	D	29.1	Very low	31.5	Very low	73 Å²	73	96.1 Å²	96.1	39%	0.39	56%	0.555	S	S	.	*			trans	-56.6	96.4	170	176.9	7.7	0	0	0	108.3	V660 T664 K665 F666	V660-D662 PolarHBondContact O-N 3.17Å; D662-T664 PolarHBondContact O-N 3.46Å; D662-T664 WeakPolarHBondContact OD1-CB 3.32Å; D662-T664 PolarHBondContact OD1-N 3.12Å; D662-T664 PolarHBondContact OD1-OG1 2.97Å; D662-K665 HydrophobicContact CB-CD 4.5Å; D662-K665 PolarHBondContact O-N 3.43Å; D662-K665 WeakPolarHBondContact OD2-CD 3.48Å; D662-K665 WeakPolarHBondContact OD2-CE 3.3Å; D662-K665 WeakPolarHBondContact OD2-CG 3.4Å; D662-F666 PolarHBondContact O-N 3.3Å
663	D	29	Very low	32.5	Very low	96 Å²	96	92.2 Å²	92.2	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-50	-33.2	-177.5	-87.7	-22.8	0	0	0	110.6	M661 K665 F666 F667	M661-D663 VanDerWaalsContact C-N 3.31Å; M661-D663 PolarHBondContact O-N 3.1Å; D663-K665 PolarHBondContact O-N 3.07Å; D663-F666 WeakPolarHBondContact O-CB 3.3Å; D663-F666 PolarHBondContact O-N 2.92Å; D663-F667 HydrophobicContact CB-CD2 4.13Å; D663-F667 HydrophobicContact CB-CE2 4.01Å; D663-F667 WeakPolarHBondContact O-CD2 3.5Å; D663-F667 PolarHBondContact O-N 3.5Å
664	T	31.4	Very low	33.5	Very low	91 Å²	91	92.9 Å²	92.9	56%	0.558	53%	0.528	S	S	*	.	H	α-helix	trans	-59.5	-45.8	177.9	-27.2	0	0	0	0	112.4	D662 F666 Q668	D662-T664 PolarHBondContact O-N 3.46Å; D662-T664 WeakPolarHBondContact OD1-CB 3.32Å; D662-T664 PolarHBondContact OD1-N 3.12Å; D662-T664 PolarHBondContact OD1-OG1 2.97Å; T664-F666 VanDerWaalsContact C-N 3.35Å; T664-Q668 WeakPolarHBondContact O-CB 3.28Å; T664-Q668 WeakPolarHBondContact O-CG 3.48Å; T664-Q668 PolarHBondContact O-N 2.83Å
665	K	34.3	Very low	34.8	Very low	151 Å²	151	91.7 Å²	91.7	66%	0.657	52%	0.52	S	S	*	.	H	α-helix	trans	-69.8	-33.8	177.1	-74.9	178.3	-175	173.6	0	111.8	D662 D663 S669	D662-K665 HydrophobicContact CB-CD 4.5Å; D662-K665 PolarHBondContact O-N 3.43Å; D662-K665 WeakPolarHBondContact OD2-CD 3.48Å; D662-K665 WeakPolarHBondContact OD2-CE 3.3Å; D662-K665 WeakPolarHBondContact OD2-CG 3.4Å; D663-K665 PolarHBondContact O-N 3.07Å; K665-S669 WeakPolarHBondContact O-CB 3.34Å; K665-S669 PolarHBondContact O-N 3.37Å
666	F	36.5	Very low	35.8	Very low	81 Å²	81	92.4 Å²	92.4	36%	0.355	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-47	175.4	175.4	-100	0	0	0	111.9	D662 D663 T664 S669 K670	D662-F666 PolarHBondContact O-N 3.3Å; D663-F666 WeakPolarHBondContact O-CB 3.3Å; D663-F666 PolarHBondContact O-N 2.92Å; T664-F666 VanDerWaalsContact C-N 3.35Å; F666-S669 WeakPolarHBondContact O-CB 3.36Å; F666-S669 PolarHBondContact O-N 2.85Å; F666-K670 HydrophobicContact CE1-CG 4.46Å; F666-K670 HydrophobicContact CZ-CG 4.44Å; F666-K670 PolarHBondContact O-N 2.98Å
667	F	34.9	Very low	36.7	Very low	88 Å²	88	90 Å²	90	39%	0.386	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-41.4	175.9	-74.7	-67.5	0	0	0	111.9	D663 S669 K670 L671	D663-F667 HydrophobicContact CB-CD2 4.13Å; D663-F667 HydrophobicContact CB-CE2 4.01Å; D663-F667 WeakPolarHBondContact O-CD2 3.5Å; D663-F667 PolarHBondContact O-N 3.5Å; F667-S669 VanDerWaalsContact C-N 3.28Å; F667-S669 PolarHBondContact O-N 3.47Å; F667-K670 PolarHBondContact O-N 3.36Å; F667-L671 WeakPolarHBondContact O-CB 3.43Å; F667-L671 PolarHBondContact O-N 3.19Å
668	Q	34.3	Very low	37.8	Very low	119 Å²	119	89 Å²	89	56%	0.556	48%	0.479	S	S	*	.	H	α-helix	trans	-62.8	-34.3	174.2	-78	-156.8	-7.3	0	0	112.9	T664 L671 K672	T664-Q668 WeakPolarHBondContact O-CB 3.28Å; T664-Q668 WeakPolarHBondContact O-CG 3.48Å; T664-Q668 PolarHBondContact O-N 2.83Å; Q668-L671 PolarHBondContact O-N 3.23Å; Q668-K672 WeakPolarHBondContact O-CB 3.31Å; Q668-K672 WeakPolarHBondContact O-CG 3.38Å; Q668-K672 PolarHBondContact O-N 3.47Å
669	S	42.6	Very low	39	Very low	58 Å²	58	89.5 Å²	89.5	41%	0.406	48%	0.476	S	S	.	.	H	α-helix	trans	-63.9	-48.3	172.2	177.2	0	0	0	0	111.1	K665 F666 F667 L671 K672 V673	K665-S669 WeakPolarHBondContact O-CB 3.34Å; K665-S669 PolarHBondContact O-N 3.37Å; F666-S669 WeakPolarHBondContact O-CB 3.36Å; F666-S669 PolarHBondContact O-N 2.85Å; F667-S669 VanDerWaalsContact C-N 3.28Å; F667-S669 PolarHBondContact O-N 3.47Å; S669-L671 VanDerWaalsContact C-N 3.34Å; S669-L671 PolarHBondContact O-N 3.35Å; S669-K672 PolarHBondContact O-N 3.24Å; S669-V673 WeakPolarHBondContact O-CB 3.29Å; S669-V673 WeakPolarHBondContact O-CG2 3.32Å; S669-V673 PolarHBondContact O-N 2.88Å
670	K	37.7	Very low	39.8	Very low	102 Å²	102	88.1 Å²	88.1	44%	0.443	46%	0.456	S	S	.	.	H	α-helix	trans	-60.2	-40.4	174.8	-77.2	-112.8	-176.4	177.8	0	112.7	F666 F667 V673 A674	F666-K670 HydrophobicContact CE1-CG 4.46Å; F666-K670 HydrophobicContact CZ-CG 4.44Å; F666-K670 PolarHBondContact O-N 2.98Å; F667-K670 PolarHBondContact O-N 3.36Å; K670-V673 PolarHBondContact O-N 3.02Å; K670-A674 WeakPolarHBondContact O-CB 3.41Å; K670-A674 PolarHBondContact O-N 3.39Å
671	L	41.3	Very low	40.6	Very low	83 Å²	83	87.6 Å²	87.6	44%	0.435	45%	0.445	S	S	.	.	H	α-helix	trans	-67.4	-48.3	179.2	-140.9	115.5	0	0	0	110.8	F667 Q668 S669 V673 A674 E675 V718	F667-L671 WeakPolarHBondContact O-CB 3.43Å; F667-L671 PolarHBondContact O-N 3.19Å; Q668-L671 PolarHBondContact O-N 3.23Å; S669-L671 VanDerWaalsContact C-N 3.34Å; S669-L671 PolarHBondContact O-N 3.35Å; L671-V673 VanDerWaalsContact C-N 3.25Å; L671-V673 PolarHBondContact O-N 3.27Å; L671-A674 PolarHBondContact O-N 2.89Å; L671-A674 VanDerWaalsContact O-N 3.15Å; L671-E675 WeakPolarHBondContact O-CB 3.04Å; L671-E675 VanDerWaalsContact O-CG 3.31Å; L671-E675 WeakPolarHBondContact O-CG 3.48Å; L671-E675 PolarHBondContact O-N 3.3Å; L671-V718 HydrophobicContact CD1-CG1 4.36Å
672	K	47.1	Very low	41.4	Very low	116 Å²	116	82.3 Å²	82.3	50%	0.504	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-36.1	173.3	-80	179.5	177.3	175.7	0	112.7	Q668 S669 K676	Q668-K672 WeakPolarHBondContact O-CB 3.31Å; Q668-K672 WeakPolarHBondContact O-CG 3.38Å; Q668-K672 PolarHBondContact O-N 3.47Å; S669-K672 PolarHBondContact O-N 3.24Å; K672-K676 WeakPolarHBondContact O-CB 3.49Å; K672-K676 WeakPolarHBondContact O-CG 3.35Å; K672-K676 PolarHBondContact O-N 3.42Å
673	V	47.7	Very low	42.3	Very low	11 Å²	11	84.7 Å²	84.7	7%	0.067	43%	0.428	C	S	.	.	H	α-helix	trans	-68.3	-46.8	175.3	167.2	0	0	0	0	110.3	L582 E585 S669 K670 L671 E675 K676 L677	L582-V673 HydrophobicContact CD1-CG2 4.37Å; E585-V673 HydrophobicContact CB-CG1 3.97Å; E585-V673 HydrophobicContact CG-CG1 3.64Å; S669-V673 WeakPolarHBondContact O-CB 3.29Å; S669-V673 WeakPolarHBondContact O-CG2 3.32Å; S669-V673 PolarHBondContact O-N 2.88Å; K670-V673 PolarHBondContact O-N 3.02Å; L671-V673 VanDerWaalsContact C-N 3.25Å; L671-V673 PolarHBondContact O-N 3.27Å; V673-E675 PolarHBondContact O-N 2.96Å; V673-K676 PolarHBondContact O-N 2.69Å; V673-L677 HydrophobicContact CG1-CD1 4.01Å; V673-L677 WeakPolarHBondContact O-CB 3.31Å; V673-L677 PolarHBondContact O-N 2.94Å
674	A	45.4	Very low	43	Very low	54 Å²	54	84.1 Å²	84.1	45%	0.446	42%	0.422	S	S	.	.	H	α-helix	trans	-61	-43	176.8	0	0	0	0	0	111.8	K670 L671 L677 T678	K670-A674 WeakPolarHBondContact O-CB 3.41Å; K670-A674 PolarHBondContact O-N 3.39Å; L671-A674 PolarHBondContact O-N 2.89Å; L671-A674 VanDerWaalsContact O-N 3.15Å; A674-L677 PolarHBondContact O-N 3.21Å; A674-T678 WeakPolarHBondContact O-CB 3.38Å; A674-T678 PolarHBondContact O-N 3.44Å; A674-T678 PolarHBondContact O-OG1 3.49Å
675	E	49.6	Very low	43.6	Very low	101 Å²	101	82.6 Å²	82.6	47%	0.472	41%	0.412	S	S	.	.	H	α-helix	trans	-59.8	-46.4	173.6	-74.7	171.8	169.2	0	0	111.7	L671 V673 T678 E679	L671-E675 WeakPolarHBondContact O-CB 3.04Å; L671-E675 VanDerWaalsContact O-CG 3.31Å; L671-E675 WeakPolarHBondContact O-CG 3.48Å; L671-E675 PolarHBondContact O-N 3.3Å; V673-E675 PolarHBondContact O-N 2.96Å; E675-T678 VanDerWaalsContact CA-OG1 3.3Å; E675-T678 WeakPolarHBondContact CA-OG1 3.34Å; E675-T678 PolarHBondContact O-N 2.66Å; E675-T678 PolarHBondContact O-OG1 3.39Å; E675-E679 WeakPolarHBondContact O-CB 3.4Å; E675-E679 PolarHBondContact O-N 3.41Å
676	K	49.3	Very low	44	Very low	83 Å²	83	79.6 Å²	79.6	36%	0.361	40%	0.403	S	S	.	.	H	α-helix	trans	-68.1	-37.1	177.3	-78.8	-173.8	175.3	-169.5	0	113.1	L582 K672 V673 E679 A680	L582-K676 HydrophobicContact CD1-CB 3.9Å; L582-K676 HydrophobicContact CD1-CD 3.49Å; L582-K676 VanDerWaalsContact CD1-CD 3.49Å; L582-K676 HydrophobicContact CD1-CG 4.34Å; K672-K676 WeakPolarHBondContact O-CB 3.49Å; K672-K676 WeakPolarHBondContact O-CG 3.35Å; K672-K676 PolarHBondContact O-N 3.42Å; V673-K676 PolarHBondContact O-N 2.69Å; K676-E679 PolarHBondContact O-N 3.43Å; K676-A680 VanDerWaalsContact O-CB 3.32Å; K676-A680 WeakPolarHBondContact O-CB 3.31Å; K676-A680 PolarHBondContact O-N 3.37Å
677	L	45.2	Very low	44.3	Very low	73 Å²	73	82.3 Å²	82.3	38%	0.382	42%	0.415	S	S	.	.	H	α-helix	trans	-66	-42.6	175.3	-111	147.1	0	0	0	111	E585 V673 A674 A680 H681	E585-L677 HydrophobicContact CG-CD1 4.2Å; V673-L677 HydrophobicContact CG1-CD1 4.01Å; V673-L677 WeakPolarHBondContact O-CB 3.31Å; V673-L677 PolarHBondContact O-N 2.94Å; A674-L677 PolarHBondContact O-N 3.21Å; L677-A680 PolarHBondContact O-N 2.94Å; L677-H681 VanDerWaalsContact O-CB 3.26Å; L677-H681 WeakPolarHBondContact O-CB 3.22Å; L677-H681 PolarHBondContact O-N 3.12Å
678	T	49.8	Very low	44.6	Very low	45 Å²	45	84.4 Å²	84.4	28%	0.276	42%	0.42	S	S	.	.	H	α-helix	trans	-67.2	-38.7	173.4	34.5	0	0	0	0	111.4	A674 E675 H681 T682	A674-T678 WeakPolarHBondContact O-CB 3.38Å; A674-T678 PolarHBondContact O-N 3.44Å; A674-T678 PolarHBondContact O-OG1 3.49Å; E675-T678 VanDerWaalsContact CA-OG1 3.3Å; E675-T678 WeakPolarHBondContact CA-OG1 3.34Å; E675-T678 PolarHBondContact O-N 2.66Å; E675-T678 PolarHBondContact O-OG1 3.39Å; T678-H681 PolarHBondContact O-N 3.05Å; T678-T682 WeakPolarHBondContact O-CB 3.33Å; T678-T682 PolarHBondContact O-N 3.08Å; T678-T682 PolarHBondContact O-OG1 3.34Å
679	E	49.5	Very low	44.8	Very low	98 Å²	98	82.8 Å²	82.8	46%	0.458	42%	0.418	S	S	.	.	H	α-helix	trans	-62.8	-43.7	174	-166.4	-168.4	162.9	0	0	111.2	E675 K676 T682 K683	E675-E679 WeakPolarHBondContact O-CB 3.4Å; E675-E679 PolarHBondContact O-N 3.41Å; K676-E679 PolarHBondContact O-N 3.43Å; E679-T682 PolarHBondContact O-N 2.99Å; E679-K683 WeakPolarHBondContact O-CB 3.46Å; E679-K683 VanDerWaalsContact O-CG 3.29Å; E679-K683 WeakPolarHBondContact O-CG 3.46Å; E679-K683 PolarHBondContact O-N 2.92Å; E679-K683 VanDerWaalsContact OE1-CE 3.23Å; E679-K683 WeakPolarHBondContact OE1-CE 3.17Å; E679-K683 IonicContact OE1-NZ 2.65Å; E679-K683 PolarHBondContact OE1-NZ 3.49Å
680	A	46.8	Very low	44.5	Very low	47 Å²	47	83.3 Å²	83.3	39%	0.388	43%	0.426	S	S	.	.	H	α-helix	trans	-65.8	-43.7	176.5	0	0	0	0	0	112.2	K676 L677 K683 E684	K676-A680 VanDerWaalsContact O-CB 3.32Å; K676-A680 WeakPolarHBondContact O-CB 3.31Å; K676-A680 PolarHBondContact O-N 3.37Å; L677-A680 PolarHBondContact O-N 2.94Å; A680-K683 PolarHBondContact O-N 2.87Å; A680-E684 WeakPolarHBondContact O-CB 3.47Å; A680-E684 PolarHBondContact O-N 2.91Å
681	H	44.2	Very low	44.7	Very low	122 Å²	122	82.8 Å²	82.8	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-64.1	-42.6	175.7	-167.1	90.9	0	0	0	110.9	L677 T678 K683 E684 V685	L677-H681 VanDerWaalsContact O-CB 3.26Å; L677-H681 WeakPolarHBondContact O-CB 3.22Å; L677-H681 PolarHBondContact O-N 3.12Å; T678-H681 PolarHBondContact O-N 3.05Å; H681-K683 PolarHBondContact O-N 3.33Å; H681-E684 PolarHBondContact O-N 3.4Å; H681-V685 WeakPolarHBondContact O-CB 3.35Å; H681-V685 VanDerWaalsContact O-CG2 3.31Å; H681-V685 WeakPolarHBondContact O-CG2 3.24Å; H681-V685 PolarHBondContact O-N 3.39Å
682	T	44	Very low	44.4	Very low	36 Å²	36	85.4 Å²	85.4	22%	0.221	45%	0.449	C	S	.	.	H	α-helix	trans	-62.3	-44	175.5	-57.2	0	0	0	0	110.6	T678 E679 E684 V685 I686	T678-T682 WeakPolarHBondContact O-CB 3.33Å; T678-T682 PolarHBondContact O-N 3.08Å; T678-T682 PolarHBondContact O-OG1 3.34Å; E679-T682 PolarHBondContact O-N 2.99Å; T682-E684 VanDerWaalsContact C-N 3.33Å; T682-E684 PolarHBondContact O-N 2.88Å; T682-V685 PolarHBondContact O-N 3.06Å; T682-I686 HydrophobicContact CG2-CD1 3.71Å; T682-I686 HydrophobicContact CG2-CG1 4.3Å; T682-I686 VanDerWaalsContact O-CB 3.32Å; T682-I686 WeakPolarHBondContact O-CB 3.26Å; T682-I686 WeakPolarHBondContact O-CG1 3.23Å; T682-I686 PolarHBondContact O-N 3.03Å
683	K	47.9	Very low	43.8	Very low	124 Å²	124	82.9 Å²	82.9	54%	0.539	45%	0.45	S	S	.	.	H	α-helix	trans	-60.4	-40.4	174.2	-77.7	173	-175.5	168	0	112.4	E679 A680 H681 K687	E679-K683 WeakPolarHBondContact O-CB 3.46Å; E679-K683 VanDerWaalsContact O-CG 3.29Å; E679-K683 WeakPolarHBondContact O-CG 3.46Å; E679-K683 PolarHBondContact O-N 2.92Å; E679-K683 VanDerWaalsContact OE1-CE 3.23Å; E679-K683 WeakPolarHBondContact OE1-CE 3.17Å; E679-K683 IonicContact OE1-NZ 2.65Å; E679-K683 PolarHBondContact OE1-NZ 3.49Å; A680-K683 PolarHBondContact O-N 2.87Å; H681-K683 PolarHBondContact O-N 3.33Å; K683-K687 WeakPolarHBondContact O-CB 3.48Å; K683-K687 PolarHBondContact O-N 3.45Å
684	E	44.2	Very low	43	Very low	84 Å²	84	90 Å²	90	39%	0.393	49%	0.488	S	S	.	.	H	α-helix	trans	-70.8	-41.9	178.8	-171.9	63	-163.7	0	0	111.9	A680 H681 T682 K687 R688	A680-E684 WeakPolarHBondContact O-CB 3.47Å; A680-E684 PolarHBondContact O-N 2.91Å; H681-E684 PolarHBondContact O-N 3.4Å; T682-E684 VanDerWaalsContact C-N 3.33Å; T682-E684 PolarHBondContact O-N 2.88Å; E684-K687 PolarHBondContact O-N 2.89Å; E684-R688 WeakPolarHBondContact O-CB 3.42Å; E684-R688 VanDerWaalsContact O-CG 3.28Å; E684-R688 WeakPolarHBondContact O-CG 3.44Å; E684-R688 PolarHBondContact O-N 2.83Å; E684-R688 IonicContact OE1-NE 3.31Å; E684-R688 PolarHBondContact OE1-NE 3.23Å; E684-R688 IonicContact OE1-NH2 3.29Å
685	V	43.1	Very low	42.2	Very low	58 Å²	58	96 Å²	96	35%	0.352	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-48.5	173.3	171.8	0	0	0	0	110.4	H681 T682 K687 R688 V689	H681-V685 WeakPolarHBondContact O-CB 3.35Å; H681-V685 VanDerWaalsContact O-CG2 3.31Å; H681-V685 WeakPolarHBondContact O-CG2 3.24Å; H681-V685 PolarHBondContact O-N 3.39Å; T682-V685 PolarHBondContact O-N 3.06Å; V685-K687 VanDerWaalsContact C-N 3.29Å; V685-K687 PolarHBondContact O-N 2.84Å; V685-R688 PolarHBondContact O-N 3.36Å; V685-R688 VanDerWaalsContact O-N 3.16Å; V685-V689 HydrophobicContact CG1-CG2 4.29Å; V685-V689 WeakPolarHBondContact O-CB 3.4Å; V685-V689 VanDerWaalsContact O-CG2 3.27Å; V685-V689 WeakPolarHBondContact O-CG2 3.2Å; V685-V689 PolarHBondContact O-N 3.47Å
686	I	43	Very low	41.2	Very low	88 Å²	88	95 Å²	95	45%	0.451	51%	0.514	S	S	.	.	H	α-helix	trans	-57.6	-43.7	175.5	-71	168.5	0	0	0	110.5	T682 R688 V689 A690	T682-I686 HydrophobicContact CG2-CD1 3.71Å; T682-I686 HydrophobicContact CG2-CG1 4.3Å; T682-I686 VanDerWaalsContact O-CB 3.32Å; T682-I686 WeakPolarHBondContact O-CB 3.26Å; T682-I686 WeakPolarHBondContact O-CG1 3.23Å; T682-I686 PolarHBondContact O-N 3.03Å; I686-R688 PolarHBondContact O-N 3.22Å; I686-V689 PolarHBondContact O-N 2.95Å; I686-A690 WeakPolarHBondContact O-CB 3.45Å; I686-A690 PolarHBondContact O-N 3.14Å
687	K	42.7	Very low	40.7	Very low	139 Å²	139	97.6 Å²	97.6	60%	0.604	54%	0.539	S	S	*	.	H	α-helix	trans	-63.8	-39.6	178.6	-171.6	-178.9	177.7	-169.3	0	112.2	K683 E684 V685 S691	K683-K687 WeakPolarHBondContact O-CB 3.48Å; K683-K687 PolarHBondContact O-N 3.45Å; E684-K687 PolarHBondContact O-N 2.89Å; V685-K687 VanDerWaalsContact C-N 3.29Å; V685-K687 PolarHBondContact O-N 2.84Å; K687-S691 WeakPolarHBondContact O-CB 3.29Å; K687-S691 PolarHBondContact O-N 2.8Å; K687-S691 PolarHBondContact O-OG 3.28Å
688	R	40.4	Very low	39.9	Very low	132 Å²	132	100.8 Å²	100.8	50%	0.498	56%	0.555	S	S	.	*	H	α-helix	trans	-70.2	-37	176.7	-73.3	174.7	-178	-162.3	-3.9	112.8	E684 V685 I686 S691	E684-R688 WeakPolarHBondContact O-CB 3.42Å; E684-R688 VanDerWaalsContact O-CG 3.28Å; E684-R688 WeakPolarHBondContact O-CG 3.44Å; E684-R688 PolarHBondContact O-N 2.83Å; E684-R688 IonicContact OE1-NE 3.31Å; E684-R688 PolarHBondContact OE1-NE 3.23Å; E684-R688 IonicContact OE1-NH2 3.29Å; V685-R688 PolarHBondContact O-N 3.36Å; V685-R688 VanDerWaalsContact O-N 3.16Å; I686-R688 PolarHBondContact O-N 3.22Å; R688-S691 PolarHBondContact O-OG 2.75Å
689	V	38.5	Very low	39.5	Very low	85 Å²	85	101.6 Å²	101.6	52%	0.515	56%	0.558	S	S	.	*	H	α-helix	trans	-67.8	-45.1	173.5	172.8	0	0	0	0	109.8	V685 I686 S691 N692 A693	V685-V689 HydrophobicContact CG1-CG2 4.29Å; V685-V689 WeakPolarHBondContact O-CB 3.4Å; V685-V689 VanDerWaalsContact O-CG2 3.27Å; V685-V689 WeakPolarHBondContact O-CG2 3.2Å; V685-V689 PolarHBondContact O-N 3.47Å; I686-V689 PolarHBondContact O-N 2.95Å; V689-S691 PolarHBondContact O-N 3.03Å; V689-N692 PolarHBondContact O-N 3.15Å; V689-A693 PolarHBondContact O-N 3.48Å
690	A	38	Very low	38.9	Very low	69 Å²	69	102.4 Å²	102.4	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-66.2	-33.9	178.9	0	0	0	0	0	113.2	I686 N692	I686-A690 WeakPolarHBondContact O-CB 3.45Å; I686-A690 PolarHBondContact O-N 3.14Å; A690-N692 VanDerWaalsContact C-N 3.25Å; A690-N692 PolarHBondContact O-N 3.01Å
691	S	42.1	Very low	38.3	Very low	90 Å²	90	105.4 Å²	105.4	63%	0.629	58%	0.579	S	S	*	*	H	α-helix	trans	-71.8	-17.9	177.2	62.3	0	0	0	0	114	K687 R688 V689	K687-S691 WeakPolarHBondContact O-CB 3.29Å; K687-S691 PolarHBondContact O-N 2.8Å; K687-S691 PolarHBondContact O-OG 3.28Å; R688-S691 PolarHBondContact O-OG 2.75Å; V689-S691 PolarHBondContact O-N 3.03Å
692	N	34.2	Very low	38.1	Very low	138 Å²	138	103.1 Å²	103.1	74%	0.738	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	0.1	-178.1	-74.5	-2	0	0	0	113.6	V689 A690 D694	V689-N692 PolarHBondContact O-N 3.15Å; A690-N692 VanDerWaalsContact C-N 3.25Å; A690-N692 PolarHBondContact O-N 3.01Å; N692-D694 PolarHBondContact O-N 3.47Å
693	A	34.2	Very low	37.9	Very low	64 Å²	64	103.2 Å²	103.2	53%	0.529	58%	0.575	S	S	.	*			trans	-92.4	82.3	-173.7	0	0	0	0	0	112.8	V689 F695	V689-A693 PolarHBondContact O-N 3.48Å; A693-F695 VanDerWaalsContact C-N 3.3Å
694	D	31.2	Very low	37.4	Very low	161 Å²	161	100.6 Å²	100.6	86%	0.861	57%	0.566	S	S	*	*			trans	-93.9	20.3	158.1	-108.5	-19.4	0	0	0	111.7	N692	N692-D694 PolarHBondContact O-N 3.47Å
695	F	28.4	Very low	37.1	Very low	179 Å²	179	98.5 Å²	98.5	79%	0.785	56%	0.563	S	S	*	*	S	Bend	trans	-127.5	149.4	179.6	-77.5	-88.7	0	0	0	111.7	A693	A693-F695 VanDerWaalsContact C-N 3.3Å
696	A	29	Very low	36.9	Very low	81 Å²	81	98.7 Å²	98.7	67%	0.669	57%	0.571	S	S	*	*			trans	-41.8	156.7	-170.7	0	0	0	0	0	116.4	L698	A696-L698 PolarHBondContact O-N 2.85Å
697	P	38.9	Very low	36.6	Very low	137 Å²	137	96.2 Å²	96.2	89%	0.89	56%	0.562	S	S	*	*			trans	-74.5	86.6	-169.8	32.1	-33.8	0	0	0	111.5
698	L	28.7	Very low	36.3	Very low	140 Å²	140	95.3 Å²	95.3	73%	0.733	56%	0.56	S	S	*	*			trans	-142.6	117.3	165.4	-150.2	90.1	0	0	0	103.7	A696	A696-L698 PolarHBondContact O-N 2.85Å
699	D	40.6	Very low	36.1	Very low	62 Å²	62	93.6 Å²	93.6	33%	0.332	56%	0.564	S	S	.	*			cis	-158.5	95.3	7.4	-165.6	-8.2	0	0	0	105.3	N701 L702	D699-N701 PolarHBondContact O-N 2.95Å; D699-N701 VanDerWaalsContact O-N 3.12Å; D699-N701 VanDerWaalsContact OD1-CB 3.3Å; D699-N701 WeakPolarHBondContact OD1-CB 3.22Å; D699-N701 PolarHBondContact OD1-N 2.03Å; D699-L702 HydrophobicContact CB-CB 3.85Å; D699-L702 PolarHBondContact O-N 3.08Å
700	T	37.4	Very low	36	Very low	115 Å²	115	92.2 Å²	92.2	71%	0.706	56%	0.561	S	S	*	*	H	α-helix	trans	-55.6	-25.8	173.3	31.9	0	0	0	0	111.5	I704	T700-I704 WeakPolarHBondContact O-CD1 3.32Å; T700-I704 WeakPolarHBondContact O-CG1 3.4Å; T700-I704 PolarHBondContact O-N 2.68Å
701	N	33.9	Very low	35.8	Very low	110 Å²	110	93.2 Å²	93.2	59%	0.588	56%	0.556	S	S	*	*	H	α-helix	trans	-72	-28.6	177	-56.8	-43.6	0	0	0	112.5	D699 I704 A705	D699-N701 PolarHBondContact O-N 2.95Å; D699-N701 VanDerWaalsContact O-N 3.12Å; D699-N701 VanDerWaalsContact OD1-CB 3.3Å; D699-N701 WeakPolarHBondContact OD1-CB 3.22Å; D699-N701 PolarHBondContact OD1-N 2.03Å; N701-I704 PolarHBondContact O-N 2.87Å; N701-A705 WeakPolarHBondContact O-CB 3.41Å; N701-A705 PolarHBondContact O-N 2.96Å
702	L	39.9	Very low	35.4	Very low	74 Å²	74	91.2 Å²	91.2	39%	0.387	55%	0.545	S	S	.	.	H	α-helix	trans	-72.6	-39.9	178.5	-171.3	66.8	0	0	0	111.7	V19 D699 A705 A706	V19-L702 HydrophobicContact CG1-CD1 4.12Å; D699-L702 HydrophobicContact CB-CB 3.85Å; D699-L702 PolarHBondContact O-N 3.08Å; L702-A705 PolarHBondContact O-N 3.36Å; L702-A706 WeakPolarHBondContact O-CB 3.47Å; L702-A706 PolarHBondContact O-N 3.03Å
703	A	39.6	Very low	35.4	Very low	37 Å²	37	87.7 Å²	87.7	31%	0.306	54%	0.535	S	S	.	.	H	α-helix	trans	-64.9	-40.1	173	0	0	0	0	0	111.6	S707	A703-S707 WeakPolarHBondContact O-CB 2.91Å; A703-S707 PolarHBondContact O-N 3.4Å
704	I	37.2	Very low	35.2	Very low	70 Å²	70	87.4 Å²	87.4	36%	0.359	53%	0.533	S	S	.	.	H	α-helix	trans	-65.5	-42.6	173.7	-67	166.3	0	0	0	110.7	T700 N701 S707 Q708	T700-I704 WeakPolarHBondContact O-CD1 3.32Å; T700-I704 WeakPolarHBondContact O-CG1 3.4Å; T700-I704 PolarHBondContact O-N 2.68Å; N701-I704 PolarHBondContact O-N 2.87Å; I704-S707 PolarHBondContact O-N 3.49Å; I704-S707 PolarHBondContact O-OG 3.34Å; I704-Q708 HydrophobicContact CG2-CG 4.25Å; I704-Q708 WeakPolarHBondContact O-CB 3.24Å; I704-Q708 VanDerWaalsContact O-CG 3.26Å; I704-Q708 WeakPolarHBondContact O-CG 3.32Å; I704-Q708 PolarHBondContact O-N 3.4Å
705	A	38.1	Very low	35.1	Very low	40 Å²	40	82.2 Å²	82.2	33%	0.331	51%	0.509	S	S	.	.	H	α-helix	trans	-65.5	-44.1	178.7	0	0	0	0	0	111.6	N701 L702 S707 Q708 T709	N701-A705 WeakPolarHBondContact O-CB 3.41Å; N701-A705 PolarHBondContact O-N 2.96Å; L702-A705 PolarHBondContact O-N 3.36Å; A705-S707 VanDerWaalsContact C-N 3.34Å; A705-S707 PolarHBondContact O-N 3.4Å; A705-Q708 PolarHBondContact O-N 2.65Å; A705-T709 WeakPolarHBondContact O-CB 3.37Å; A705-T709 PolarHBondContact O-N 3.46Å; A705-T709 PolarHBondContact O-OG1 3.09Å
706	A	38.7	Very low	35.2	Very low	61 Å²	61	76.6 Å²	76.6	50%	0.504	49%	0.493	S	S	.	.	H	α-helix	trans	-62.1	-40.8	175.5	0	0	0	0	0	111.7	L702 T709 A710	L702-A706 WeakPolarHBondContact O-CB 3.47Å; L702-A706 PolarHBondContact O-N 3.03Å; A706-T709 PolarHBondContact O-N 3.39Å; A706-A710 WeakPolarHBondContact O-CB 3.47Å; A706-A710 PolarHBondContact O-N 3.16Å
707	S	37	Very low	35.3	Very low	37 Å²	37	75.7 Å²	75.7	26%	0.259	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-39.3	176.1	96.8	0	0	0	0	112.2	A703 I704 A705 A710 L711	A703-S707 WeakPolarHBondContact O-CB 2.91Å; A703-S707 PolarHBondContact O-N 3.4Å; I704-S707 PolarHBondContact O-N 3.49Å; I704-S707 PolarHBondContact O-OG 3.34Å; A705-S707 VanDerWaalsContact C-N 3.34Å; A705-S707 PolarHBondContact O-N 3.4Å; S707-A710 PolarHBondContact O-N 2.85Å; S707-L711 WeakPolarHBondContact O-CB 3.46Å; S707-L711 PolarHBondContact O-N 3.24Å
708	Q	36.4	Very low	34.8	Very low	120 Å²	120	72.1 Å²	72.1	56%	0.561	46%	0.46	S	S	*	.	H	α-helix	trans	-67.6	-34.2	174.7	-76	180	-8.1	0	0	112.3	I704 A705 L711 A712	I704-Q708 HydrophobicContact CG2-CG 4.25Å; I704-Q708 WeakPolarHBondContact O-CB 3.24Å; I704-Q708 VanDerWaalsContact O-CG 3.26Å; I704-Q708 WeakPolarHBondContact O-CG 3.32Å; I704-Q708 PolarHBondContact O-N 3.4Å; A705-Q708 PolarHBondContact O-N 2.65Å; Q708-L711 VanDerWaalsContact O-CB 3.31Å; Q708-L711 WeakPolarHBondContact O-CB 3.41Å; Q708-L711 PolarHBondContact O-N 2.86Å; Q708-A712 PolarHBondContact O-N 2.89Å
709	T	36	Very low	34.9	Very low	95 Å²	95	69.9 Å²	69.9	58%	0.583	45%	0.448	S	S	*	.	H	α-helix	trans	-71.1	-39.4	176.6	-45.8	0	0	0	0	110.6	A705 A706 L711 A712 A713	A705-T709 WeakPolarHBondContact O-CB 3.37Å; A705-T709 PolarHBondContact O-N 3.46Å; A705-T709 PolarHBondContact O-OG1 3.09Å; A706-T709 PolarHBondContact O-N 3.39Å; T709-L711 VanDerWaalsContact C-N 3.32Å; T709-A712 PolarHBondContact O-N 3.28Å; T709-A713 WeakPolarHBondContact O-CB 3.48Å; T709-A713 PolarHBondContact O-N 3.34Å
710	A	37.1	Very low	34.3	Very low	57 Å²	57	72.8 Å²	72.8	47%	0.471	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-38.1	169.8	0	0	0	0	0	112	A706 S707 A713 A714	A706-A710 WeakPolarHBondContact O-CB 3.47Å; A706-A710 PolarHBondContact O-N 3.16Å; S707-A710 PolarHBondContact O-N 2.85Å; A710-A713 PolarHBondContact O-N 3.5Å; A710-A714 VanDerWaalsContact O-CB 3.32Å; A710-A714 WeakPolarHBondContact O-CB 3.47Å; A710-A714 PolarHBondContact O-N 3.13Å
711	L	32.9	Very low	34	Very low	89 Å²	89	72.3 Å²	72.3	47%	0.466	46%	0.456	S	S	.	.	H	α-helix	trans	-61.9	-45.5	173.6	-160.6	92.9	0	0	0	111.4	S707 Q708 T709 A714 S715	S707-L711 WeakPolarHBondContact O-CB 3.46Å; S707-L711 PolarHBondContact O-N 3.24Å; Q708-L711 VanDerWaalsContact O-CB 3.31Å; Q708-L711 WeakPolarHBondContact O-CB 3.41Å; Q708-L711 PolarHBondContact O-N 2.86Å; T709-L711 VanDerWaalsContact C-N 3.32Å; L711-A714 PolarHBondContact O-N 3.29Å; L711-S715 WeakPolarHBondContact O-CB 3.42Å; L711-S715 PolarHBondContact O-N 2.91Å; L711-S715 PolarHBondContact O-OG 3.12Å
712	A	33.7	Very low	33.8	Very low	48 Å²	48	69.9 Å²	69.9	40%	0.397	45%	0.445	S	S	.	.	H	α-helix	trans	-61.2	-49.6	176.4	0	0	0	0	0	110.8	Q708 T709 A714 S715 S716	Q708-A712 PolarHBondContact O-N 2.89Å; T709-A712 PolarHBondContact O-N 3.28Å; A712-A714 PolarHBondContact O-N 3.42Å; A712-S715 PolarHBondContact O-N 3.29Å; A712-S715 PolarHBondContact O-OG 2.92Å; A712-S716 PolarHBondContact O-N 3.31Å; A712-S716 PolarHBondContact O-OG 2.62Å
713	A	34.1	Very low	33.2	Very low	64 Å²	64	71.5 Å²	71.5	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-60.8	-42.1	178.5	0	0	0	0	0	113.1	T709 A710 S716 A717	T709-A713 WeakPolarHBondContact O-CB 3.48Å; T709-A713 PolarHBondContact O-N 3.34Å; A710-A713 PolarHBondContact O-N 3.5Å; A713-S716 PolarHBondContact O-N 2.93Å; A713-A717 PolarHBondContact O-N 3.44Å
714	A	31.1	Very low	32.7	Very low	58 Å²	58	76.9 Å²	76.9	48%	0.479	47%	0.473	S	S	.	.	H	α-helix	trans	-66	-37.9	176.2	0	0	0	0	0	112.2	A710 L711 A712	A710-A714 VanDerWaalsContact O-CB 3.32Å; A710-A714 WeakPolarHBondContact O-CB 3.47Å; A710-A714 PolarHBondContact O-N 3.13Å; L711-A714 PolarHBondContact O-N 3.29Å; A712-A714 PolarHBondContact O-N 3.42Å
715	S	29.2	Very low	32.4	Very low	52 Å²	52	79 Å²	79	36%	0.364	48%	0.48	S	S	.	.	H	α-helix	trans	-69.6	-39	176.4	73	0	0	0	0	112.3	L711 A712 A717 V718 I719	L711-S715 WeakPolarHBondContact O-CB 3.42Å; L711-S715 PolarHBondContact O-N 2.91Å; L711-S715 PolarHBondContact O-OG 3.12Å; A712-S715 PolarHBondContact O-N 3.29Å; A712-S715 PolarHBondContact O-OG 2.92Å; S715-A717 PolarHBondContact O-N 3.07Å; S715-V718 PolarHBondContact O-N 3.46Å; S715-I719 VanDerWaalsContact O-CG1 3.26Å; S715-I719 WeakPolarHBondContact O-CG1 3.23Å; S715-I719 PolarHBondContact O-N 3.12Å
716	S	29.2	Very low	31.8	Very low	62 Å²	62	84.2 Å²	84.2	43%	0.434	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-39.2	179.2	-56.3	0	0	0	0	112.6	A712 A713 V718 I719 L720	A712-S716 PolarHBondContact O-N 3.31Å; A712-S716 PolarHBondContact O-OG 2.62Å; A713-S716 PolarHBondContact O-N 2.93Å; S716-V718 VanDerWaalsContact C-N 3.28Å; S716-V718 PolarHBondContact O-N 2.83Å; S716-I719 PolarHBondContact O-N 3.44Å; S716-L720 WeakPolarHBondContact O-CB 3.41Å; S716-L720 PolarHBondContact O-N 2.7Å
717	A	31.3	Very low	31.2	Very low	62 Å²	62	87.8 Å²	87.8	51%	0.512	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-29.5	177.8	0	0	0	0	0	113.2	A713 S715	A713-A717 PolarHBondContact O-N 3.44Å; S715-A717 PolarHBondContact O-N 3.07Å
718	V	29.4	Very low	30.8	Very low	61 Å²	61	90.7 Å²	90.7	37%	0.37	52%	0.524	S	S	.	.	H	α-helix	trans	-83.5	-40.2	176.9	178.8	0	0	0	0	111.1	L671 S715 S716 L720 N721 T722	L671-V718 HydrophobicContact CD1-CG1 4.36Å; S715-V718 PolarHBondContact O-N 3.46Å; S716-V718 VanDerWaalsContact C-N 3.28Å; S716-V718 PolarHBondContact O-N 2.83Å; V718-L720 VanDerWaalsContact C-N 3.34Å; V718-L720 PolarHBondContact O-N 2.72Å; V718-N721 PolarHBondContact O-N 3.14Å; V718-T722 PolarHBondContact O-N 3.28Å; V718-T722 PolarHBondContact O-OG1 3.37Å
719	I	29.7	Very low	30.5	Very low	93 Å²	93	94.2 Å²	94.2	48%	0.477	54%	0.54	S	S	.	.	H	α-helix	trans	-61.8	-42.1	175.7	-67.3	165.5	0	0	0	110.4	S715 S716 N721 T722 L723	S715-I719 VanDerWaalsContact O-CG1 3.26Å; S715-I719 WeakPolarHBondContact O-CG1 3.23Å; S715-I719 PolarHBondContact O-N 3.12Å; S716-I719 PolarHBondContact O-N 3.44Å; I719-N721 VanDerWaalsContact C-N 3.34Å; I719-N721 PolarHBondContact O-N 3.44Å; I719-T722 PolarHBondContact O-N 2.78Å; I719-T722 VanDerWaalsContact O-N 3.15Å; I719-L723 HydrophobicContact CG2-CD1 3.65Å; I719-L723 HydrophobicContact CG2-CG 4.12Å; I719-L723 WeakPolarHBondContact O-CB 3.31Å; I719-L723 WeakPolarHBondContact O-CG 3.44Å; I719-L723 PolarHBondContact O-N 3.04Å
720	L	29.3	Very low	30	Very low	123 Å²	123	97.3 Å²	97.3	64%	0.644	55%	0.554	S	S	*	*	H	α-helix	trans	-59.2	-44.3	176.3	-123.3	101.9	0	0	0	112.1	S716 V718 T722 Q724	S716-L720 WeakPolarHBondContact O-CB 3.41Å; S716-L720 PolarHBondContact O-N 2.7Å; V718-L720 VanDerWaalsContact C-N 3.34Å; V718-L720 PolarHBondContact O-N 2.72Å; L720-T722 VanDerWaalsContact C-N 3.29Å; L720-T722 PolarHBondContact O-N 2.76Å; L720-Q724 PolarHBondContact O-N 3.25Å
721	N	29.7	Very low	29.5	Very low	105 Å²	105	99.1 Å²	99.1	56%	0.561	56%	0.563	S	S	*	*	H	α-helix	trans	-69.4	-25.8	178.5	-101	-33.3	0	0	0	113.4	V718 I719	V718-N721 PolarHBondContact O-N 3.14Å; I719-N721 VanDerWaalsContact C-N 3.34Å; I719-N721 PolarHBondContact O-N 3.44Å
722	T	29.9	Very low	29.1	Very low	59 Å²	59	101.9 Å²	101.9	36%	0.362	58%	0.584	S	S	.	*	H	α-helix	trans	-84.1	-39.7	-179.9	-45.2	0	0	0	0	110.9	V718 I719 L720 Q724 K725	V718-T722 PolarHBondContact O-N 3.28Å; V718-T722 PolarHBondContact O-OG1 3.37Å; I719-T722 PolarHBondContact O-N 2.78Å; I719-T722 VanDerWaalsContact O-N 3.15Å; L720-T722 VanDerWaalsContact C-N 3.29Å; L720-T722 PolarHBondContact O-N 2.76Å; T722-Q724 VanDerWaalsContact C-N 3.3Å; T722-Q724 PolarHBondContact O-N 2.57Å; T722-K725 PolarHBondContact O-N 3.49Å
723	L	27.9	Very low	28.5	Very low	108 Å²	108	108 Å²	108	57%	0.565	60%	0.604	S	S	*	*	H	α-helix	trans	-65.5	-32.8	176.7	-73.5	172.5	0	0	0	112.4	I719 K725 Q726	I719-L723 HydrophobicContact CG2-CD1 3.65Å; I719-L723 HydrophobicContact CG2-CG 4.12Å; I719-L723 WeakPolarHBondContact O-CB 3.31Å; I719-L723 WeakPolarHBondContact O-CG 3.44Å; I719-L723 PolarHBondContact O-N 3.04Å; L723-K725 PolarHBondContact O-N 3.21Å; L723-Q726 PolarHBondContact O-N 3.3Å
724	Q	28.9	Very low	27.9	Very low	150 Å²	150	112 Å²	112	70%	0.701	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-13.3	178.4	-154.8	167.9	-5.2	0	0	113.7	L720 T722	L720-Q724 PolarHBondContact O-N 3.25Å; T722-Q724 VanDerWaalsContact C-N 3.3Å; T722-Q724 PolarHBondContact O-N 2.57Å
725	K	31	Very low	27.5	Very low	116 Å²	116	117 Å²	117	50%	0.504	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.3	-9.4	177.4	-83.5	-178.3	174.1	-179.8	0	115	Y620 T722 L723	Y620-K725 WeakPolarHBondContact OH-CE 3.28Å; Y620-K725 PolarHBondContact OH-NZ 2.84Å; T722-K725 PolarHBondContact O-N 3.49Å; L723-K725 PolarHBondContact O-N 3.21Å
726	Q	25.8	Very low	27.1	Very low	148 Å²	148	120.7 Å²	120.7	69%	0.692	66%	0.66	S	S	*	*			trans	-106.2	30.9	-177.7	-76.3	-164.6	-28.5	0	0	113.3	L723 P728	L723-Q726 PolarHBondContact O-N 3.3Å; Q726-P728 WeakPolarHBondContact O-CD 3.33Å
727	I	26.5	Very low	26.8	Very low	137 Å²	137	122.5 Å²	122.5	70%	0.703	67%	0.673	S	S	*	*			trans	-95	94	166.1	-55.2	177.9	0	0	0	107.9
728	P	27.9	Very low	26.3	Very low	97 Å²	97	127.2 Å²	127.2	63%	0.63	69%	0.688	S	S	*	*			trans	-72.3	134.2	169.1	28.4	-32.6	0	0	0	110.3	Q726 N730	Q726-P728 WeakPolarHBondContact O-CD 3.33Å; P728-N730 PolarHBondContact O-N 3.15Å
729	E	30.3	Very low	25.8	Very low	194 Å²	194	132.7 Å²	132.7	91%	0.907	71%	0.707	S	S	*	*	S	Bend	trans	-65.2	15.7	-168.6	-68.8	-178.1	147.3	0	0	117.1
730	N	26	Very low	25.3	Very low	161 Å²	161	135.4 Å²	135.4	86%	0.861	72%	0.721	S	S	*	*			trans	-141.4	53.4	-176.6	-92	-25.7	0	0	0	114.2	P728	P728-N730 PolarHBondContact O-N 3.15Å
731	S	26.3	Very low	24.9	Very low	95 Å²	95	135.6 Å²	135.6	66%	0.664	73%	0.73	S	S	*	*			trans	-120.4	89.3	161.3	58.8	0	0	0	0	110.5	Q733	S731-Q733 PolarHBondContact O-N 2.81Å
732	T	23.2	Very low	24.7	Very low	147 Å²	147	139.3 Å²	139.3	90%	0.902	74%	0.744	S	S	*	*			trans	-67.4	80.3	159.5	25.2	0	0	0	0	109.2
733	Q	23	Very low	24.3	Very low	177 Å²	177	145.2 Å²	145.2	83%	0.827	77%	0.768	S	S	*	*			trans	-129.7	126.6	154.1	-80.7	-171.1	-8.8	0	0	108.8	S731 L735	S731-Q733 PolarHBondContact O-N 2.81Å; Q733-L735 PolarHBondContact O-N 3.06Å
734	T	20.7	Very low	24	Very low	148 Å²	148	148.1 Å²	148.1	91%	0.908	78%	0.782	S	S	*	*			trans	-57.5	84.7	-170.6	-33.1	0	0	0	0	111.7
735	L	21.5	Very low	23.6	Very low	163 Å²	163	149.9 Å²	149.9	85%	0.853	79%	0.79	S	S	*	*			trans	-85.3	114.2	158.6	-136.7	86	0	0	0	107	Q733 S737	Q733-L735 PolarHBondContact O-N 3.06Å; L735-S737 PolarHBondContact O-N 3.3Å
736	T	21.7	Very low	23.1	Very low	129 Å²	129	155.9 Å²	155.9	79%	0.791	81%	0.81	S	S	*	*			trans	-38.2	118.6	171.4	28.3	0	0	0	0	111.2	I738	T736-I738 PolarHBondContact O-N 3.35Å
737	S	22	Very low	22.9	Very low	100 Å²	100	152.3 Å²	152.3	70%	0.699	81%	0.812	S	S	*	*			trans	-60.6	115.4	-171.6	46.8	0	0	0	0	112.2	L735 K739	L735-S737 PolarHBondContact O-N 3.3Å; S737-K739 VanDerWaalsContact C-N 3.3Å; S737-K739 PolarHBondContact O-N 3.07Å
738	I	20.7	Very low	22.6	Very low	160 Å²	160	152.7 Å²	152.7	82%	0.821	82%	0.816	S	S	*	*			trans	-69.9	96.4	153.9	-62.7	172.3	0	0	0	105.1	T736 L740	T736-I738 PolarHBondContact O-N 3.35Å; I738-L740 PolarHBondContact O-N 3.45Å; I738-L740 VanDerWaalsContact O-N 3.12Å
739	K	19.2	Very low	22.5	Very low	176 Å²	176	155.1 Å²	155.1	77%	0.765	82%	0.824	S	S	*	*			trans	-60.2	111.1	172.2	-84.1	-174.6	171.1	-170.3	0	108.4	S737	S737-K739 VanDerWaalsContact C-N 3.3Å; S737-K739 PolarHBondContact O-N 3.07Å
740	L	19.9	Very low	22.2	Very low	151 Å²	151	152.7 Å²	152.7	79%	0.791	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-62.6	131.3	155.7	-98.1	83.4	0	0	0	107.4	I738 E742	I738-L740 PolarHBondContact O-N 3.45Å; I738-L740 VanDerWaalsContact O-N 3.12Å; L740-E742 PolarHBondContact O-N 2.99Å
741	P	21.9	Very low	22.2	Very low	127 Å²	127	151.7 Å²	151.7	83%	0.825	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-60.3	133.1	177.6	-18.8	30.7	0	0	0	110.9
742	E	23.6	Very low	22.3	Very low	183 Å²	183	153.8 Å²	153.8	86%	0.855	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.2	163.1	177.5	-100.4	164.9	143.9	0	0	113.7	L740	L740-E742 PolarHBondContact O-N 2.99Å
743	Q	21.6	Very low	22.4	Very low	183 Å²	183	154.1 Å²	154.1	86%	0.855	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-52.1	142.8	-177.3	-60.8	-172.2	-19.7	0	0	113.7	E745	Q743-E745 PolarHBondContact O-N 2.93Å; Q743-E745 VanDerWaalsContact O-N 3.16Å
744	I	21.8	Very low	22.7	Very low	169 Å²	169	153 Å²	153	87%	0.867	81%	0.811	S	S	*	*			trans	-66.1	102.7	169.4	-62.4	165.7	0	0	0	108
745	E	21.8	Very low	22.9	Very low	186 Å²	186	153.5 Å²	153.5	87%	0.869	81%	0.808	S	S	*	*			trans	-82.9	132.7	159.1	-86.6	-173.8	157.8	0	0	109.5	Q743	Q743-E745 PolarHBondContact O-N 2.93Å; Q743-E745 VanDerWaalsContact O-N 3.16Å
746	R	19.4	Very low	23.1	Very low	243 Å²	243	152.7 Å²	152.7	92%	0.917	81%	0.805	S	S	*	*			trans	-65.5	125.6	173	-68.1	175.7	-174.7	-170	-1	109.2
747	G	22.5	Very low	23.2	Very low	73 Å²	73	152.9 Å²	152.9	75%	0.753	81%	0.806	S	S	*	*			trans	-125.7	111.9	159.4	0	0	0	0	0	107.3
748	D	20.2	Very low	23.2	Very low	145 Å²	145	155.1 Å²	155.1	78%	0.775	81%	0.81	S	S	*	*			trans	-56.3	141.2	161.3	-60.9	-55	0	0	0	109.2
749	D	25.4	Very low	23.3	Very low	148 Å²	148	154.8 Å²	154.8	79%	0.791	81%	0.808	S	S	*	*			trans	164.8	104	139.2	-80.5	-16	0	0	0	109.4
750	D	23.6	Very low	23.4	Very low	142 Å²	142	152.5 Å²	152.5	76%	0.759	81%	0.809	S	S	*	*			trans	48.5	133.4	133.5	-63.3	-21.8	0	0	0	122.8
751	D	26.3	Very low	23.4	Very low	140 Å²	140	156.5 Å²	156.5	75%	0.749	81%	0.813	S	S	*	*			trans	90.9	116.4	148.1	-60.8	-22.9	0	0	0	121.1
752	D	27.8	Very low	23.4	Very low	139 Å²	139	157.9 Å²	157.9	74%	0.743	81%	0.812	S	S	*	*			trans	78.8	100.1	144.3	-61.5	-21	0	0	0	121
753	D	26.7	Very low	23.2	Very low	154 Å²	154	158.6 Å²	158.6	82%	0.824	81%	0.812	S	S	*	*				54.7	140.4	124.6	-75.8	-22.2	0	0	0	122.5
754	D	28.9	Very low	23.2	Very low	155 Å²	155	158.5 Å²	158.5	83%	0.829	81%	0.812	S	S	*	*			trans	92.8	107.2	163.2	-77.3	-20.6	0	0	0	120.4	N756	D754-N756 PolarHBondContact O-N 3.49Å
755	D	24.3	Very low	23.2	Very low	158 Å²	158	158.3 Å²	158.3	85%	0.845	81%	0.811	S	S	*	*			trans	-37.4	116	160.5	-71.4	-47.4	0	0	0	113.9
756	N	26.2	Very low	23.2	Very low	146 Å²	146	155.3 Å²	155.3	78%	0.781	81%	0.805	S	S	*	*			trans	-156.5	119.6	139.4	-117.7	-34.1	0	0	0	112.6	D754 N758	D754-N756 PolarHBondContact O-N 3.49Å; N756-N758 PolarHBondContact O-N 3.28Å
757	V	23.5	Very low	23.3	Very low	133 Å²	133	149.2 Å²	149.2	81%	0.806	80%	0.797	S	S	*	*			trans	-64	91.1	173.3	177.7	0	0	0	0	108.8	I759	V757-I759 PolarHBondContact O-N 3.22Å; V757-I759 VanDerWaalsContact O-N 3.1Å
758	N	21.8	Very low	23.3	Very low	147 Å²	147	150.7 Å²	150.7	79%	0.786	80%	0.796	S	S	*	*			trans	-76.3	97.4	174.3	-88.6	-39.4	0	0	0	110.3	N756 V760	N756-N758 PolarHBondContact O-N 3.28Å; N758-V760 PolarHBondContact O-N 3.38Å; N758-V760 VanDerWaalsContact O-N 3.16Å
759	I	22.9	Very low	23.5	Very low	152 Å²	152	151.6 Å²	151.6	78%	0.779	80%	0.801	S	S	*	*			trans	-58.6	113.1	163.3	-64.9	169.2	0	0	0	108	V757 R761	V757-I759 PolarHBondContact O-N 3.22Å; V757-I759 VanDerWaalsContact O-N 3.1Å; I759-R761 PolarHBondContact O-N 2.59Å; I759-R761 VanDerWaalsContact O-N 3.08Å
760	V	20.5	Very low	23.3	Very low	129 Å²	129	152.3 Å²	152.3	78%	0.782	80%	0.799	S	S	*	*			trans	-60.1	108.3	-178.6	176	0	0	0	0	110.1	N758 I762	N758-V760 PolarHBondContact O-N 3.38Å; N758-V760 VanDerWaalsContact O-N 3.16Å; V760-I762 PolarHBondContact O-N 2.87Å
761	R	20.9	Very low	23.4	Very low	234 Å²	234	153.3 Å²	153.3	88%	0.883	80%	0.804	S	S	*	*			trans	-67.7	114.8	168.8	-84	-177.6	-175.1	160.8	2.6	110	I759 K763	I759-R761 PolarHBondContact O-N 2.59Å; I759-R761 VanDerWaalsContact O-N 3.08Å; R761-K763 PolarHBondContact O-N 3.16Å
762	I	20.9	Very low	23.2	Very low	157 Å²	157	154.3 Å²	154.3	81%	0.805	80%	0.804	S	S	*	*			trans	-72.2	106.6	164.6	-59.6	172.5	0	0	0	107.3	V760 Q764	V760-I762 PolarHBondContact O-N 2.87Å; I762-Q764 PolarHBondContact O-N 2.93Å
763	K	20.8	Very low	23	Very low	197 Å²	197	153.7 Å²	153.7	86%	0.857	80%	0.801	S	S	*	*			trans	-69.6	114	169.2	-91.6	-178.9	174.3	177.1	0	108.9	R761 I765	R761-K763 PolarHBondContact O-N 3.16Å; K763-I765 PolarHBondContact O-N 3.33Å
764	Q	21.7	Very low	22.9	Very low	182 Å²	182	152.4 Å²	152.4	85%	0.85	79%	0.793	S	S	*	*			trans	-60.8	129	165.6	-90.3	176	-28.9	0	0	110.1	I762 T766	I762-Q764 PolarHBondContact O-N 2.93Å; Q764-T766 PolarHBondContact O-N 3.49Å
765	I	20.2	Very low	22.6	Very low	165 Å²	165	151.2 Å²	151.2	85%	0.846	79%	0.787	S	S	*	*			trans	-81.1	107.1	169	-63.5	168.1	0	0	0	106.7	K763	K763-I765 PolarHBondContact O-N 3.33Å
766	T	21.8	Very low	22.6	Very low	123 Å²	123	149.8 Å²	149.8	76%	0.755	78%	0.78	S	S	*	*			trans	-76.6	129.7	169.7	-35.6	0	0	0	0	108.8	Q764 S768	Q764-T766 PolarHBondContact O-N 3.49Å; T766-S768 PolarHBondContact O-N 3.43Å
767	P	22.6	Very low	22.4	Very low	114 Å²	114	150.1 Å²	150.1	74%	0.74	78%	0.776	S	S	*	*			trans	-72.5	121.1	177.6	-6.1	21.4	0	0	0	110.1	N769	P767-N769 PolarHBondContact O-N 3.25Å; P767-N769 VanDerWaalsContact O-N 3.16Å
768	S	21.4	Very low	22.4	Very low	105 Å²	105	150.6 Å²	150.6	73%	0.734	77%	0.769	S	S	*	*			trans	-66.9	102.5	170.8	54.1	0	0	0	0	110.5	T766 H770	T766-S768 PolarHBondContact O-N 3.43Å; S768-H770 PolarHBondContact O-N 3.38Å
769	N	24.9	Very low	22.5	Very low	164 Å²	164	151.1 Å²	151.1	88%	0.877	77%	0.767	S	S	*	*			trans	-85.9	103.7	162.4	-102.8	-8.5	0	0	0	108.5	P767 N771	P767-N769 PolarHBondContact O-N 3.25Å; P767-N769 VanDerWaalsContact O-N 3.16Å; N769-N771 PolarHBondContact O-N 3.42Å
770	H	21.8	Very low	22.4	Very low	162 Å²	162	148.9 Å²	148.9	75%	0.75	77%	0.765	S	S	*	*			trans	-65.3	115.3	161.4	-84.7	-62.9	0	0	0	108.9	S768	S768-H770 PolarHBondContact O-N 3.38Å
771	N	25.6	Very low	22.5	Very low	163 Å²	163	147 Å²	147	87%	0.872	76%	0.763	S	S	*	*			trans	-143.5	110.4	146.6	-96	-21.9	0	0	0	109.2	N769	N769-N771 PolarHBondContact O-N 3.42Å
772	H	21.9	Very low	22.5	Very low	162 Å²	162	142.5 Å²	142.5	75%	0.75	76%	0.762	S	S	*	*			trans	-40.5	131	153.3	-80.9	-88.9	0	0	0	110.9
773	D	23.8	Very low	22.6	Very low	125 Å²	125	140.7 Å²	140.7	67%	0.668	76%	0.76	S	S	*	*				169.8	143.7	80.2	-107.4	-20.6	0	0	0	112.4
774	L	23.8	Very low	22.6	Very low	127 Å²	127	140 Å²	140	67%	0.665	76%	0.759	S	S	*	*			trans	63.4	115.2	139.9	-67.5	155.8	0	0	0	121.4
775	N	22.6	Very low	22.5	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	75%	0.753	S	S	*	*				59.9	133.8	128.4	-63.9	2.7	0	0	0	117.7
776	D	24.9	Very low	22.5	Very low	129 Å²	129	135.8 Å²	135.8	69%	0.69	75%	0.751	S	S	*	*			cis	-160	144.4	35.3	-99.4	-42.1	0	0	0	110.4
777	H	23	Very low	22.6	Very low	152 Å²	152	138.2 Å²	138.2	70%	0.704	75%	0.754	S	S	*	*			trans	30	129.9	134.3	-79.4	-68.1	0	0	0	123.4
778	H	23.6	Very low	22.5	Very low	143 Å²	143	140.9 Å²	140.9	66%	0.662	76%	0.756	S	S	*	*			trans	98.2	117.3	135.5	-78.6	-57.4	0	0	0	121
779	Q	22.7	Very low	22.4	Very low	158 Å²	158	140.9 Å²	140.9	74%	0.738	76%	0.757	S	S	*	*			trans	71.5	103.7	134.6	-72.2	174.5	-7.1	0	0	116.8
780	S	20.5	Very low	22.3	Very low	105 Å²	105	142 Å²	142	73%	0.734	76%	0.756	S	S	*	*				55.7	99.9	85.3	75.7	0	0	0	0	113.5
781	A	23.5	Very low	22.1	Very low	91 Å²	91	144.9 Å²	144.9	75%	0.752	76%	0.762	S	S	*	*				169.1	111.5	127.9	0	0	0	0	0	109.3
782	T	21.2	Very low	21.8	Very low	139 Å²	139	145.6 Å²	145.6	85%	0.853	76%	0.76	S	S	*	*			trans	-51.2	142.9	145.9	22.1	0	0	0	0	110
783	P	22.9	Very low	21.6	Very low	119 Å²	119	146.6 Å²	146.6	77%	0.773	77%	0.765	S	S	*	*				-135.5	140.3	127.3	29.1	-13.3	0	0	0	113.3
784	H	20.6	Very low	21.5	Very low	181 Å²	181	149 Å²	149	84%	0.838	77%	0.773	S	S	*	*			trans	-38	144.2	152.3	-73.3	-99.8	0	0	0	112.9
785	C	19.3	Very low	21.4	Very low	106 Å²	106	150.1 Å²	150.1	72%	0.716	78%	0.779	S	S	*	*				161.9	127.3	97.3	-139	0	0	0	0	111.6
786	L	20.2	Very low	21.3	Very low	153 Å²	153	152 Å²	152	80%	0.801	78%	0.783	S	S	*	*			trans	16.2	126.5	137.6	-71.6	148.9	0	0	0	119.9
787	Q	23.5	Very low	21.2	Very low	175 Å²	175	154.2 Å²	154.2	82%	0.818	79%	0.79	S	S	*	*				177.9	112.2	124.1	-98.8	170.7	-7.5	0	0	109.9
788	Q	20.6	Very low	21.2	Very low	169 Å²	169	152.5 Å²	152.5	79%	0.79	79%	0.789	S	S	*	*				78.5	104.8	95.9	-95.1	-178.4	-14.8	0	0	116
789	S	20.2	Very low	21.3	Very low	106 Å²	106	153.7 Å²	153.7	74%	0.741	80%	0.795	S	S	*	*			trans	16.5	117.4	137.4	59.3	0	0	0	0	119.2
790	Q	22.3	Very low	21.5	Very low	186 Å²	186	154.5 Å²	154.5	87%	0.869	80%	0.797	S	S	*	*			trans	-135.9	113.8	144.6	-82.1	-172.7	-33.9	0	0	110.4
791	Y	16.7	Very low	22.1	Very low	223 Å²	223	153.3 Å²	153.3	88%	0.875	78%	0.782	S	S	*	*			trans	-69	128.9	158.1	-114	-106.9	0	0	0	107.8
792	Q	20.6	Very low	22.8	Very low	179 Å²	179	156.2 Å²	156.2	84%	0.836	78%	0.778	S	S	*	*			trans	-135.8	112.9	156.9	-86.8	-168	-34.1	0	0	109.9
793	E	17.9	Very low	23.6	Very low	182 Å²	182	156.5 Å²	156.5	85%	0.85	77%	0.773	S	S	*	*			trans	-82.5	124.8	166	-126.5	173.2	176.5	0	0	107.4
794	E	22	Very low	24.5	Very low	176 Å²	176	155.1 Å²	155.1	82%	0.822	76%	0.759	S	S	*	*			trans	-150.2	99.6	163.4	-118.2	174.9	-161.8	0	0	112.3
795	N	20.6	Very low	25.7	Very low	150 Å²	150	153.6 Å²	153.6	80%	0.802	75%	0.75	S	S	*	*			trans	35	115.9	136.5	-65.8	-31.7	0	0	0	122.5
796	H	20.7	Very low	27.3	Very low	170 Å²	170	153.3 Å²	153.3	79%	0.787	74%	0.74	S	S	*	*			trans	8.5	120.8	132.6	-75.4	-72	0	0	0	120.2
797	E	22.7	Very low	28.8	Very low	176 Å²	176	151 Å²	151	82%	0.822	73%	0.725	S	S	*	*			trans	-149.3	110.4	136	-134.8	172.1	-164.4	0	0	110.6	H799	E797-H799 PolarHBondContact O-N 2.91Å
798	V	22.9	Very low	30.4	Very low	115 Å²	115	150.2 Å²	150.2	70%	0.697	72%	0.715	S	S	*	*			trans	-91.3	88.1	-176.5	178.9	0	0	0	0	108.6
799	H	25.7	Very low	32.2	Very low	169 Å²	169	147.7 Å²	147.7	78%	0.782	71%	0.706	S	S	*	*			trans	-85.3	116.5	173	-117	-76.9	0	0	0	110.8	E797 D801	E797-H799 PolarHBondContact O-N 2.91Å; H799-D801 VanDerWaalsContact C-N 3.35Å; H799-D801 PolarHBondContact O-N 3.41Å
800	F	26.4	Very low	34.2	Very low	175 Å²	175	146.9 Å²	146.9	77%	0.768	69%	0.693	S	S	*	*			trans	-65.2	80.6	178.2	-95.6	-99	0	0	0	112.1	K802	F800-K802 VanDerWaalsContact C-N 3.31Å; F800-K802 PolarHBondContact O-N 3.41Å
801	D	33.9	Very low	35.9	Very low	80 Å²	80	141.4 Å²	141.4	43%	0.428	67%	0.67	S	S	.	*			trans	-94.7	29.4	177.1	-152.1	22.3	0	0	0	113	H799 N804 K805	H799-D801 VanDerWaalsContact C-N 3.35Å; H799-D801 PolarHBondContact O-N 3.41Å; D801-N804 WeakPolarHBondContact OD1-CB 3.42Å; D801-N804 PolarHBondContact OD1-ND2 3.16Å; D801-K805 PolarHBondContact O-N 3.4Å
802	K	37.4	Very low	37.7	Very low	152 Å²	152	138.4 Å²	138.4	66%	0.661	66%	0.661	S	S	*	*	H	α-helix	trans	-73.4	-33.5	-176.2	-85.2	-176.7	177.2	178.3	0	113.4	F800 I806	F800-K802 VanDerWaalsContact C-N 3.31Å; F800-K802 PolarHBondContact O-N 3.41Å; K802-I806 PolarHBondContact O-N 3.04Å
803	L	39	Very low	39.4	Very low	145 Å²	145	133.7 Å²	133.7	76%	0.759	64%	0.644	S	S	*	*	H	α-helix	trans	-72.7	-39.6	-177.4	-143.5	84.3	0	0	0	111.6	K805 I806 Q807	L803-K805 VanDerWaalsContact C-N 3.33Å; L803-K805 PolarHBondContact O-N 3.37Å; L803-I806 PolarHBondContact O-N 3.33Å; L803-Q807 PolarHBondContact O-N 2.84Å; L803-Q807 VanDerWaalsContact O-N 3.07Å
804	N	41.3	Very low	40.9	Very low	90 Å²	90	132.3 Å²	132.3	48%	0.481	64%	0.636	S	S	.	*	H	α-helix	trans	-66.3	-33.9	176.7	-71.5	-28.4	0	0	0	112.3	D801 R808	D801-N804 WeakPolarHBondContact OD1-CB 3.42Å; D801-N804 PolarHBondContact OD1-ND2 3.16Å; N804-R808 WeakPolarHBondContact O-CG 3.31Å; N804-R808 PolarHBondContact O-N 2.96Å
805	K	46	Very low	42.2	Very low	149 Å²	149	130.7 Å²	130.7	65%	0.648	63%	0.632	S	S	*	*	H	α-helix	trans	-63.9	-42.4	174.1	-94.9	-177	175.2	-179.9	0	112.6	D801 L803 L809	D801-K805 PolarHBondContact O-N 3.4Å; L803-K805 VanDerWaalsContact C-N 3.33Å; L803-K805 PolarHBondContact O-N 3.37Å; K805-L809 PolarHBondContact O-N 3.04Å; K805-L809 VanDerWaalsContact O-N 3.1Å
806	I	53.7	Low	43.4	Very low	99 Å²	99	128.6 Å²	128.6	51%	0.508	63%	0.63	S	S	.	*	H	α-helix	trans	-68.1	-43.5	179	-66.4	170.6	0	0	0	110.3	K802 L803 R808 L809 I810	K802-I806 PolarHBondContact O-N 3.04Å; L803-I806 PolarHBondContact O-N 3.33Å; I806-R808 PolarHBondContact O-N 3.15Å; I806-L809 WeakPolarHBondContact O-CB 3.46Å; I806-L809 PolarHBondContact O-N 2.96Å; I806-L809 VanDerWaalsContact O-N 3.12Å; I806-I810 HydrophobicContact CG2-CD1 3.9Å; I806-I810 HydrophobicContact CG2-CG1 4.42Å; I806-I810 WeakPolarHBondContact O-CG1 3.21Å; I806-I810 PolarHBondContact O-N 3.23Å
807	Q	49.7	Very low	44.6	Very low	104 Å²	104	129.4 Å²	129.4	49%	0.486	64%	0.638	S	S	.	*	H	α-helix	trans	-61.9	-43.2	177.8	-162.7	65.7	29.1	0	0	111.8	L803 L809 I810 D811	L803-Q807 PolarHBondContact O-N 2.84Å; L803-Q807 VanDerWaalsContact O-N 3.07Å; Q807-L809 VanDerWaalsContact C-N 3.28Å; Q807-L809 PolarHBondContact O-N 3.38Å; Q807-I810 PolarHBondContact O-N 3.45Å; Q807-D811 PolarHBondContact O-N 2.99Å
808	R	57.8	Low	45.7	Very low	160 Å²	160	127.1 Å²	127.1	60%	0.604	63%	0.628	S	S	*	*	H	α-helix	trans	-62.1	-33.4	174.2	-73.1	-177.5	-153	177.5	9.9	113.1	N804 I806 K812	N804-R808 WeakPolarHBondContact O-CG 3.31Å; N804-R808 PolarHBondContact O-N 2.96Å; I806-R808 PolarHBondContact O-N 3.15Å; R808-K812 VanDerWaalsContact O-CB 3.26Å; R808-K812 WeakPolarHBondContact O-CB 3.34Å; R808-K812 VanDerWaalsContact O-CG 3.27Å; R808-K812 WeakPolarHBondContact O-CG 3.19Å; R808-K812 PolarHBondContact O-N 3.16Å
809	L	58.8	Low	46.9	Very low	115 Å²	115	127.7 Å²	127.7	60%	0.602	63%	0.625	S	S	*	*	H	α-helix	trans	-70.7	-43.1	176.3	-110.7	143.3	0	0	0	111.3	K805 I806 Q807 K812 V813	K805-L809 PolarHBondContact O-N 3.04Å; K805-L809 VanDerWaalsContact O-N 3.1Å; I806-L809 WeakPolarHBondContact O-CB 3.46Å; I806-L809 PolarHBondContact O-N 2.96Å; I806-L809 VanDerWaalsContact O-N 3.12Å; Q807-L809 VanDerWaalsContact C-N 3.28Å; Q807-L809 PolarHBondContact O-N 3.38Å; L809-K812 PolarHBondContact O-N 2.85Å; L809-V813 WeakPolarHBondContact O-CG2 3.34Å; L809-V813 PolarHBondContact O-N 3.49Å
810	I	61.5	Low	48.1	Very low	89 Å²	89	125.4 Å²	125.4	46%	0.456	62%	0.616	S	S	.	*	H	α-helix	trans	-61.6	-48.4	175.3	-67.9	170.1	0	0	0	110.1	I806 Q807 K812 V813 K814	I806-I810 HydrophobicContact CG2-CD1 3.9Å; I806-I810 HydrophobicContact CG2-CG1 4.42Å; I806-I810 WeakPolarHBondContact O-CG1 3.21Å; I806-I810 PolarHBondContact O-N 3.23Å; Q807-I810 PolarHBondContact O-N 3.45Å; I810-K812 VanDerWaalsContact C-N 3.31Å; I810-K812 PolarHBondContact O-N 3.25Å; I810-V813 PolarHBondContact O-N 2.88Å; I810-K814 WeakPolarHBondContact O-CB 3.47Å; I810-K814 PolarHBondContact O-N 3.37Å
811	D	58.7	Low	49.4	Very low	72 Å²	72	122.5 Å²	122.5	39%	0.385	61%	0.607	S	S	.	*	H	α-helix	trans	-65.4	-34.7	179.6	-65.6	-26.8	0	0	0	111.9	Q807 K814 N815	Q807-D811 PolarHBondContact O-N 2.99Å; D811-K814 PolarHBondContact O-N 3.24Å; D811-N815 WeakPolarHBondContact O-CB 3.37Å; D811-N815 PolarHBondContact O-N 3.49Å; D811-N815 PolarHBondContact O-ND2 3.14Å
812	K	53.5	Low	50.4	Low	159 Å²	159	125.1 Å²	125.1	69%	0.691	62%	0.618	S	S	*	*	H	α-helix	trans	-67	-43.6	174.3	-87	-178.4	174.2	-173.2	0	113.2	R808 L809 I810 K814 N815 S816	R808-K812 VanDerWaalsContact O-CB 3.26Å; R808-K812 WeakPolarHBondContact O-CB 3.34Å; R808-K812 VanDerWaalsContact O-CG 3.27Å; R808-K812 WeakPolarHBondContact O-CG 3.19Å; R808-K812 PolarHBondContact O-N 3.16Å; L809-K812 PolarHBondContact O-N 2.85Å; I810-K812 VanDerWaalsContact C-N 3.31Å; I810-K812 PolarHBondContact O-N 3.25Å; K812-K814 VanDerWaalsContact C-N 3.3Å; K812-N815 PolarHBondContact O-N 3.25Å; K812-S816 WeakPolarHBondContact O-CB 3.18Å; K812-S816 PolarHBondContact O-N 3.48Å; K812-S816 VanDerWaalsContact O-N 3.12Å
813	V	56.9	Low	51.2	Low	81 Å²	81	123.3 Å²	123.3	49%	0.491	62%	0.616	S	S	.	*	H	α-helix	trans	-64.6	-40.6	176	171.9	0	0	0	0	109.8	L809 I810 N815 S816 I817	L809-V813 WeakPolarHBondContact O-CG2 3.34Å; L809-V813 PolarHBondContact O-N 3.49Å; I810-V813 PolarHBondContact O-N 2.88Å; V813-N815 VanDerWaalsContact C-N 3.31Å; V813-N815 PolarHBondContact O-N 3.29Å; V813-S816 PolarHBondContact O-N 3.23Å; V813-I817 HydrophobicContact CG1-CD1 3.96Å; V813-I817 WeakPolarHBondContact O-CG1 3.49Å; V813-I817 PolarHBondContact O-N 3.3Å; V813-I817 VanDerWaalsContact O-N 3.08Å
814	K	50.5	Low	52.1	Low	153 Å²	153	121.8 Å²	121.8	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-66.9	-28.6	179.8	-147.6	179.8	-173.2	-175.3	0	113.9	I810 D811 K812	I810-K814 WeakPolarHBondContact O-CB 3.47Å; I810-K814 PolarHBondContact O-N 3.37Å; D811-K814 PolarHBondContact O-N 3.24Å; K812-K814 VanDerWaalsContact C-N 3.3Å
815	N	47.7	Very low	52.9	Low	141 Å²	141	124.2 Å²	124.2	75%	0.754	62%	0.615	S	S	*	*	H	α-helix	trans	-86.8	-16	174.5	-72.2	-19.2	0	0	0	113.5	D811 K812 V813	D811-N815 WeakPolarHBondContact O-CB 3.37Å; D811-N815 PolarHBondContact O-N 3.49Å; D811-N815 PolarHBondContact O-ND2 3.14Å; K812-N815 PolarHBondContact O-N 3.25Å; V813-N815 VanDerWaalsContact C-N 3.31Å; V813-N815 PolarHBondContact O-N 3.29Å
816	S	46.9	Very low	53.5	Low	107 Å²	107	122.2 Å²	122.2	75%	0.748	61%	0.612	S	S	*	*	H	α-helix	trans	-93.8	-21.7	180	-171	0	0	0	0	113.3	K812 V813	K812-S816 WeakPolarHBondContact O-CB 3.18Å; K812-S816 PolarHBondContact O-N 3.48Å; K812-S816 VanDerWaalsContact O-N 3.12Å; V813-S816 PolarHBondContact O-N 3.23Å
817	I	46.3	Very low	53.5	Low	186 Å²	186	124.3 Å²	124.3	95%	0.954	62%	0.622	S	S	*	*			trans	-78.1	0	162.1	-62.7	169.5	0	0	0	107.5	V813	V813-I817 HydrophobicContact CG1-CD1 3.96Å; V813-I817 WeakPolarHBondContact O-CG1 3.49Å; V813-I817 PolarHBondContact O-N 3.3Å; V813-I817 VanDerWaalsContact O-N 3.08Å

Retrieved 817 of 817 residues in 1246 ms (Link to these results)

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