A0A077ZAZ8_TRITR Loading...

Homeobox protein SIX4

AlphaFold DB , UniProt , Accession A0A077ZAZ8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 235 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	38.2	Very low	223 Å²	223	114 Å²	114	100%	1.099	60%	0.599	S	S	*	*				0	83.6	0	-73	-97.7	-146.9	0	0	107.4	F3	M1-F3 PolarHBondContact O-N 3.09Å
2	C	28.7	Very low	38.9	Very low	124 Å²	124	110.7 Å²	110.7	84%	0.838	59%	0.587	S	S	*	*			trans	-82.7	104.4	177	-58.9	0	0	0	0	107.2	L4	C2-L4 PolarHBondContact O-N 3.12Å
3	F	29.5	Very low	39.1	Very low	168 Å²	168	112.8 Å²	112.8	74%	0.737	59%	0.588	S	S	*	*			trans	-61.4	101.9	168.2	-74.2	-86.8	0	0	0	107.5	M1 Y5	M1-F3 PolarHBondContact O-N 3.09Å; F3-Y5 VanDerWaalsContact C-N 3.26Å; F3-Y5 HydrophobicContact CB-CD2 4.05Å; F3-Y5 HydrophobicContact CB-CE2 3.78Å; F3-Y5 PolarHBondContact O-N 2.89Å
4	L	32.2	Very low	39.3	Very low	167 Å²	167	106.1 Å²	106.1	87%	0.874	55%	0.553	S	S	*	*			trans	-65.9	92.2	167.6	-71.7	166.4	0	0	0	106.6	C2 P6	C2-L4 PolarHBondContact O-N 3.12Å; L4-P6 WeakPolarHBondContact O-CD 3.14Å
5	Y	33.9	Very low	39.3	Very low	167 Å²	167	107.8 Å²	107.8	66%	0.655	56%	0.557	S	S	*	*			trans	-66.4	125.2	169.7	-84.4	-91	0	0	0	108.1	F3 T7	F3-Y5 VanDerWaalsContact C-N 3.26Å; F3-Y5 HydrophobicContact CB-CD2 4.05Å; F3-Y5 HydrophobicContact CB-CE2 3.78Å; F3-Y5 PolarHBondContact O-N 2.89Å; Y5-T7 PolarHBondContact O-N 3.06Å
6	P	37.7	Very low	39.3	Very low	88 Å²	88	110.8 Å²	110.8	57%	0.571	57%	0.568	S	S	*	*			trans	-58	129.5	177.3	-19.5	29.9	0	0	0	108.6	L4 Y8	L4-P6 WeakPolarHBondContact O-CD 3.14Å; P6-Y8 PolarHBondContact O-N 3.23Å
7	T	39.6	Very low	39	Very low	120 Å²	120	109.5 Å²	109.5	74%	0.736	56%	0.559	S	S	*	*			trans	-19.3	120.6	167.5	48.6	0	0	0	0	111.8	Y5 D9	Y5-T7 PolarHBondContact O-N 3.06Å; T7-D9 PolarHBondContact O-N 3.34Å
8	Y	46.7	Very low	38.9	Very low	50 Å²	50	109.3 Å²	109.3	20%	0.196	57%	0.566	C	S	.	*			trans	-55.5	87.4	169.8	-87.8	-91.8	0	0	0	109.4	P6 V10 Y64 L98 E128	P6-Y8 PolarHBondContact O-N 3.23Å; Y8-V10 HydrophobicContact CD1-CG2 4.17Å; Y8-V10 PolarHBondContact O-N 3.22Å; Y8-Y64 PolarHBondContact OH-OH 3.16Å; Y8-L98 HydrophobicContact CE1-CD2 4.43Å; Y8-E128 VanDerWaalsContact CD2-CD 3.42Å; Y8-E128 HydrophobicContact CD2-CG 4.34Å; Y8-E128 WeakPolarHBondContact CD2-OE1 3.37Å; Y8-E128 WeakPolarHBondContact CD2-OE2 3.48Å
9	D	48	Very low	39	Very low	78 Å²	78	111.2 Å²	111.2	42%	0.417	58%	0.576	S	S	.	*			trans	-84	56.8	177.5	-165.6	4.3	0	0	0	109.4	T7 V12	T7-D9 PolarHBondContact O-N 3.34Å; D9-V12 VanDerWaalsContact CG-CB 3.43Å; D9-V12 WeakPolarHBondContact OD1-CB 3.23Å; D9-V12 WeakPolarHBondContact OD1-CG2 3.3Å; D9-V12 PolarHBondContact OD1-N 2.81Å; D9-V12 VanDerWaalsContact OD2-CB 3.27Å; D9-V12 WeakPolarHBondContact OD2-CB 3.39Å; D9-V12 WeakPolarHBondContact OD2-CG2 3.35Å
10	V	50.1	Low	39	Very low	13 Å²	13	111.1 Å²	111.1	8%	0.079	57%	0.569	C	S	.	*	H	α-helix	trans	-70	-31.1	173.7	176.2	0	0	0	0	108.6	Y8 L14	Y8-V10 HydrophobicContact CD1-CG2 4.17Å; Y8-V10 PolarHBondContact O-N 3.22Å; V10-L14 HydrophobicContact CG1-CD1 3.36Å; V10-L14 HydrophobicContact CG1-CG 3.9Å; V10-L14 WeakPolarHBondContact O-CB 3.41Å; V10-L14 WeakPolarHBondContact O-CD1 3.39Å; V10-L14 WeakPolarHBondContact O-CG 3.16Å; V10-L14 PolarHBondContact O-N 3.15Å
11	S	42.3	Very low	38.7	Very low	56 Å²	56	111.4 Å²	111.4	39%	0.392	57%	0.572	S	S	.	*	H	α-helix	trans	-68.2	-41.7	178.8	-60.7	0	0	0	0	114.3
12	V	46.3	Very low	39	Very low	74 Å²	74	105.2 Å²	105.2	45%	0.448	55%	0.55	S	S	.	.	H	α-helix	trans	-78.5	-31.1	-179.1	178.4	0	0	0	0	111.7	D9	D9-V12 VanDerWaalsContact CG-CB 3.43Å; D9-V12 WeakPolarHBondContact OD1-CB 3.23Å; D9-V12 WeakPolarHBondContact OD1-CG2 3.3Å; D9-V12 PolarHBondContact OD1-N 2.81Å; D9-V12 VanDerWaalsContact OD2-CB 3.27Å; D9-V12 WeakPolarHBondContact OD2-CB 3.39Å; D9-V12 WeakPolarHBondContact OD2-CG2 3.35Å
13	K	41.7	Very low	39.2	Very low	138 Å²	138	104.4 Å²	104.4	60%	0.6	54%	0.544	S	S	*	.	H	α-helix	trans	-81.3	-27.8	176.5	-75	-164.5	175	-172	0	114.2	Q15 Q16	K13-Q15 VanDerWaalsContact C-N 3.3Å; K13-Q15 PolarHBondContact O-N 3.44Å; K13-Q16 PolarHBondContact O-N 2.91Å
14	L	41.7	Very low	39.2	Very low	19 Å²	19	101.9 Å²	101.9	10%	0.099	55%	0.546	C	S	.	.	H	α-helix	trans	-69.3	-26.2	174.3	-76.6	174.2	0	0	0	113.1	V10 Q16 H17 Y20 I102 M136	V10-L14 HydrophobicContact CG1-CD1 3.36Å; V10-L14 HydrophobicContact CG1-CG 3.9Å; V10-L14 WeakPolarHBondContact O-CB 3.41Å; V10-L14 WeakPolarHBondContact O-CD1 3.39Å; V10-L14 WeakPolarHBondContact O-CG 3.16Å; V10-L14 PolarHBondContact O-N 3.15Å; L14-Q16 PolarHBondContact O-N 3.4Å; L14-H17 PolarHBondContact O-N 3.03Å; L14-Y20 HydrophobicContact CB-CD2 4.37Å; L14-Y20 HydrophobicContact CB-CE2 4.48Å; L14-Y20 VanDerWaalsContact O-CB 3.31Å; L14-Y20 WeakPolarHBondContact O-CB 3.27Å; L14-I102 HydrophobicContact CD2-CG2 3.88Å; L14-M136 HydrophobicContact CD1-CE 3.83Å
15	Q	39.6	Very low	39	Very low	132 Å²	132	104.8 Å²	104.8	62%	0.617	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-14.6	175	-75.9	171	-31.2	0	0	113.7	K13	K13-Q15 VanDerWaalsContact C-N 3.3Å; K13-Q15 PolarHBondContact O-N 3.44Å
16	Q	39.1	Very low	38.8	Very low	156 Å²	156	100.1 Å²	100.1	73%	0.729	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-4.8	178.6	-64.5	-177.3	-7.3	0	0	113.4	K13 L14 P18	K13-Q16 PolarHBondContact O-N 2.91Å; L14-Q16 PolarHBondContact O-N 3.4Å; Q16-P18 WeakPolarHBondContact O-CD 3.38Å
17	H	34.9	Very low	38.3	Very low	89 Å²	89	99.6 Å²	99.6	41%	0.412	56%	0.56	S	S	.	*			trans	-85.9	122.9	177.1	-106.6	-81.3	0	0	0	111.3	L14 L19 Y20	L14-H17 PolarHBondContact O-N 3.03Å; H17-L19 PolarHBondContact O-N 3.49Å; H17-Y20 WeakPolarHBondContact O-CB 3.4Å; H17-Y20 PolarHBondContact O-N 3.07Å
18	P	36.2	Very low	38.1	Very low	106 Å²	106	104 Å²	104	69%	0.688	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-20	-179.5	-24.8	33.2	0	0	0	114.8	Q16	Q16-P18 WeakPolarHBondContact O-CD 3.38Å
19	L	40.8	Very low	37.3	Very low	144 Å²	144	106.1 Å²	106.1	75%	0.754	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-12.2	179.6	-60.2	-178.2	0	0	0	113.8	H17 N21	H17-L19 PolarHBondContact O-N 3.49Å; L19-N21 VanDerWaalsContact C-N 3.34Å
20	Y	38.8	Very low	36.7	Very low	110 Å²	110	111.9 Å²	111.9	43%	0.431	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-73.6	-28	174.4	-170.7	-103.6	0	0	0	111.8	L14 H17 S22	L14-Y20 HydrophobicContact CB-CD2 4.37Å; L14-Y20 HydrophobicContact CB-CE2 4.48Å; L14-Y20 VanDerWaalsContact O-CB 3.31Å; L14-Y20 WeakPolarHBondContact O-CB 3.27Å; H17-Y20 WeakPolarHBondContact O-CB 3.4Å; H17-Y20 PolarHBondContact O-N 3.07Å; Y20-S22 VanDerWaalsContact C-N 3.33Å; Y20-S22 PolarHBondContact O-N 3.25Å
21	N	34.4	Very low	35.9	Very low	118 Å²	118	120.6 Å²	120.6	63%	0.631	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-84	-0.1	178.4	-76.1	-17.5	0	0	0	114.6	L19	L19-N21 VanDerWaalsContact C-N 3.34Å
22	S	37	Very low	35.5	Very low	92 Å²	92	123.4 Å²	123.4	64%	0.643	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-92.4	-2.4	-175.8	-172	0	0	0	0	114.4	Y20	Y20-S22 VanDerWaalsContact C-N 3.33Å; Y20-S22 PolarHBondContact O-N 3.25Å
23	C	32.3	Very low	35	Very low	107 Å²	107	128.4 Å²	128.4	72%	0.723	69%	0.694	S	S	*	*			trans	-113.2	39.7	-177.4	-156.1	0	0	0	0	113.1	Y25	C23-Y25 VanDerWaalsContact C-N 3.33Å; C23-Y25 PolarHBondContact O-N 3.44Å
24	C	29.8	Very low	34.5	Very low	115 Å²	115	126.1 Å²	126.1	78%	0.777	70%	0.701	S	S	*	*			trans	-87.6	73	164.4	-65.7	0	0	0	0	109.4	G26	C24-G26 VanDerWaalsContact C-N 3.32Å; C24-G26 PolarHBondContact O-N 2.94Å; C24-G26 VanDerWaalsContact O-N 3.13Å
25	Y	27.4	Very low	34.2	Very low	229 Å²	229	133.4 Å²	133.4	90%	0.898	74%	0.739	S	S	*	*			trans	-80.1	84.6	165.3	-99.1	-87	0	0	0	108.9	C23	C23-Y25 VanDerWaalsContact C-N 3.33Å; C23-Y25 PolarHBondContact O-N 3.44Å
26	G	31.4	Very low	34	Very low	68 Å²	68	135.9 Å²	135.9	70%	0.701	75%	0.751	S	S	*	*			trans	-128.9	101.2	171.1	0	0	0	0	0	108.7	C24	C24-G26 VanDerWaalsContact C-N 3.32Å; C24-G26 PolarHBondContact O-N 2.94Å; C24-G26 VanDerWaalsContact O-N 3.13Å
27	G	26.7	Very low	33.9	Very low	77 Å²	77	134.2 Å²	134.2	79%	0.794	75%	0.753	S	S	*	*			trans	-63	145.8	-164	0	0	0	0	0	115.8
28	K	34.8	Very low	33.9	Very low	213 Å²	213	135.7 Å²	135.7	93%	0.926	77%	0.774	S	S	*	*			trans	-146.9	128.7	141.9	-96.4	172.6	-175.6	180	0	107.7
29	A	29.7	Very low	33.9	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	78%	0.782	S	S	*	*			trans	-63.8	138	176	0	0	0	0	0	110.4
30	E	35.5	Very low	33.6	Very low	199 Å²	199	139.5 Å²	139.5	93%	0.93	79%	0.789	S	S	*	*			trans	-170.6	138	138.2	-105.1	159.6	-168.5	0	0	111.7
31	K	33.5	Very low	33.5	Very low	196 Å²	196	136.8 Å²	136.8	85%	0.852	79%	0.794	S	S	*	*			trans	-46.5	150.9	177.6	-73.1	159.4	159.2	172	0	112.9
32	T	34.8	Very low	33.5	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	81%	0.806	S	S	*	*				158.7	126.4	103.5	-60.5	0	0	0	0	112.4
33	M	35.6	Very low	33.8	Very low	179 Å²	179	141.2 Å²	141.2	88%	0.882	82%	0.815	S	S	*	*			trans	72	128.3	150.1	-72.2	165.4	75.9	0	0	123.3
34	A	30.5	Very low	34.3	Very low	90 Å²	90	142.5 Å²	142.5	74%	0.744	82%	0.819	S	S	*	*			trans	-60.3	154.7	170.1	0	0	0	0	0	114
35	L	36.5	Very low	35.2	Very low	171 Å²	171	141.6 Å²	141.6	90%	0.895	82%	0.82	S	S	*	*			trans	-169.9	115.3	132.9	-95.1	155.3	0	0	0	107.3
36	Q	33.9	Very low	36.4	Very low	184 Å²	184	135.7 Å²	135.7	86%	0.86	81%	0.813	S	S	*	*			trans	-81.1	146.4	159.5	-73.3	-172.6	-36.8	0	0	108.2
37	P	37.7	Very low	37.6	Very low	121 Å²	121	138 Å²	138	79%	0.786	82%	0.815	S	S	*	*			trans	-130.3	138.4	131.9	23.7	-6.5	0	0	0	111.8
38	S	33.8	Very low	39.5	Very low	120 Å²	120	141.2 Å²	141.2	84%	0.839	80%	0.803	S	S	*	*			trans	-47.4	135.3	162.9	-46.3	0	0	0	0	111.5
39	D	37.4	Very low	41.2	Very low	163 Å²	163	136.5 Å²	136.5	87%	0.872	79%	0.788	S	S	*	*			trans	-142.4	132.4	148.7	-148.1	-2.1	0	0	0	111.6	G41	D39-G41 PolarHBondContact O-N 3.34Å
40	N	34.6	Very low	43.5	Very low	167 Å²	167	136.1 Å²	136.1	89%	0.893	78%	0.784	S	S	*	*			trans	-87	98.8	-174.5	-123.3	-4.9	0	0	0	106.9
41	G	36.3	Very low	45.7	Very low	53 Å²	53	130 Å²	130	55%	0.546	75%	0.753	S	S	.	*			trans	-121.4	91.2	-179.7	0	0	0	0	0	112.1	D39 H43	D39-G41 PolarHBondContact O-N 3.34Å; G41-H43 VanDerWaalsContact C-N 3.32Å; G41-H43 PolarHBondContact O-N 2.87Å
42	S	33.5	Very low	48.2	Very low	126 Å²	126	124.2 Å²	124.2	88%	0.881	73%	0.734	S	S	*	*			trans	-59	92	162.6	-86	0	0	0	0	109.9
43	H	44.2	Very low	50.8	Low	177 Å²	177	122 Å²	122	82%	0.819	72%	0.723	S	S	*	*			trans	-92	107	163.4	-74.9	-71.9	0	0	0	108.6	G41 A45	G41-H43 VanDerWaalsContact C-N 3.32Å; G41-H43 PolarHBondContact O-N 2.87Å; H43-A45 PolarHBondContact O-N 3.48Å; H43-A45 VanDerWaalsContact O-N 3.12Å
44	T	42.2	Very low	53.3	Low	134 Å²	134	121 Å²	121	82%	0.822	72%	0.716	S	S	*	*			trans	-48.9	113.6	166.3	45.6	0	0	0	0	109.5	S46	T44-S46 PolarHBondContact O-N 2.94Å; T44-S46 VanDerWaalsContact O-N 3.09Å
45	A	48.3	Very low	56.2	Low	96 Å²	96	121 Å²	121	79%	0.793	70%	0.701	S	S	*	*			trans	-61.2	113.9	173.2	0	0	0	0	0	108.4	H43	H43-A45 PolarHBondContact O-N 3.48Å; H43-A45 VanDerWaalsContact O-N 3.12Å
46	S	53.6	Low	58.7	Low	106 Å²	106	113 Å²	113	74%	0.741	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-53.7	132.5	172.7	-76.4	0	0	0	0	109.3	T44 R48	T44-S46 PolarHBondContact O-N 2.94Å; T44-S46 VanDerWaalsContact O-N 3.09Å; S46-R48 PolarHBondContact O-N 2.77Å; S46-R48 VanDerWaalsContact O-N 3.15Å
47	P	56.6	Low	61.4	Low	115 Å²	115	104.8 Å²	104.8	75%	0.747	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-58.3	123.1	-179.2	23.7	-32.3	0	0	0	108.7	L49	P47-L49 PolarHBondContact O-N 3.44Å
48	R	65.6	Low	64	Low	146 Å²	146	102.8 Å²	102.8	55%	0.551	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-66.7	119.5	174.4	-73.6	-167.9	-177.9	-158.1	-0.7	108.4	S46 A50 Y78 R80	S46-R48 PolarHBondContact O-N 2.77Å; S46-R48 VanDerWaalsContact O-N 3.15Å; R48-A50 PolarHBondContact O-N 2.74Å; R48-Y78 VanDerWaalsContact CA-OH 3.23Å; R48-Y78 WeakPolarHBondContact CA-OH 3.21Å; R48-Y78 HydrophobicContact CG-CE2 4.42Å; R48-Y78 PolarHBondContact NH1-O 2.82Å; R48-R80 VanDerWaalsContact NH1-CG 3.3Å
49	L	70.7	Confident	66.8	Low	114 Å²	114	99.2 Å²	99.2	60%	0.597	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-68.9	116.3	168.2	-68.2	167.3	0	0	0	107.2	P47 Y78	P47-L49 PolarHBondContact O-N 3.44Å; L49-Y78 PolarHBondContact N-OH 3.33Å
50	A	78.1	Confident	69.4	Low	86 Å²	86	91.5 Å²	91.5	71%	0.711	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-79	120.2	170.9	0	0	0	0	0	108.4	R48	R48-A50 PolarHBondContact O-N 2.74Å
51	Y	82	Confident	72	Confident	72 Å²	72	85.6 Å²	85.6	28%	0.282	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-90.3	142.4	174.6	-64.2	-77.7	0	0	0	110	Q55 I59 F75 Y78 L79	Y51-Q55 HydrophobicContact CD1-CB 4.31Å; Y51-I59 HydrophobicContact CD1-CD1 3.8Å; Y51-I59 HydrophobicContact CE1-CD1 3.79Å; Y51-I59 HydrophobicContact CG-CD1 4.41Å; Y51-F75 AromaticContact CD2-CE2 3.98Å; Y51-F75 HydrophobicContact CD2-CE2 3.98Å; Y51-F75 HydrophobicContact CD2-CZ 4.42Å; Y51-F75 AromaticContact CE2-CE2 3.77Å; Y51-F75 HydrophobicContact CE2-CE2 3.77Å; Y51-Y78 HydrophobicContact CE2-CD1 4.27Å; Y51-Y78 AromaticContact CE2-CE1 3.9Å; Y51-Y78 HydrophobicContact CE2-CE1 3.9Å; Y51-L79 HydrophobicContact CD2-CD2 4.09Å
52	T	87.2	Confident	74.7	Confident	74 Å²	74	87 Å²	87	45%	0.454	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-69.7	157.7	167.9	61.2	0	0	0	0	110.5	E54 Q55 I56	T52-E54 PolarHBondContact O-N 3.42Å; T52-Q55 WeakPolarHBondContact O-CB 3.36Å; T52-Q55 PolarHBondContact O-N 3.02Å; T52-Q55 VanDerWaalsContact O-N 3.07Å; T52-Q55 WeakPolarHBondContact OG1-CB 3.33Å; T52-Q55 WeakPolarHBondContact OG1-CG 3.45Å; T52-Q55 PolarHBondContact OG1-N 3.26Å; T52-Q55 PolarHBondContact OG1-OE1 3.43Å; T52-Q55 VanDerWaalsContact OG1-OE1 3.06Å; T52-I56 WeakPolarHBondContact O-CG1 3.47Å; T52-I56 PolarHBondContact O-N 2.89Å
53	S	87.8	Confident	77.5	Confident	68 Å²	68	82.5 Å²	82.5	48%	0.476	47%	0.471	S	S	.	.	H	α-helix	trans	-53.5	-40.5	175.8	50.3	0	0	0	0	112.7	I56 A57 L87	S53-I56 PolarHBondContact O-N 3.35Å; S53-A57 PolarHBondContact O-N 3.28Å; S53-L87 VanDerWaalsContact CB-CD2 3.44Å
54	E	88.2	Confident	79.6	Confident	157 Å²	157	75.4 Å²	75.4	73%	0.734	44%	0.438	S	S	*	.	H	α-helix	trans	-66.8	-41.3	176.8	-65.3	-179.3	-175.2	0	0	112.3	T52 A57 C58	T52-E54 PolarHBondContact O-N 3.42Å; E54-A57 PolarHBondContact O-N 2.59Å; E54-C58 VanDerWaalsContact O-CB 3.3Å; E54-C58 WeakPolarHBondContact O-CB 3.2Å; E54-C58 PolarHBondContact O-N 3.33Å
55	Q	90.9	Very high	81.9	Confident	92 Å²	92	77.9 Å²	77.9	43%	0.43	43%	0.432	S	S	.	.	H	α-helix	trans	-64	-43.2	175.5	-75.9	165.9	-23.2	0	0	111.1	Y51 T52 A57 C58 I59	Y51-Q55 HydrophobicContact CD1-CB 4.31Å; T52-Q55 WeakPolarHBondContact O-CB 3.36Å; T52-Q55 PolarHBondContact O-N 3.02Å; T52-Q55 VanDerWaalsContact O-N 3.07Å; T52-Q55 WeakPolarHBondContact OG1-CB 3.33Å; T52-Q55 WeakPolarHBondContact OG1-CG 3.45Å; T52-Q55 PolarHBondContact OG1-N 3.26Å; T52-Q55 PolarHBondContact OG1-OE1 3.43Å; T52-Q55 VanDerWaalsContact OG1-OE1 3.06Å; Q55-A57 PolarHBondContact O-N 3Å; Q55-C58 PolarHBondContact O-N 3.09Å; Q55-I59 WeakPolarHBondContact O-CB 3.22Å; Q55-I59 WeakPolarHBondContact O-CD1 3.34Å; Q55-I59 WeakPolarHBondContact O-CG1 3.39Å; Q55-I59 PolarHBondContact O-N 3.44Å
56	I	90.7	Very high	83.9	Confident	3 Å²	3	76.6 Å²	76.6	2%	0.015	42%	0.421	C	S	.	.	H	α-helix	trans	-59.7	-48.7	176.6	-63.9	171.2	0	0	0	109.9	T52 S53 C58 I59 C60 F75 L79 E83 L87 V92	T52-I56 WeakPolarHBondContact O-CG1 3.47Å; T52-I56 PolarHBondContact O-N 2.89Å; S53-I56 PolarHBondContact O-N 3.35Å; I56-C58 PolarHBondContact O-N 2.78Å; I56-I59 PolarHBondContact O-N 3.43Å; I56-C60 WeakPolarHBondContact O-CB 3.4Å; I56-C60 PolarHBondContact O-N 3.4Å; I56-C60 PolarHBondContact O-SG 2.94Å; I56-F75 HydrophobicContact CG1-CZ 4.36Å; I56-F75 HydrophobicContact CG2-CE1 4.15Å; I56-F75 HydrophobicContact CG2-CZ 4.39Å; I56-L79 HydrophobicContact CD1-CD2 4.35Å; I56-L79 HydrophobicContact CG2-CD1 4.22Å; I56-E83 HydrophobicContact CD1-CB 4.32Å; I56-L87 HydrophobicContact CB-CD1 4.02Å; I56-L87 HydrophobicContact CD1-CD1 4.1Å; I56-L87 HydrophobicContact CG2-CD1 3.84Å; I56-V92 HydrophobicContact CG2-CG1 4.46Å; I56-V92 HydrophobicContact CG2-CG2 4.14Å
57	A	90.8	Very high	85.4	Confident	11 Å²	11	75.4 Å²	75.4	9%	0.091	40%	0.403	C	S	.	.	H	α-helix	trans	-60	-44.4	178.1	0	0	0	0	0	112.5	S53 E54 Q55 C60 E61 N89 V92	S53-A57 PolarHBondContact O-N 3.28Å; E54-A57 PolarHBondContact O-N 2.59Å; Q55-A57 PolarHBondContact O-N 3Å; A57-C60 PolarHBondContact O-N 2.94Å; A57-E61 WeakPolarHBondContact O-CB 3.34Å; A57-E61 PolarHBondContact O-N 3.42Å; A57-N89 HydrophobicContact CB-CB 4.39Å; A57-V92 HydrophobicContact CB-CG2 3.98Å
58	C	92	Very high	87	Confident	78 Å²	78	73.1 Å²	73.1	53%	0.527	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-43.2	178	-174.8	0	0	0	0	112.4	E54 Q55 I56 E61 T62	E54-C58 VanDerWaalsContact O-CB 3.3Å; E54-C58 WeakPolarHBondContact O-CB 3.2Å; E54-C58 PolarHBondContact O-N 3.33Å; Q55-C58 PolarHBondContact O-N 3.09Å; I56-C58 PolarHBondContact O-N 2.78Å; C58-E61 PolarHBondContact O-N 2.71Å; C58-T62 WeakPolarHBondContact O-CB 3.16Å; C58-T62 PolarHBondContact O-N 2.55Å; C58-T62 PolarHBondContact O-OG1 2.91Å
59	I	91.7	Very high	88.1	Confident	46 Å²	46	68.3 Å²	68.3	24%	0.236	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-49.2	176.1	-68	163.4	0	0	0	109.8	Y51 Q55 I56 E61 T62 L63 F75	Y51-I59 HydrophobicContact CD1-CD1 3.8Å; Y51-I59 HydrophobicContact CE1-CD1 3.79Å; Y51-I59 HydrophobicContact CG-CD1 4.41Å; Q55-I59 WeakPolarHBondContact O-CB 3.22Å; Q55-I59 WeakPolarHBondContact O-CD1 3.34Å; Q55-I59 WeakPolarHBondContact O-CG1 3.39Å; Q55-I59 PolarHBondContact O-N 3.44Å; I56-I59 PolarHBondContact O-N 3.43Å; I59-E61 PolarHBondContact O-N 2.89Å; I59-T62 PolarHBondContact O-N 2.88Å; I59-L63 HydrophobicContact CG2-CD1 3.69Å; I59-L63 HydrophobicContact CG2-CG 4.15Å; I59-L63 WeakPolarHBondContact O-CB 3.36Å; I59-L63 VanDerWaalsContact O-CG 3.27Å; I59-L63 WeakPolarHBondContact O-CG 3.14Å; I59-L63 PolarHBondContact O-N 3.31Å; I59-F75 HydrophobicContact CB-CE1 4.17Å; I59-F75 HydrophobicContact CB-CZ 4.01Å; I59-F75 HydrophobicContact CD1-CE2 3.9Å; I59-F75 HydrophobicContact CD1-CZ 3.81Å; I59-F75 HydrophobicContact CG2-CD1 3.97Å; I59-F75 HydrophobicContact CG2-CD2 4.15Å; I59-F75 HydrophobicContact CG2-CE1 3.72Å; I59-F75 HydrophobicContact CG2-CE2 3.95Å; I59-F75 HydrophobicContact CG2-CG 4.17Å; I59-F75 HydrophobicContact CG2-CZ 3.72Å
60	C	92.1	Very high	88.9	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-57.7	-46.9	177.7	-73.5	0	0	0	0	112	I56 A57 T62 Y64 V92 A95	I56-C60 WeakPolarHBondContact O-CB 3.4Å; I56-C60 PolarHBondContact O-N 3.4Å; I56-C60 PolarHBondContact O-SG 2.94Å; A57-C60 PolarHBondContact O-N 2.94Å; C60-T62 PolarHBondContact O-N 3.45Å; C60-Y64 WeakPolarHBondContact O-CB 3.39Å; C60-Y64 PolarHBondContact O-N 3.41Å; C60-V92 HydrophobicContact CB-CG2 4.44Å; C60-A95 HydrophobicContact CB-CB 3.79Å
61	E	90.1	Very high	89.5	Confident	44 Å²	44	61.9 Å²	61.9	21%	0.206	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-44.9	177.6	-177.2	64.5	-165.3	0	0	111.7	A57 C58 I59 Y64 R65 S91	A57-E61 WeakPolarHBondContact O-CB 3.34Å; A57-E61 PolarHBondContact O-N 3.42Å; C58-E61 PolarHBondContact O-N 2.71Å; I59-E61 PolarHBondContact O-N 2.89Å; E61-Y64 PolarHBondContact O-N 3.5Å; E61-R65 WeakPolarHBondContact O-CB 3.34Å; E61-R65 WeakPolarHBondContact O-CG 3.27Å; E61-R65 PolarHBondContact O-N 3.49Å; E61-R65 IonicContact OE1-CZ 3.15Å; E61-R65 IonicContact OE1-NE 2.71Å; E61-R65 PolarHBondContact OE1-NE 3.3Å; E61-R65 IonicContact OE1-NH2 2.78Å; E61-R65 PolarHBondContact OE1-NH2 3.09Å; E61-S91 VanDerWaalsContact OE2-CB 3.22Å; E61-S91 WeakPolarHBondContact OE2-CB 3.47Å; E61-S91 PolarHBondContact OE2-OG 3.47Å
62	T	93.1	Very high	89.9	Confident	83 Å²	83	58.5 Å²	58.5	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-47.3	-179.2	-57.6	0	0	0	0	111.3	C58 I59 C60 Y64 R65 A66	C58-T62 WeakPolarHBondContact O-CB 3.16Å; C58-T62 PolarHBondContact O-N 2.55Å; C58-T62 PolarHBondContact O-OG1 2.91Å; I59-T62 PolarHBondContact O-N 2.88Å; C60-T62 PolarHBondContact O-N 3.45Å; T62-Y64 VanDerWaalsContact C-N 3.35Å; T62-R65 PolarHBondContact O-N 3.1Å; T62-A66 WeakPolarHBondContact O-CB 3.34Å; T62-A66 PolarHBondContact O-N 2.91Å
63	L	91.5	Very high	90	Very high	30 Å²	30	55.6 Å²	55.6	16%	0.157	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-39.3	178.3	-68.4	178.4	0	0	0	111.9	I59 A66 K67 D68 I72 F75	I59-L63 HydrophobicContact CG2-CD1 3.69Å; I59-L63 HydrophobicContact CG2-CG 4.15Å; I59-L63 WeakPolarHBondContact O-CB 3.36Å; I59-L63 VanDerWaalsContact O-CG 3.27Å; I59-L63 WeakPolarHBondContact O-CG 3.14Å; I59-L63 PolarHBondContact O-N 3.31Å; L63-A66 PolarHBondContact O-N 3.3Å; L63-K67 PolarHBondContact O-N 3.18Å; L63-K67 VanDerWaalsContact O-N 3.09Å; L63-D68 PolarHBondContact O-N 3.09Å; L63-I72 HydrophobicContact CB-CD1 4.19Å; L63-I72 HydrophobicContact CB-CG1 3.59Å; L63-I72 HydrophobicContact CD1-CG1 4.12Å; L63-I72 HydrophobicContact CG-CG1 4.47Å; L63-F75 HydrophobicContact CD1-CB 4.3Å
64	Y	88.6	Confident	90	Very high	28 Å²	28	58.5 Å²	58.5	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-47.2	176.2	-170	-85.7	0	0	0	111.3	Y8 C60 E61 T62 A66 K67 R94 L98	Y8-Y64 PolarHBondContact OH-OH 3.16Å; C60-Y64 WeakPolarHBondContact O-CB 3.39Å; C60-Y64 PolarHBondContact O-N 3.41Å; E61-Y64 PolarHBondContact O-N 3.5Å; T62-Y64 VanDerWaalsContact C-N 3.35Å; Y64-A66 PolarHBondContact O-N 3.01Å; Y64-K67 PolarHBondContact O-N 3.06Å; Y64-R94 HydrophobicContact CD2-CB 4.15Å; Y64-R94 HydrophobicContact CE2-CB 3.82Å; Y64-L98 HydrophobicContact CD2-CD1 3.53Å; Y64-L98 HydrophobicContact CE2-CD1 3.32Å; Y64-L98 HydrophobicContact CE2-CG 4.11Å
65	R	89.2	Confident	90.1	Very high	186 Å²	186	52 Å²	52	70%	0.702	27%	0.273	S	S	*	.	H	α-helix	trans	-63.1	-38.9	175.7	-73.8	-177.8	-174.4	-170.1	4.9	113	E61 T62 K67	E61-R65 WeakPolarHBondContact O-CB 3.34Å; E61-R65 WeakPolarHBondContact O-CG 3.27Å; E61-R65 PolarHBondContact O-N 3.49Å; E61-R65 IonicContact OE1-CZ 3.15Å; E61-R65 IonicContact OE1-NE 2.71Å; E61-R65 PolarHBondContact OE1-NE 3.3Å; E61-R65 IonicContact OE1-NH2 2.78Å; E61-R65 PolarHBondContact OE1-NH2 3.09Å; T62-R65 PolarHBondContact O-N 3.1Å; R65-K67 PolarHBondContact O-N 3.36Å
66	A	90.3	Very high	90	Very high	69 Å²	69	47.9 Å²	47.9	57%	0.57	25%	0.254	S	S	*	.	H	α-helix	trans	-69.2	-13.8	175.7	0	0	0	0	0	113	T62 L63 Y64 D68	T62-A66 WeakPolarHBondContact O-CB 3.34Å; T62-A66 PolarHBondContact O-N 2.91Å; L63-A66 PolarHBondContact O-N 3.3Å; Y64-A66 PolarHBondContact O-N 3.01Å; A66-D68 HydrophobicContact CB-CB 4.42Å; A66-D68 PolarHBondContact O-N 3.39Å
67	K	87	Confident	89.9	Confident	82 Å²	82	51.7 Å²	51.7	36%	0.357	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	31.5	-171.6	-58.5	-176.9	178	-171.6	0	112.7	L63 Y64 R65 Y69	L63-K67 PolarHBondContact O-N 3.18Å; L63-K67 VanDerWaalsContact O-N 3.09Å; Y64-K67 PolarHBondContact O-N 3.06Å; R65-K67 PolarHBondContact O-N 3.36Å; K67-Y69 HydrophobicContact CB-CE1 4.47Å; K67-Y69 HydrophobicContact CB-CE2 4.35Å; K67-Y69 PolarHBondContact O-N 3.03Å
68	D	89	Confident	89.7	Confident	67 Å²	67	55 Å²	55	36%	0.358	29%	0.285	S	S	.	.			trans	-89.1	79	177.4	-172.5	-4.6	0	0	0	110.5	L63 A66 G70 S71 I72	L63-D68 PolarHBondContact O-N 3.09Å; A66-D68 HydrophobicContact CB-CB 4.42Å; A66-D68 PolarHBondContact O-N 3.39Å; D68-G70 VanDerWaalsContact C-N 3.26Å; D68-G70 PolarHBondContact O-N 3.4Å; D68-G70 PolarHBondContact OD1-N 3.19Å; D68-S71 VanDerWaalsContact CG-CB 3.43Å; D68-S71 PolarHBondContact O-N 3.18Å; D68-S71 PolarHBondContact OD1-N 3.47Å; D68-S71 VanDerWaalsContact OD1-N 3.09Å; D68-S71 PolarHBondContact OD1-OG 3.38Å; D68-S71 WeakPolarHBondContact OD2-CB 3.35Å; D68-S71 PolarHBondContact OD2-OG 3.09Å; D68-I72 WeakPolarHBondContact O-CG1 3.36Å; D68-I72 PolarHBondContact O-N 3.49Å; D68-I72 VanDerWaalsContact O-N 3.09Å
69	Y	88.7	Confident	89.4	Confident	44 Å²	44	51.7 Å²	51.7	17%	0.173	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-29.3	-178	-52	-55.2	0	0	0	113.3	K67 I72 C73 L98	K67-Y69 HydrophobicContact CB-CE1 4.47Å; K67-Y69 HydrophobicContact CB-CE2 4.35Å; K67-Y69 PolarHBondContact O-N 3.03Å; Y69-I72 HydrophobicContact CD1-CD1 4.34Å; Y69-I72 PolarHBondContact O-N 3.15Å; Y69-C73 PolarHBondContact O-N 3.34Å; Y69-L98 HydrophobicContact CD1-CD1 4.15Å; Y69-L98 HydrophobicContact CE1-CD1 3.96Å
70	G	88.4	Confident	88.9	Confident	19 Å²	19	56 Å²	56	20%	0.196	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-48.2	177.8	0	0	0	0	0	110.8	D68 I72 C73 H74	D68-G70 VanDerWaalsContact C-N 3.26Å; D68-G70 PolarHBondContact O-N 3.4Å; D68-G70 PolarHBondContact OD1-N 3.19Å; G70-I72 VanDerWaalsContact C-N 3.34Å; G70-I72 PolarHBondContact O-N 3.01Å; G70-C73 PolarHBondContact O-N 3.46Å; G70-H74 PolarHBondContact O-CD2 3.45Å; G70-H74 PolarHBondContact O-N 3.27Å
71	S	90	Very high	88.3	Confident	46 Å²	46	59.2 Å²	59.2	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-36.3	175.7	-66.1	0	0	0	0	112.6	D68 C73 H74 F75	D68-S71 VanDerWaalsContact CG-CB 3.43Å; D68-S71 PolarHBondContact O-N 3.18Å; D68-S71 PolarHBondContact OD1-N 3.47Å; D68-S71 VanDerWaalsContact OD1-N 3.09Å; D68-S71 PolarHBondContact OD1-OG 3.38Å; D68-S71 WeakPolarHBondContact OD2-CB 3.35Å; D68-S71 PolarHBondContact OD2-OG 3.09Å; S71-C73 VanDerWaalsContact C-N 3.35Å; S71-C73 PolarHBondContact O-N 3.18Å; S71-H74 PolarHBondContact O-N 3.44Å; S71-F75 VanDerWaalsContact O-CB 3.27Å; S71-F75 WeakPolarHBondContact O-CB 3.24Å; S71-F75 PolarHBondContact O-N 2.88Å
72	I	89.9	Confident	87.7	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-57.6	-49.4	171.6	-68.2	172.3	0	0	0	110.1	L63 D68 Y69 G70 H74 F75 F76 A95 L98 H99	L63-I72 HydrophobicContact CB-CD1 4.19Å; L63-I72 HydrophobicContact CB-CG1 3.59Å; L63-I72 HydrophobicContact CD1-CG1 4.12Å; L63-I72 HydrophobicContact CG-CG1 4.47Å; D68-I72 WeakPolarHBondContact O-CG1 3.36Å; D68-I72 PolarHBondContact O-N 3.49Å; D68-I72 VanDerWaalsContact O-N 3.09Å; Y69-I72 HydrophobicContact CD1-CD1 4.34Å; Y69-I72 PolarHBondContact O-N 3.15Å; G70-I72 VanDerWaalsContact C-N 3.34Å; G70-I72 PolarHBondContact O-N 3.01Å; I72-H74 PolarHBondContact O-N 3.43Å; I72-F75 PolarHBondContact O-N 2.72Å; I72-F76 HydrophobicContact CG2-CD2 3.75Å; I72-F76 HydrophobicContact CG2-CE2 3.91Å; I72-F76 WeakPolarHBondContact O-CD2 3.4Å; I72-F76 PolarHBondContact O-N 3.13Å; I72-A95 HydrophobicContact CG2-CB 4.38Å; I72-L98 HydrophobicContact CD1-CD1 4.44Å; I72-H99 HydrophobicContact CG2-CB 4.32Å
73	C	89.4	Confident	86.8	Confident	14 Å²	14	62.2 Å²	62.2	10%	0.095	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-47	178.9	-77.2	0	0	0	0	112.6	Y69 G70 S71 F75 F76 D77 I102	Y69-C73 PolarHBondContact O-N 3.34Å; G70-C73 PolarHBondContact O-N 3.46Å; S71-C73 VanDerWaalsContact C-N 3.35Å; S71-C73 PolarHBondContact O-N 3.18Å; C73-F75 VanDerWaalsContact C-N 3.31Å; C73-F75 PolarHBondContact O-N 3.04Å; C73-F76 PolarHBondContact O-N 3.26Å; C73-D77 WeakPolarHBondContact O-CB 3.38Å; C73-D77 PolarHBondContact O-N 2.98Å; C73-I102 WeakPolarHBondContact SG-CD1 3.47Å; C73-I102 WeakPolarHBondContact SG-CG2 3.49Å
74	H	88.8	Confident	86.3	Confident	129 Å²	129	62 Å²	62	60%	0.597	30%	0.302	S	S	*	.	H	α-helix	trans	-61.9	-39.1	177.7	-75.6	-59.6	0	0	0	112.7	G70 S71 I72 D77 Y78	G70-H74 PolarHBondContact O-CD2 3.45Å; G70-H74 PolarHBondContact O-N 3.27Å; S71-H74 PolarHBondContact O-N 3.44Å; I72-H74 PolarHBondContact O-N 3.43Å; H74-D77 PolarHBondContact O-N 3.07Å; H74-Y78 WeakPolarHBondContact O-CB 3.42Å; H74-Y78 PolarHBondContact O-N 2.96Å; H74-Y78 VanDerWaalsContact O-N 3.1Å
75	F	90.3	Very high	85.6	Confident	20 Å²	20	64.8 Å²	64.8	9%	0.088	33%	0.325	C	S	.	.	H	α-helix	trans	-65	-47.9	178.3	-175.7	-119.2	0	0	0	111.7	Y51 I56 I59 L63 S71 I72 C73 D77 Y78 L79	Y51-F75 AromaticContact CD2-CE2 3.98Å; Y51-F75 HydrophobicContact CD2-CE2 3.98Å; Y51-F75 HydrophobicContact CD2-CZ 4.42Å; Y51-F75 AromaticContact CE2-CE2 3.77Å; Y51-F75 HydrophobicContact CE2-CE2 3.77Å; I56-F75 HydrophobicContact CG1-CZ 4.36Å; I56-F75 HydrophobicContact CG2-CE1 4.15Å; I56-F75 HydrophobicContact CG2-CZ 4.39Å; I59-F75 HydrophobicContact CB-CE1 4.17Å; I59-F75 HydrophobicContact CB-CZ 4.01Å; I59-F75 HydrophobicContact CD1-CE2 3.9Å; I59-F75 HydrophobicContact CD1-CZ 3.81Å; I59-F75 HydrophobicContact CG2-CD1 3.97Å; I59-F75 HydrophobicContact CG2-CD2 4.15Å; I59-F75 HydrophobicContact CG2-CE1 3.72Å; I59-F75 HydrophobicContact CG2-CE2 3.95Å; I59-F75 HydrophobicContact CG2-CG 4.17Å; I59-F75 HydrophobicContact CG2-CZ 3.72Å; L63-F75 HydrophobicContact CD1-CB 4.3Å; S71-F75 VanDerWaalsContact O-CB 3.27Å; S71-F75 WeakPolarHBondContact O-CB 3.24Å; S71-F75 PolarHBondContact O-N 2.88Å; I72-F75 PolarHBondContact O-N 2.72Å; C73-F75 VanDerWaalsContact C-N 3.31Å; C73-F75 PolarHBondContact O-N 3.04Å; F75-D77 PolarHBondContact O-N 3.1Å; F75-Y78 WeakPolarHBondContact O-CB 3.22Å; F75-Y78 PolarHBondContact O-N 3.02Å; F75-Y78 VanDerWaalsContact O-N 3.16Å; F75-L79 HydrophobicContact CD1-CD1 3.95Å; F75-L79 HydrophobicContact CE1-CD1 3.55Å; F75-L79 HydrophobicContact CE1-CG 4.41Å; F75-L79 HydrophobicContact CE2-CD1 4.34Å; F75-L79 HydrophobicContact CE2-CD2 4.36Å; F75-L79 HydrophobicContact CE2-CG 4.37Å; F75-L79 HydrophobicContact CZ-CD1 3.76Å; F75-L79 HydrophobicContact CZ-CD2 4.29Å; F75-L79 HydrophobicContact CZ-CG 4.26Å; F75-L79 WeakPolarHBondContact O-CG 3.13Å; F75-L79 PolarHBondContact O-N 2.96Å
76	F	89	Confident	84.8	Confident	5 Å²	5	60.1 Å²	60.1	2%	0.022	32%	0.32	C	S	.	.	H	α-helix	trans	-70	-28.2	177	-82.1	-80.7	0	0	0	113.7	I72 C73 Y78 Y84 A95 H96 H99	I72-F76 HydrophobicContact CG2-CD2 3.75Å; I72-F76 HydrophobicContact CG2-CE2 3.91Å; I72-F76 WeakPolarHBondContact O-CD2 3.4Å; I72-F76 PolarHBondContact O-N 3.13Å; C73-F76 PolarHBondContact O-N 3.26Å; F76-Y78 VanDerWaalsContact C-N 3.25Å; F76-Y78 PolarHBondContact O-N 3.45Å; F76-Y84 AromaticContact CD1-CD1 3.97Å; F76-Y84 HydrophobicContact CD1-CD1 3.97Å; F76-Y84 HydrophobicContact CD1-CD2 4.43Å; F76-Y84 HydrophobicContact CD1-CE1 4.02Å; F76-Y84 HydrophobicContact CD1-CG 4.16Å; F76-Y84 HydrophobicContact CE1-CD1 4.15Å; F76-Y84 HydrophobicContact CE1-CD2 4.11Å; F76-Y84 AromaticContact CE1-CG 3.89Å; F76-Y84 HydrophobicContact CE1-CG 3.89Å; F76-A95 HydrophobicContact CE2-CB 3.68Å; F76-A95 HydrophobicContact CZ-CB 4.02Å; F76-H96 AromaticContact CD1-ND1 3.79Å; F76-H96 HydrophobicContact CE1-CB 3.7Å; F76-H96 AromaticContact CE1-ND1 3.67Å; F76-H96 HydrophobicContact CZ-CB 3.74Å; F76-H99 HydrophobicContact CB-CB 4.14Å; F76-H99 WeakPolarHBondContact CB-ND1 3.41Å; F76-H99 HydrophobicContact CD2-CB 3.87Å; F76-H99 HydrophobicContact CG-CB 4.02Å; F76-H99 AromaticContact CG-CG 3.95Å
77	D	87.2	Confident	84.1	Confident	84 Å²	84	58.2 Å²	58.2	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-68.7	-26.4	171.7	-74.8	-24.5	0	0	0	112	C73 H74 F75 H99 K103	C73-D77 WeakPolarHBondContact O-CB 3.38Å; C73-D77 PolarHBondContact O-N 2.98Å; H74-D77 PolarHBondContact O-N 3.07Å; F75-D77 PolarHBondContact O-N 3.1Å; D77-H99 IonicContact OD1-CE1 3.63Å; D77-H99 PolarHBondContact OD1-CE1 3.23Å; D77-K103 WeakPolarHBondContact OD1-CE 3.27Å; D77-K103 IonicContact OD1-NZ 3.43Å; D77-K103 PolarHBondContact OD1-NZ 2.68Å; D77-K103 IonicContact OD2-NZ 3.9Å; D77-K103 PolarHBondContact OD2-NZ 3.3Å
78	Y	87	Confident	83.6	Confident	79 Å²	79	61 Å²	61	31%	0.31	32%	0.319	S	S	.	.	H	α-helix	trans	-79.8	-41.9	176.4	179.9	-96.5	0	0	0	112.7	R48 L49 Y51 H74 F75 F76	R48-Y78 VanDerWaalsContact CA-OH 3.23Å; R48-Y78 WeakPolarHBondContact CA-OH 3.21Å; R48-Y78 HydrophobicContact CG-CE2 4.42Å; R48-Y78 PolarHBondContact NH1-O 2.82Å; L49-Y78 PolarHBondContact N-OH 3.33Å; Y51-Y78 HydrophobicContact CE2-CD1 4.27Å; Y51-Y78 AromaticContact CE2-CE1 3.9Å; Y51-Y78 HydrophobicContact CE2-CE1 3.9Å; H74-Y78 WeakPolarHBondContact O-CB 3.42Å; H74-Y78 PolarHBondContact O-N 2.96Å; H74-Y78 VanDerWaalsContact O-N 3.1Å; F75-Y78 WeakPolarHBondContact O-CB 3.22Å; F75-Y78 PolarHBondContact O-N 3.02Å; F75-Y78 VanDerWaalsContact O-N 3.16Å; F76-Y78 VanDerWaalsContact C-N 3.25Å; F76-Y78 PolarHBondContact O-N 3.45Å
79	L	85.9	Confident	83.4	Confident	9 Å²	9	60.8 Å²	60.8	5%	0.047	32%	0.318	C	S	.	.	S	Bend	trans	-67.8	145.4	178.7	-66.1	176.9	0	0	0	111.7	Y51 I56 F75 Y84	Y51-L79 HydrophobicContact CD2-CD2 4.09Å; I56-L79 HydrophobicContact CD1-CD2 4.35Å; I56-L79 HydrophobicContact CG2-CD1 4.22Å; F75-L79 HydrophobicContact CD1-CD1 3.95Å; F75-L79 HydrophobicContact CE1-CD1 3.55Å; F75-L79 HydrophobicContact CE1-CG 4.41Å; F75-L79 HydrophobicContact CE2-CD1 4.34Å; F75-L79 HydrophobicContact CE2-CD2 4.36Å; F75-L79 HydrophobicContact CE2-CG 4.37Å; F75-L79 HydrophobicContact CZ-CD1 3.76Å; F75-L79 HydrophobicContact CZ-CD2 4.29Å; F75-L79 HydrophobicContact CZ-CG 4.26Å; F75-L79 WeakPolarHBondContact O-CG 3.13Å; F75-L79 PolarHBondContact O-N 2.96Å; L79-Y84 HydrophobicContact CB-CD1 3.96Å; L79-Y84 HydrophobicContact CB-CE1 4.27Å; L79-Y84 HydrophobicContact CD1-CD1 4.26Å
80	R	81.7	Confident	83.2	Confident	138 Å²	138	61.3 Å²	61.3	52%	0.521	33%	0.327	S	S	.	.			trans	-80.5	149.1	167.7	-54.7	-174.7	176.5	175.8	1.4	110	R48 E82 E83 Y84	R48-R80 VanDerWaalsContact NH1-CG 3.3Å; R80-E82 WeakPolarHBondContact CB-OE2 3.39Å; R80-E82 PolarHBondContact O-N 3.06Å; R80-E82 VanDerWaalsContact O-N 3.09Å; R80-E83 HydrophobicContact CB-CG 4.3Å; R80-E83 PolarHBondContact N-OE2 3.13Å; R80-E83 WeakPolarHBondContact O-CB 3.49Å; R80-E83 PolarHBondContact O-N 3.46Å; R80-Y84 WeakPolarHBondContact O-CD1 3.45Å; R80-Y84 WeakPolarHBondContact O-CE1 3.3Å
81	P	78.7	Confident	83.1	Confident	67 Å²	67	61.1 Å²	61.1	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-50.9	-35.6	177.4	-28.1	36.7	0	0	0	114.1	E83 Y84 C85	P81-E83 PolarHBondContact O-N 2.92Å; P81-Y84 PolarHBondContact O-N 3.44Å; P81-C85 VanDerWaalsContact O-CB 3.24Å; P81-C85 WeakPolarHBondContact O-CB 3.39Å; P81-C85 PolarHBondContact O-N 3.42Å; P81-C85 PolarHBondContact O-SG 3.43Å
82	E	77.2	Confident	83.1	Confident	133 Å²	133	59 Å²	59	62%	0.621	31%	0.308	S	S	*	.	H	α-helix	trans	-65.6	-25.9	-178.2	-56	75.6	-147.3	0	0	113.2	R80 S86	R80-E82 WeakPolarHBondContact CB-OE2 3.39Å; R80-E82 PolarHBondContact O-N 3.06Å; R80-E82 VanDerWaalsContact O-N 3.09Å; E82-S86 PolarHBondContact O-OG 3.33Å
83	E	75.5	Confident	83	Confident	57 Å²	57	59.9 Å²	59.9	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-78	-22.6	-175.3	-63.5	178.5	111.9	0	0	113	I56 R80 P81 L87	I56-E83 HydrophobicContact CD1-CB 4.32Å; R80-E83 HydrophobicContact CB-CG 4.3Å; R80-E83 PolarHBondContact N-OE2 3.13Å; R80-E83 WeakPolarHBondContact O-CB 3.49Å; R80-E83 PolarHBondContact O-N 3.46Å; P81-E83 PolarHBondContact O-N 2.92Å; E83-L87 WeakPolarHBondContact O-CD1 3.49Å
84	Y	80.2	Confident	82.9	Confident	25 Å²	25	61.1 Å²	61.1	10%	0.098	32%	0.316	C	S	.	.	H	α-helix	trans	-122.9	-22.4	-178.4	63.3	-100.9	0	0	0	114.5	F76 L79 R80 P81 S86 L87 H96	F76-Y84 AromaticContact CD1-CD1 3.97Å; F76-Y84 HydrophobicContact CD1-CD1 3.97Å; F76-Y84 HydrophobicContact CD1-CD2 4.43Å; F76-Y84 HydrophobicContact CD1-CE1 4.02Å; F76-Y84 HydrophobicContact CD1-CG 4.16Å; F76-Y84 HydrophobicContact CE1-CD1 4.15Å; F76-Y84 HydrophobicContact CE1-CD2 4.11Å; F76-Y84 AromaticContact CE1-CG 3.89Å; F76-Y84 HydrophobicContact CE1-CG 3.89Å; L79-Y84 HydrophobicContact CB-CD1 3.96Å; L79-Y84 HydrophobicContact CB-CE1 4.27Å; L79-Y84 HydrophobicContact CD1-CD1 4.26Å; R80-Y84 WeakPolarHBondContact O-CD1 3.45Å; R80-Y84 WeakPolarHBondContact O-CE1 3.3Å; P81-Y84 PolarHBondContact O-N 3.44Å; Y84-S86 PolarHBondContact O-N 2.9Å; Y84-L87 PolarHBondContact O-N 3.45Å; Y84-L87 VanDerWaalsContact O-N 3.13Å; Y84-H96 AromaticContact CD2-CE1 3.93Å; Y84-H96 AromaticContact CD2-ND1 3.69Å; Y84-H96 AromaticContact CE2-CE1 3.13Å; Y84-H96 WeakPolarHBondContact CE2-CE1 3.41Å; Y84-H96 AromaticContact CE2-ND1 3.3Å; Y84-H96 VanDerWaalsContact CE2-ND1 3.3Å; Y84-H96 WeakPolarHBondContact CE2-ND1 3.41Å; Y84-H96 AromaticContact CE2-NE2 3.83Å; Y84-H96 AromaticContact CZ-CE1 3.74Å; Y84-H96 AromaticContact CZ-ND1 3.92Å
85	C	74.9	Confident	83	Confident	87 Å²	87	55 Å²	55	59%	0.588	29%	0.287	S	S	*	.	H	α-helix	trans	-66.6	-22.4	179.3	-70.1	0	0	0	0	112.9	P81	P81-C85 VanDerWaalsContact O-CB 3.24Å; P81-C85 WeakPolarHBondContact O-CB 3.39Å; P81-C85 PolarHBondContact O-N 3.42Å; P81-C85 PolarHBondContact O-SG 3.43Å
86	S	72.3	Confident	83	Confident	87 Å²	87	54.8 Å²	54.8	61%	0.608	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-6.8	177.1	55.6	0	0	0	0	113.5	E82 Y84 D88	E82-S86 PolarHBondContact O-OG 3.33Å; Y84-S86 PolarHBondContact O-N 2.9Å; S86-D88 PolarHBondContact O-N 3.29Å
87	L	75.2	Confident	83.1	Confident	29 Å²	29	54.5 Å²	54.5	15%	0.152	29%	0.285	C	S	.	.			trans	-94.3	98.5	-176.5	-59.3	-179	0	0	0	110	S53 I56 E83 Y84 N89 V92	S53-L87 VanDerWaalsContact CB-CD2 3.44Å; I56-L87 HydrophobicContact CB-CD1 4.02Å; I56-L87 HydrophobicContact CD1-CD1 4.1Å; I56-L87 HydrophobicContact CG2-CD1 3.84Å; E83-L87 WeakPolarHBondContact O-CD1 3.49Å; Y84-L87 PolarHBondContact O-N 3.45Å; Y84-L87 VanDerWaalsContact O-N 3.13Å; L87-N89 PolarHBondContact O-N 3.01Å; L87-V92 HydrophobicContact CB-CB 4.4Å; L87-V92 HydrophobicContact CB-CG1 4.19Å; L87-V92 HydrophobicContact CB-CG2 4.37Å; L87-V92 HydrophobicContact CD1-CG1 4.4Å; L87-V92 HydrophobicContact CD1-CG2 4.21Å
88	D	76.7	Confident	83.3	Confident	141 Å²	141	50.7 Å²	50.7	75%	0.754	27%	0.265	S	S	*	.			trans	-72.8	19.2	172.3	-70.5	-26.6	0	0	0	113.1	S86	S86-D88 PolarHBondContact O-N 3.29Å
89	N	84	Confident	83.4	Confident	63 Å²	63	47.3 Å²	47.3	34%	0.337	25%	0.252	S	S	.	.			trans	-75.3	128	178.3	-171.8	-64.5	0	0	0	109.9	A57 L87 S91 V92 V93	A57-N89 HydrophobicContact CB-CB 4.39Å; L87-N89 PolarHBondContact O-N 3.01Å; N89-S91 PolarHBondContact O-N 3.22Å; N89-S91 WeakPolarHBondContact OD1-CB 3.36Å; N89-S91 PolarHBondContact OD1-N 2.92Å; N89-V92 HydrophobicContact CB-CB 4.37Å; N89-V92 HydrophobicContact CB-CG2 3.99Å; N89-V92 PolarHBondContact O-N 3Å; N89-V93 PolarHBondContact O-N 3.01Å
90	P	84.1	Confident	83.7	Confident	55 Å²	55	47 Å²	47	36%	0.357	25%	0.25	S	S	.	.	H	α-helix	trans	-61.1	-32.2	-174.3	25.7	-36.3	0	0	0	112.7	R94	P90-R94 WeakPolarHBondContact O-CB 3.23Å; P90-R94 WeakPolarHBondContact O-CG 3.03Å; P90-R94 PolarHBondContact O-N 2.94Å
91	S	86.7	Confident	84.1	Confident	15 Å²	15	40.6 Å²	40.6	11%	0.105	23%	0.226	C	C	.	.	H	α-helix	trans	-66.9	-39.8	176.7	-56.1	0	0	0	0	112.1	E61 N89 A95	E61-S91 VanDerWaalsContact OE2-CB 3.22Å; E61-S91 WeakPolarHBondContact OE2-CB 3.47Å; E61-S91 PolarHBondContact OE2-OG 3.47Å; N89-S91 PolarHBondContact O-N 3.22Å; N89-S91 WeakPolarHBondContact OD1-CB 3.36Å; N89-S91 PolarHBondContact OD1-N 2.92Å; S91-A95 WeakPolarHBondContact O-CB 3.47Å; S91-A95 PolarHBondContact O-N 3.04Å; S91-A95 VanDerWaalsContact O-N 3.1Å
92	V	90	Very high	84.6	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-46.7	176.5	-179.5	0	0	0	0	110	I56 A57 C60 L87 N89 R94 A95 H96	I56-V92 HydrophobicContact CG2-CG1 4.46Å; I56-V92 HydrophobicContact CG2-CG2 4.14Å; A57-V92 HydrophobicContact CB-CG2 3.98Å; C60-V92 HydrophobicContact CB-CG2 4.44Å; L87-V92 HydrophobicContact CB-CB 4.4Å; L87-V92 HydrophobicContact CB-CG1 4.19Å; L87-V92 HydrophobicContact CB-CG2 4.37Å; L87-V92 HydrophobicContact CD1-CG1 4.4Å; L87-V92 HydrophobicContact CD1-CG2 4.21Å; N89-V92 HydrophobicContact CB-CB 4.37Å; N89-V92 HydrophobicContact CB-CG2 3.99Å; N89-V92 PolarHBondContact O-N 3Å; V92-R94 PolarHBondContact O-N 3.32Å; V92-A95 PolarHBondContact O-N 3.35Å; V92-H96 WeakPolarHBondContact O-CB 3.31Å; V92-H96 PolarHBondContact O-N 2.76Å
93	V	88.6	Confident	85.1	Confident	18 Å²	18	37.1 Å²	37.1	11%	0.109	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-43.5	179.9	-179.8	0	0	0	0	111.4	N89 H96 L97 I112 F118	N89-V93 PolarHBondContact O-N 3.01Å; V93-H96 PolarHBondContact O-N 2.85Å; V93-L97 HydrophobicContact CG1-CD1 3.88Å; V93-L97 HydrophobicContact CG1-CG 4.21Å; V93-L97 WeakPolarHBondContact O-CB 3.45Å; V93-L97 VanDerWaalsContact O-CG 3.23Å; V93-L97 WeakPolarHBondContact O-CG 3.49Å; V93-L97 PolarHBondContact O-N 3.33Å; V93-I112 HydrophobicContact CG1-CG2 4.21Å; V93-F118 HydrophobicContact CG1-CE1 3.68Å; V93-F118 HydrophobicContact CG1-CZ 4.11Å
94	R	88.1	Confident	85.7	Confident	40 Å²	40	35.4 Å²	35.4	15%	0.151	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-50.8	174.6	-76.6	176.6	-177.1	115.7	-6.6	112.3	Y64 P90 V92 H96 L97 L98 C122 E125	Y64-R94 HydrophobicContact CD2-CB 4.15Å; Y64-R94 HydrophobicContact CE2-CB 3.82Å; P90-R94 WeakPolarHBondContact O-CB 3.23Å; P90-R94 WeakPolarHBondContact O-CG 3.03Å; P90-R94 PolarHBondContact O-N 2.94Å; V92-R94 PolarHBondContact O-N 3.32Å; R94-H96 VanDerWaalsContact C-N 3.29Å; R94-H96 PolarHBondContact O-N 2.97Å; R94-L97 PolarHBondContact O-N 2.92Å; R94-L98 PolarHBondContact O-N 3Å; R94-C122 PolarHBondContact NH2-SG 3.4Å; R94-E125 WeakPolarHBondContact CD-OE2 3.41Å; R94-E125 IonicContact CZ-OE2 2.72Å; R94-E125 IonicContact NE-OE2 3.75Å; R94-E125 PolarHBondContact NE-OE2 3.48Å; R94-E125 IonicContact NH2-OE2 3Å
95	A	90.4	Very high	86.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.6	-35.8	-179.2	0	0	0	0	0	111.6	C60 I72 F76 S91 V92 L98 H99	C60-A95 HydrophobicContact CB-CB 3.79Å; I72-A95 HydrophobicContact CG2-CB 4.38Å; F76-A95 HydrophobicContact CE2-CB 3.68Å; F76-A95 HydrophobicContact CZ-CB 4.02Å; S91-A95 WeakPolarHBondContact O-CB 3.47Å; S91-A95 PolarHBondContact O-N 3.04Å; S91-A95 VanDerWaalsContact O-N 3.1Å; V92-A95 PolarHBondContact O-N 3.35Å; A95-L98 PolarHBondContact O-N 3.4Å; A95-H99 PolarHBondContact O-N 3.27Å
96	H	90.8	Very high	86.9	Confident	16 Å²	16	36.7 Å²	36.7	7%	0.074	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-45.2	175.2	-177	61	0	0	0	112	F76 Y84 V92 V93 R94 L98 H99 L100	F76-H96 AromaticContact CD1-ND1 3.79Å; F76-H96 HydrophobicContact CE1-CB 3.7Å; F76-H96 AromaticContact CE1-ND1 3.67Å; F76-H96 HydrophobicContact CZ-CB 3.74Å; Y84-H96 AromaticContact CD2-CE1 3.93Å; Y84-H96 AromaticContact CD2-ND1 3.69Å; Y84-H96 AromaticContact CE2-CE1 3.13Å; Y84-H96 WeakPolarHBondContact CE2-CE1 3.41Å; Y84-H96 AromaticContact CE2-ND1 3.3Å; Y84-H96 VanDerWaalsContact CE2-ND1 3.3Å; Y84-H96 WeakPolarHBondContact CE2-ND1 3.41Å; Y84-H96 AromaticContact CE2-NE2 3.83Å; Y84-H96 AromaticContact CZ-CE1 3.74Å; Y84-H96 AromaticContact CZ-ND1 3.92Å; V92-H96 WeakPolarHBondContact O-CB 3.31Å; V92-H96 PolarHBondContact O-N 2.76Å; V93-H96 PolarHBondContact O-N 2.85Å; R94-H96 VanDerWaalsContact C-N 3.29Å; R94-H96 PolarHBondContact O-N 2.97Å; H96-L98 VanDerWaalsContact C-N 3.3Å; H96-L98 PolarHBondContact O-N 3.29Å; H96-H99 WeakPolarHBondContact O-CB 3.38Å; H96-H99 PolarHBondContact O-N 3.2Å; H96-H99 VanDerWaalsContact O-N 3.13Å; H96-L100 WeakPolarHBondContact NE2-CD1 3.25Å; H96-L100 WeakPolarHBondContact O-CG 3.47Å; H96-L100 PolarHBondContact O-N 3.42Å
97	L	90.9	Very high	87.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-40.3	175.2	-73.7	168.9	0	0	0	111.8	V93 R94 L100 L101 I109 I112 L113 L126 I129	V93-L97 HydrophobicContact CG1-CD1 3.88Å; V93-L97 HydrophobicContact CG1-CG 4.21Å; V93-L97 WeakPolarHBondContact O-CB 3.45Å; V93-L97 VanDerWaalsContact O-CG 3.23Å; V93-L97 WeakPolarHBondContact O-CG 3.49Å; V93-L97 PolarHBondContact O-N 3.33Å; R94-L97 PolarHBondContact O-N 2.92Å; L97-L100 PolarHBondContact O-N 2.9Å; L97-L101 WeakPolarHBondContact O-CB 3.43Å; L97-L101 PolarHBondContact O-N 3.46Å; L97-I109 HydrophobicContact CD2-CB 4.48Å; L97-I109 HydrophobicContact CD2-CG2 4.1Å; L97-I112 HydrophobicContact CD2-CB 4.18Å; L97-I112 HydrophobicContact CD2-CD1 4.49Å; L97-I112 HydrophobicContact CD2-CG2 3.94Å; L97-L113 HydrophobicContact CD1-CD2 3.75Å; L97-L113 HydrophobicContact CD2-CD2 4.2Å; L97-L113 HydrophobicContact CD2-CG 4.14Å; L97-L126 HydrophobicContact CD1-CD2 3.36Å; L97-I129 HydrophobicContact CB-CD1 3.96Å; L97-I129 HydrophobicContact CB-CG2 4.31Å; L97-I129 HydrophobicContact CD1-CD1 4.38Å
98	L	90.3	Very high	88.6	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-43.5	172.7	-73.3	-176.8	0	0	0	112.3	Y8 Y64 Y69 I72 R94 A95 H96 L100 L101 I102 I129	Y8-L98 HydrophobicContact CE1-CD2 4.43Å; Y64-L98 HydrophobicContact CD2-CD1 3.53Å; Y64-L98 HydrophobicContact CE2-CD1 3.32Å; Y64-L98 HydrophobicContact CE2-CG 4.11Å; Y69-L98 HydrophobicContact CD1-CD1 4.15Å; Y69-L98 HydrophobicContact CE1-CD1 3.96Å; I72-L98 HydrophobicContact CD1-CD1 4.44Å; R94-L98 PolarHBondContact O-N 3Å; A95-L98 PolarHBondContact O-N 3.4Å; H96-L98 VanDerWaalsContact C-N 3.3Å; H96-L98 PolarHBondContact O-N 3.29Å; L98-L100 VanDerWaalsContact C-N 3.34Å; L98-L100 PolarHBondContact O-N 3.07Å; L98-L101 WeakPolarHBondContact O-CB 3.42Å; L98-L101 PolarHBondContact O-N 2.98Å; L98-I102 WeakPolarHBondContact O-CD1 3.11Å; L98-I102 WeakPolarHBondContact O-CG1 3.2Å; L98-I102 PolarHBondContact O-N 2.95Å; L98-I129 HydrophobicContact CD2-CD1 4.32Å; L98-I129 HydrophobicContact CD2-CG1 4.46Å
99	H	90	Very high	89.2	Confident	8 Å²	8	35.5 Å²	35.5	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-57.4	-47.5	175.1	166.4	85	0	0	0	111.3	I72 F76 D77 A95 H96 L101 I102 K103	I72-H99 HydrophobicContact CG2-CB 4.32Å; F76-H99 HydrophobicContact CB-CB 4.14Å; F76-H99 WeakPolarHBondContact CB-ND1 3.41Å; F76-H99 HydrophobicContact CD2-CB 3.87Å; F76-H99 HydrophobicContact CG-CB 4.02Å; F76-H99 AromaticContact CG-CG 3.95Å; D77-H99 IonicContact OD1-CE1 3.63Å; D77-H99 PolarHBondContact OD1-CE1 3.23Å; A95-H99 PolarHBondContact O-N 3.27Å; H96-H99 WeakPolarHBondContact O-CB 3.38Å; H96-H99 PolarHBondContact O-N 3.2Å; H96-H99 VanDerWaalsContact O-N 3.13Å; H99-L101 VanDerWaalsContact C-N 3.3Å; H99-L101 PolarHBondContact O-N 3.38Å; H99-I102 PolarHBondContact O-N 3.41Å; H99-K103 VanDerWaalsContact CE1-CE 3.49Å; H99-K103 WeakPolarHBondContact CE1-CE 3.4Å; H99-K103 WeakPolarHBondContact O-CG 3.4Å; H99-K103 PolarHBondContact O-N 2.92Å
100	L	90.5	Very high	89.6	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-38.5	177	-68.1	177.1	0	0	0	112.2	H96 L97 L98 K103 G104 R105 E108 I109 I112	H96-L100 WeakPolarHBondContact NE2-CD1 3.25Å; H96-L100 WeakPolarHBondContact O-CG 3.47Å; H96-L100 PolarHBondContact O-N 3.42Å; L97-L100 PolarHBondContact O-N 2.9Å; L98-L100 VanDerWaalsContact C-N 3.34Å; L98-L100 PolarHBondContact O-N 3.07Å; L100-K103 PolarHBondContact O-N 3.48Å; L100-G104 PolarHBondContact O-N 2.98Å; L100-R105 HydrophobicContact CB-CB 4.47Å; L100-R105 HydrophobicContact CD2-CB 3.96Å; L100-R105 PolarHBondContact O-N 3.33Å; L100-E108 HydrophobicContact CD1-CB 3.82Å; L100-E108 HydrophobicContact CD2-CB 4.2Å; L100-E108 VanDerWaalsContact CD2-OE2 3.25Å; L100-E108 WeakPolarHBondContact CD2-OE2 3.33Å; L100-I109 HydrophobicContact CB-CD1 4.01Å; L100-I109 HydrophobicContact CB-CG1 3.59Å; L100-I109 HydrophobicContact CD1-CG1 4.06Å; L100-I112 HydrophobicContact CD1-CD1 3.56Å
101	L	91.1	Very high	89.9	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-43.9	177.4	-172	68.7	0	0	0	111.1	L97 L98 H99 G104 F106 I109 Q132 A133 M136	L97-L101 WeakPolarHBondContact O-CB 3.43Å; L97-L101 PolarHBondContact O-N 3.46Å; L98-L101 WeakPolarHBondContact O-CB 3.42Å; L98-L101 PolarHBondContact O-N 2.98Å; H99-L101 VanDerWaalsContact C-N 3.3Å; H99-L101 PolarHBondContact O-N 3.38Å; L101-G104 PolarHBondContact O-N 2.97Å; L101-F106 HydrophobicContact CD1-CE1 4.37Å; L101-I109 HydrophobicContact CB-CD1 4.01Å; L101-I109 HydrophobicContact CD1-CD1 4.04Å; L101-Q132 HydrophobicContact CD1-CB 4.28Å; L101-Q132 HydrophobicContact CD2-CB 4.07Å; L101-A133 HydrophobicContact CD1-CB 3.94Å; L101-M136 HydrophobicContact CD1-SD 3.67Å; L101-M136 HydrophobicContact CD2-SD 4.35Å; L101-M136 HydrophobicContact CG-SD 3.77Å
102	I	89	Confident	89.9	Confident	40 Å²	40	39.4 Å²	39.4	21%	0.205	17%	0.173	C	C	.	.	H	α-helix	trans	-67.8	-39.2	177.9	-65.5	160.4	0	0	0	111.5	L14 C73 L98 H99 G104	L14-I102 HydrophobicContact CD2-CG2 3.88Å; C73-I102 WeakPolarHBondContact SG-CD1 3.47Å; C73-I102 WeakPolarHBondContact SG-CG2 3.49Å; L98-I102 WeakPolarHBondContact O-CD1 3.11Å; L98-I102 WeakPolarHBondContact O-CG1 3.2Å; L98-I102 PolarHBondContact O-N 2.95Å; H99-I102 PolarHBondContact O-N 3.41Å; I102-G104 PolarHBondContact O-N 2.93Å
103	K	87.4	Confident	89.7	Confident	88 Å²	88	39.3 Å²	39.3	38%	0.383	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-6.4	175.8	-66.7	-68	-175.3	175.4	0	113.7	D77 H99 L100 R105	D77-K103 WeakPolarHBondContact OD1-CE 3.27Å; D77-K103 IonicContact OD1-NZ 3.43Å; D77-K103 PolarHBondContact OD1-NZ 2.68Å; D77-K103 IonicContact OD2-NZ 3.9Å; D77-K103 PolarHBondContact OD2-NZ 3.3Å; H99-K103 VanDerWaalsContact CE1-CE 3.49Å; H99-K103 WeakPolarHBondContact CE1-CE 3.4Å; H99-K103 WeakPolarHBondContact O-CG 3.4Å; H99-K103 PolarHBondContact O-N 2.92Å; L100-K103 PolarHBondContact O-N 3.48Å; K103-R105 VanDerWaalsContact C-N 3.32Å; K103-R105 HydrophobicContact CB-CG 4.13Å; K103-R105 PolarHBondContact O-N 3.32Å
104	G	89.1	Confident	89.5	Confident	20 Å²	20	41.4 Å²	41.4	21%	0.206	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	23.6	-177.7	0	0	0	0	0	114.2	L100 L101 I102 F106	L100-G104 PolarHBondContact O-N 2.98Å; L101-G104 PolarHBondContact O-N 2.97Å; I102-G104 PolarHBondContact O-N 2.93Å; G104-F106 VanDerWaalsContact C-N 3.33Å; G104-F106 WeakPolarHBondContact O-CD2 2.97Å; G104-F106 WeakPolarHBondContact O-CE2 3.31Å; G104-F106 PolarHBondContact O-N 2.89Å
105	R	90.2	Very high	89.2	Confident	128 Å²	128	43.1 Å²	43.1	48%	0.483	21%	0.206	S	C	.	.			trans	-90.1	62.8	-178.9	-64.9	-168.9	-175.4	-177.1	5.7	111.8	L100 K103 K107 E108 I109	L100-R105 HydrophobicContact CB-CB 4.47Å; L100-R105 HydrophobicContact CD2-CB 3.96Å; L100-R105 PolarHBondContact O-N 3.33Å; K103-R105 VanDerWaalsContact C-N 3.32Å; K103-R105 HydrophobicContact CB-CG 4.13Å; K103-R105 PolarHBondContact O-N 3.32Å; R105-K107 VanDerWaalsContact C-N 3.34Å; R105-K107 PolarHBondContact O-N 3.27Å; R105-E108 WeakPolarHBondContact CD-OE1 3.37Å; R105-E108 IonicContact NH1-OE1 3.35Å; R105-E108 PolarHBondContact O-N 3.46Å; R105-I109 PolarHBondContact O-N 3.25Å
106	F	90.6	Very high	88.6	Confident	11 Å²	11	45.7 Å²	45.7	5%	0.048	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-35.2	-171.3	-46.4	-63.2	0	0	0	114.1	L101 G104 E108 I109 Y110 A133 M136 E137 Q140	L101-F106 HydrophobicContact CD1-CE1 4.37Å; G104-F106 VanDerWaalsContact C-N 3.33Å; G104-F106 WeakPolarHBondContact O-CD2 2.97Å; G104-F106 WeakPolarHBondContact O-CE2 3.31Å; G104-F106 PolarHBondContact O-N 2.89Å; F106-E108 VanDerWaalsContact C-N 3.27Å; F106-E108 PolarHBondContact O-N 3.11Å; F106-I109 HydrophobicContact CD1-CD1 4.4Å; F106-I109 WeakPolarHBondContact O-CB 3.41Å; F106-I109 PolarHBondContact O-N 3.34Å; F106-I109 VanDerWaalsContact O-N 3.16Å; F106-Y110 HydrophobicContact CB-CE2 3.87Å; F106-Y110 WeakPolarHBondContact O-CD2 3.02Å; F106-Y110 VanDerWaalsContact O-CG 3.26Å; F106-Y110 PolarHBondContact O-N 3.28Å; F106-A133 HydrophobicContact CD1-CB 4.03Å; F106-M136 HydrophobicContact CE1-CB 3.67Å; F106-M136 HydrophobicContact CZ-CB 3.74Å; F106-E137 HydrophobicContact CD2-CB 3.58Å; F106-E137 HydrophobicContact CD2-CG 3.78Å; F106-E137 HydrophobicContact CE2-CB 3.82Å; F106-E137 HydrophobicContact CE2-CG 4.26Å; F106-E137 HydrophobicContact CG-CB 3.96Å; F106-E137 HydrophobicContact CG-CG 4.39Å; F106-E137 HydrophobicContact CZ-CB 4.39Å; F106-Q140 VanDerWaalsContact CE2-OE1 3.31Å
107	K	91.3	Very high	87.9	Confident	172 Å²	172	52 Å²	52	75%	0.748	25%	0.254	S	S	*	.	H	α-helix	trans	-59.5	-37.6	178.6	-66.2	-176.7	-179.1	178.4	0	112.9	R105 R111	R105-K107 VanDerWaalsContact C-N 3.34Å; R105-K107 PolarHBondContact O-N 3.27Å; K107-R111 PolarHBondContact O-N 3.11Å; K107-R111 VanDerWaalsContact O-N 3.16Å
108	E	90.4	Very high	87.3	Confident	60 Å²	60	53.6 Å²	53.6	28%	0.28	26%	0.261	S	S	.	.	H	α-helix	trans	-70.7	-39.5	178.6	-68.2	179.9	-146.8	0	0	110.9	L100 R105 F106 Y110 R111 I112	L100-E108 HydrophobicContact CD1-CB 3.82Å; L100-E108 HydrophobicContact CD2-CB 4.2Å; L100-E108 VanDerWaalsContact CD2-OE2 3.25Å; L100-E108 WeakPolarHBondContact CD2-OE2 3.33Å; R105-E108 WeakPolarHBondContact CD-OE1 3.37Å; R105-E108 IonicContact NH1-OE1 3.35Å; R105-E108 PolarHBondContact O-N 3.46Å; F106-E108 VanDerWaalsContact C-N 3.27Å; F106-E108 PolarHBondContact O-N 3.11Å; E108-Y110 PolarHBondContact O-N 3.13Å; E108-R111 PolarHBondContact O-N 3.11Å; E108-I112 VanDerWaalsContact O-CG1 3.31Å; E108-I112 WeakPolarHBondContact O-CG1 3.31Å; E108-I112 PolarHBondContact O-N 2.85Å
109	I	90.6	Very high	86.5	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-56.7	-50.9	173.9	-61	173.6	0	0	0	110.1	L97 L100 L101 R105 F106 R111 I112 L113 I129 A133	L97-I109 HydrophobicContact CD2-CB 4.48Å; L97-I109 HydrophobicContact CD2-CG2 4.1Å; L100-I109 HydrophobicContact CB-CD1 4.01Å; L100-I109 HydrophobicContact CB-CG1 3.59Å; L100-I109 HydrophobicContact CD1-CG1 4.06Å; L101-I109 HydrophobicContact CB-CD1 4.01Å; L101-I109 HydrophobicContact CD1-CD1 4.04Å; R105-I109 PolarHBondContact O-N 3.25Å; F106-I109 HydrophobicContact CD1-CD1 4.4Å; F106-I109 WeakPolarHBondContact O-CB 3.41Å; F106-I109 PolarHBondContact O-N 3.34Å; F106-I109 VanDerWaalsContact O-N 3.16Å; I109-R111 VanDerWaalsContact C-N 3.28Å; I109-R111 PolarHBondContact O-N 3.35Å; I109-I112 PolarHBondContact O-N 3.38Å; I109-L113 HydrophobicContact CG2-CD1 3.64Å; I109-L113 HydrophobicContact CG2-CG 4.25Å; I109-L113 WeakPolarHBondContact O-CB 3.47Å; I109-L113 VanDerWaalsContact O-CG 3.31Å; I109-L113 WeakPolarHBondContact O-CG 3.36Å; I109-L113 PolarHBondContact O-N 3.3Å; I109-I129 HydrophobicContact CG2-CG2 4.06Å; I109-A133 HydrophobicContact CD1-CB 4.09Å; I109-A133 HydrophobicContact CG2-CB 4.21Å
110	Y	91.2	Very high	85.9	Confident	35 Å²	35	62.2 Å²	62.2	14%	0.137	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-38.7	-179.4	-53.6	-35	0	0	0	112.1	F106 E108 S114 W130 A133 H134 E137	F106-Y110 HydrophobicContact CB-CE2 3.87Å; F106-Y110 WeakPolarHBondContact O-CD2 3.02Å; F106-Y110 VanDerWaalsContact O-CG 3.26Å; F106-Y110 PolarHBondContact O-N 3.28Å; E108-Y110 PolarHBondContact O-N 3.13Å; Y110-S114 VanDerWaalsContact O-CB 3.26Å; Y110-S114 WeakPolarHBondContact O-CB 3.34Å; Y110-S114 PolarHBondContact O-N 2.94Å; Y110-S114 VanDerWaalsContact O-N 3.08Å; Y110-S114 PolarHBondContact O-OG 3.47Å; Y110-W130 AromaticContact CD1-CE3 3.97Å; Y110-W130 HydrophobicContact CD1-CE3 3.97Å; Y110-W130 HydrophobicContact CD1-CH2 4.2Å; Y110-W130 AromaticContact CD1-CZ3 3.69Å; Y110-W130 HydrophobicContact CD1-CZ3 3.69Å; Y110-W130 HydrophobicContact CG-CZ3 4.3Å; Y110-A133 HydrophobicContact CE1-CB 3.79Å; Y110-H134 AromaticContact CE1-CD2 3.92Å; Y110-H134 AromaticContact CE1-CE1 3.6Å; Y110-H134 AromaticContact CE1-NE2 3.57Å; Y110-H134 AromaticContact CE2-CE1 3.95Å; Y110-H134 AromaticContact CZ-CE1 3.36Å; Y110-H134 AromaticContact CZ-ND1 3.58Å; Y110-H134 AromaticContact CZ-NE2 3.85Å; Y110-H134 PolarHBondContact OH-CE1 3.21Å; Y110-H134 PolarHBondContact OH-ND1 2.93Å; Y110-E137 WeakPolarHBondContact CE2-OE2 3.28Å; Y110-E137 PolarHBondContact OH-OE2 3.46Å
111	R	90	Very high	85.3	Confident	162 Å²	162	68.9 Å²	68.9	61%	0.611	35%	0.349	S	S	*	.	H	α-helix	trans	-63.7	-51.5	176.5	-175.1	-176.3	64.9	169.7	-0.6	111.3	K107 E108 I109 S114 S115	K107-R111 PolarHBondContact O-N 3.11Å; K107-R111 VanDerWaalsContact O-N 3.16Å; E108-R111 PolarHBondContact O-N 3.11Å; I109-R111 VanDerWaalsContact C-N 3.28Å; I109-R111 PolarHBondContact O-N 3.35Å; R111-S114 PolarHBondContact O-N 3.19Å; R111-S115 WeakPolarHBondContact O-CB 3.13Å; R111-S115 PolarHBondContact O-N 3.22Å; R111-S115 PolarHBondContact O-OG 3.04Å; R111-S115 VanDerWaalsContact O-OG 3.13Å
112	I	87.3	Confident	84.8	Confident	18 Å²	18	69.1 Å²	69.1	9%	0.092	35%	0.351	C	S	.	.	H	α-helix	trans	-62	-45.8	-178.1	-67.5	166.6	0	0	0	110.8	V93 L97 L100 E108 I109 S114 S115 N116 F118	V93-I112 HydrophobicContact CG1-CG2 4.21Å; L97-I112 HydrophobicContact CD2-CB 4.18Å; L97-I112 HydrophobicContact CD2-CD1 4.49Å; L97-I112 HydrophobicContact CD2-CG2 3.94Å; L100-I112 HydrophobicContact CD1-CD1 3.56Å; E108-I112 VanDerWaalsContact O-CG1 3.31Å; E108-I112 WeakPolarHBondContact O-CG1 3.31Å; E108-I112 PolarHBondContact O-N 2.85Å; I109-I112 PolarHBondContact O-N 3.38Å; I112-S114 PolarHBondContact O-N 3Å; I112-S115 PolarHBondContact O-N 3.48Å; I112-S115 PolarHBondContact O-OG 2.93Å; I112-N116 PolarHBondContact O-N 3.34Å; I112-F118 HydrophobicContact CG2-CZ 4.48Å
113	L	86.3	Confident	84.5	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-28.9	179.4	-68.7	177.9	0	0	0	112.4	L97 I109 F118 L126 W130 P161 T163 I164	L97-L113 HydrophobicContact CD1-CD2 3.75Å; L97-L113 HydrophobicContact CD2-CD2 4.2Å; L97-L113 HydrophobicContact CD2-CG 4.14Å; I109-L113 HydrophobicContact CG2-CD1 3.64Å; I109-L113 HydrophobicContact CG2-CG 4.25Å; I109-L113 WeakPolarHBondContact O-CB 3.47Å; I109-L113 VanDerWaalsContact O-CG 3.31Å; I109-L113 WeakPolarHBondContact O-CG 3.36Å; I109-L113 PolarHBondContact O-N 3.3Å; L113-F118 HydrophobicContact CD2-CE2 4.25Å; L113-F118 HydrophobicContact CD2-CZ 4.32Å; L113-L126 HydrophobicContact CD2-CB 4.09Å; L113-L126 HydrophobicContact CD2-CD2 3.82Å; L113-L126 HydrophobicContact CD2-CG 4.36Å; L113-W130 HydrophobicContact CB-CE3 4.34Å; L113-W130 HydrophobicContact CD1-CB 4.11Å; L113-W130 HydrophobicContact CD1-CE3 3.8Å; L113-P161 HydrophobicContact CB-CG 4.44Å; L113-T163 WeakPolarHBondContact O-CB 3.24Å; L113-T163 PolarHBondContact O-OG1 3.05Å; L113-I164 HydrophobicContact CD1-CD1 4.44Å; L113-I164 HydrophobicContact CD2-CG2 4.21Å
114	S	83.2	Confident	84.3	Confident	63 Å²	63	67.6 Å²	67.6	44%	0.441	35%	0.353	S	S	.	.	H	α-helix	trans	-88.9	-20.1	178.9	-53.1	0	0	0	0	113.9	Y110 R111 I112	Y110-S114 VanDerWaalsContact O-CB 3.26Å; Y110-S114 WeakPolarHBondContact O-CB 3.34Å; Y110-S114 PolarHBondContact O-N 2.94Å; Y110-S114 VanDerWaalsContact O-N 3.08Å; Y110-S114 PolarHBondContact O-OG 3.47Å; R111-S114 PolarHBondContact O-N 3.19Å; I112-S114 PolarHBondContact O-N 3Å
115	S	82.7	Confident	84.1	Confident	76 Å²	76	69.3 Å²	69.3	53%	0.531	36%	0.356	S	S	.	.	H	α-helix	trans	-92.8	-31.9	-175.5	64.1	0	0	0	0	113.9	R111 I112	R111-S115 WeakPolarHBondContact O-CB 3.13Å; R111-S115 PolarHBondContact O-N 3.22Å; R111-S115 PolarHBondContact O-OG 3.04Å; R111-S115 VanDerWaalsContact O-OG 3.13Å; I112-S115 PolarHBondContact O-N 3.48Å; I112-S115 PolarHBondContact O-OG 2.93Å
116	N	77.6	Confident	83.9	Confident	53 Å²	53	63.3 Å²	63.3	28%	0.283	33%	0.333	S	S	.	.	S	Bend	trans	-100.8	145.2	-171.1	-64.1	-8.2	0	0	0	111	I112 F118 T163	I112-N116 PolarHBondContact O-N 3.34Å; N116-F118 HydrophobicContact CB-CD2 4.46Å; N116-F118 HydrophobicContact CB-CE1 4.31Å; N116-F118 HydrophobicContact CB-CE2 3.72Å; N116-F118 HydrophobicContact CB-CZ 3.64Å; N116-F118 VanDerWaalsContact O-CD2 3.28Å; N116-F118 WeakPolarHBondContact O-CD2 3.31Å; N116-F118 VanDerWaalsContact O-CE2 3.31Å; N116-F118 WeakPolarHBondContact O-CE2 3.39Å; N116-T163 WeakPolarHBondContact O-CB 3.28Å; N116-T163 WeakPolarHBondContact O-CG2 3.27Å
117	N	75.7	Confident	83.8	Confident	149 Å²	149	65.1 Å²	65.1	80%	0.797	34%	0.342	S	S	*	.			trans	-87.5	133.3	169.3	-70.1	-42.7	0	0	0	109
118	F	78	Confident	83.6	Confident	33 Å²	33	60.3 Å²	60.3	15%	0.145	32%	0.322	C	S	.	.			trans	-120.7	146.2	-178.2	-62.4	-83.1	0	0	0	110.7	V93 I112 L113 N116 H123 L126 I164	V93-F118 HydrophobicContact CG1-CE1 3.68Å; V93-F118 HydrophobicContact CG1-CZ 4.11Å; I112-F118 HydrophobicContact CG2-CZ 4.48Å; L113-F118 HydrophobicContact CD2-CE2 4.25Å; L113-F118 HydrophobicContact CD2-CZ 4.32Å; N116-F118 HydrophobicContact CB-CD2 4.46Å; N116-F118 HydrophobicContact CB-CE1 4.31Å; N116-F118 HydrophobicContact CB-CE2 3.72Å; N116-F118 HydrophobicContact CB-CZ 3.64Å; N116-F118 VanDerWaalsContact O-CD2 3.28Å; N116-F118 WeakPolarHBondContact O-CD2 3.31Å; N116-F118 VanDerWaalsContact O-CE2 3.31Å; N116-F118 WeakPolarHBondContact O-CE2 3.39Å; F118-H123 PolarHBondContact O-NE2 3.24Å; F118-L126 HydrophobicContact CB-CD1 3.58Å; F118-L126 HydrophobicContact CD1-CD1 3.44Å; F118-L126 VanDerWaalsContact CD1-CD1 3.44Å; F118-L126 HydrophobicContact CD2-CD1 3.72Å; F118-L126 HydrophobicContact CE1-CD1 3.96Å; F118-L126 HydrophobicContact CE2-CD1 4.21Å; F118-L126 HydrophobicContact CG-CD1 3.28Å; F118-L126 HydrophobicContact CZ-CD1 4.31Å; F118-I164 HydrophobicContact CD2-CG2 3.54Å; F118-I164 HydrophobicContact CE2-CG2 3.99Å; F118-I164 HydrophobicContact CG-CG2 4.34Å
119	D	75.2	Confident	83.6	Confident	117 Å²	117	57.8 Å²	57.8	63%	0.626	31%	0.31	S	S	*	.			trans	-64.9	145.9	172.2	-66.3	-36.7	0	0	0	111.1	D121 C122 H123	D119-D121 PolarHBondContact O-N 3.16Å; D119-D121 VanDerWaalsContact O-N 3.11Å; D119-C122 WeakPolarHBondContact O-CB 3.49Å; D119-C122 PolarHBondContact O-N 3.14Å; D119-H123 PolarHBondContact O-CD2 2.86Å
120	S	76.9	Confident	83.6	Confident	77 Å²	77	58.8 Å²	58.8	54%	0.538	31%	0.314	S	S	.	.	H	α-helix	trans	-55.5	-31.8	-177.2	-168.2	0	0	0	0	113	C122 H123	S120-C122 PolarHBondContact O-N 2.89Å; S120-H123 WeakPolarHBondContact O-CB 3.44Å; S120-H123 PolarHBondContact O-N 3.16Å; S120-H123 VanDerWaalsContact O-N 3.11Å
121	D	77.3	Confident	83.6	Confident	141 Å²	141	59.3 Å²	59.3	75%	0.754	32%	0.316	S	S	*	.	H	α-helix	trans	-60.8	-30.3	177.2	-65	-27.4	0	0	0	112.6	D119	D119-D121 PolarHBondContact O-N 3.16Å; D119-D121 VanDerWaalsContact O-N 3.11Å
122	C	80.5	Confident	83.6	Confident	8 Å²	8	53.4 Å²	53.4	5%	0.054	30%	0.295	C	S	.	.	H	α-helix	trans	-86.7	-17.5	-180	-50.9	0	0	0	0	112.7	R94 D119 S120 S124 E125 L126	R94-C122 PolarHBondContact NH2-SG 3.4Å; D119-C122 WeakPolarHBondContact O-CB 3.49Å; D119-C122 PolarHBondContact O-N 3.14Å; S120-C122 PolarHBondContact O-N 2.89Å; C122-S124 VanDerWaalsContact C-N 3.27Å; C122-S124 PolarHBondContact O-N 3.41Å; C122-E125 PolarHBondContact O-N 3.29Å; C122-L126 HydrophobicContact CB-CD1 3.89Å; C122-L126 HydrophobicContact CB-CG 4.29Å; C122-L126 VanDerWaalsContact O-CG 3.27Å; C122-L126 WeakPolarHBondContact O-CG 3.47Å; C122-L126 PolarHBondContact O-N 3.35Å
123	H	82.5	Confident	83.8	Confident	15 Å²	15	52.5 Å²	52.5	7%	0.069	29%	0.291	C	S	.	.	H	α-helix	trans	-58.1	-39.3	-170.7	-72.8	-172.7	0	0	0	112.5	F118 D119 S120 E125 L126 Q127 I164 D166	F118-H123 PolarHBondContact O-NE2 3.24Å; D119-H123 PolarHBondContact O-CD2 2.86Å; S120-H123 WeakPolarHBondContact O-CB 3.44Å; S120-H123 PolarHBondContact O-N 3.16Å; S120-H123 VanDerWaalsContact O-N 3.11Å; H123-E125 PolarHBondContact O-N 3.16Å; H123-L126 PolarHBondContact O-N 3.34Å; H123-Q127 VanDerWaalsContact O-CB 3.28Å; H123-Q127 WeakPolarHBondContact O-CB 3.36Å; H123-Q127 WeakPolarHBondContact O-CG 3.22Å; H123-Q127 PolarHBondContact O-N 2.96Å; H123-I164 WeakPolarHBondContact CB-O 3.38Å; H123-D166 IonicContact CE1-OD1 2.63Å; H123-D166 IonicContact ND1-OD1 3.57Å
124	S	83.4	Confident	84	Confident	81 Å²	81	52.9 Å²	52.9	57%	0.566	29%	0.292	S	S	*	.	H	α-helix	trans	-60.8	-45.3	-179.6	63.2	0	0	0	0	112.5	C122 E128	C122-S124 VanDerWaalsContact C-N 3.27Å; C122-S124 PolarHBondContact O-N 3.41Å; S124-E128 PolarHBondContact O-N 3.23Å; S124-E128 VanDerWaalsContact O-N 3.16Å
125	E	84.6	Confident	84.4	Confident	57 Å²	57	50.7 Å²	50.7	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-69.3	-43.2	178.1	-63.9	176	170.4	0	0	111.4	R94 C122 H123 Q127 E128 I129	R94-E125 WeakPolarHBondContact CD-OE2 3.41Å; R94-E125 IonicContact CZ-OE2 2.72Å; R94-E125 IonicContact NE-OE2 3.75Å; R94-E125 PolarHBondContact NE-OE2 3.48Å; R94-E125 IonicContact NH2-OE2 3Å; C122-E125 PolarHBondContact O-N 3.29Å; H123-E125 PolarHBondContact O-N 3.16Å; E125-Q127 VanDerWaalsContact C-N 3.35Å; E125-Q127 PolarHBondContact O-N 3.3Å; E125-E128 WeakPolarHBondContact O-CB 3.44Å; E125-E128 PolarHBondContact O-N 3.29Å; E125-E128 VanDerWaalsContact O-N 3.14Å; E125-I129 WeakPolarHBondContact O-CG1 3.3Å; E125-I129 PolarHBondContact O-N 3.17Å
126	L	86.7	Confident	84.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-37.1	-179.7	-63.6	173.2	0	0	0	111.9	L97 L113 F118 C122 H123 E128 I129 W130 I164	L97-L126 HydrophobicContact CD1-CD2 3.36Å; L113-L126 HydrophobicContact CD2-CB 4.09Å; L113-L126 HydrophobicContact CD2-CD2 3.82Å; L113-L126 HydrophobicContact CD2-CG 4.36Å; F118-L126 HydrophobicContact CB-CD1 3.58Å; F118-L126 HydrophobicContact CD1-CD1 3.44Å; F118-L126 VanDerWaalsContact CD1-CD1 3.44Å; F118-L126 HydrophobicContact CD2-CD1 3.72Å; F118-L126 HydrophobicContact CE1-CD1 3.96Å; F118-L126 HydrophobicContact CE2-CD1 4.21Å; F118-L126 HydrophobicContact CG-CD1 3.28Å; F118-L126 HydrophobicContact CZ-CD1 4.31Å; C122-L126 HydrophobicContact CB-CD1 3.89Å; C122-L126 HydrophobicContact CB-CG 4.29Å; C122-L126 VanDerWaalsContact O-CG 3.27Å; C122-L126 WeakPolarHBondContact O-CG 3.47Å; C122-L126 PolarHBondContact O-N 3.35Å; H123-L126 PolarHBondContact O-N 3.34Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-I129 PolarHBondContact O-N 3.29Å; L126-W130 WeakPolarHBondContact O-CB 3.28Å; L126-W130 PolarHBondContact O-N 3.1Å; L126-I164 HydrophobicContact CB-CB 4.22Å; L126-I164 HydrophobicContact CB-CD1 4.31Å; L126-I164 HydrophobicContact CB-CG2 3.97Å; L126-I164 HydrophobicContact CD1-CG2 3.81Å
127	Q	88.1	Confident	85.3	Confident	50 Å²	50	48.4 Å²	48.4	23%	0.234	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-39.9	171.5	-74.3	170.7	23.4	0	0	111.1	H123 E125 W130 W131 P160 I164	H123-Q127 VanDerWaalsContact O-CB 3.28Å; H123-Q127 WeakPolarHBondContact O-CB 3.36Å; H123-Q127 WeakPolarHBondContact O-CG 3.22Å; H123-Q127 PolarHBondContact O-N 2.96Å; E125-Q127 VanDerWaalsContact C-N 3.35Å; E125-Q127 PolarHBondContact O-N 3.3Å; Q127-W130 WeakPolarHBondContact O-CB 3.49Å; Q127-W130 PolarHBondContact O-N 3.04Å; Q127-W131 VanDerWaalsContact O-CG 3.3Å; Q127-W131 PolarHBondContact O-N 3.18Å; Q127-P160 HydrophobicContact CG-CB 4.28Å; Q127-I164 HydrophobicContact CG-CD1 4.27Å; Q127-I164 HydrophobicContact CG-CG1 4.34Å; Q127-I164 PolarHBondContact NE2-O 2.89Å
128	E	87.7	Confident	85.9	Confident	70 Å²	70	43.5 Å²	43.5	33%	0.327	23%	0.228	S	C	.	.	H	α-helix	trans	-62.3	-46.3	174.6	-174.4	160.3	-160.8	0	0	111.3	Y8 S124 E125 L126 W130 W131 Q132	Y8-E128 VanDerWaalsContact CD2-CD 3.42Å; Y8-E128 HydrophobicContact CD2-CG 4.34Å; Y8-E128 WeakPolarHBondContact CD2-OE1 3.37Å; Y8-E128 WeakPolarHBondContact CD2-OE2 3.48Å; S124-E128 PolarHBondContact O-N 3.23Å; S124-E128 VanDerWaalsContact O-N 3.16Å; E125-E128 WeakPolarHBondContact O-CB 3.44Å; E125-E128 PolarHBondContact O-N 3.29Å; E125-E128 VanDerWaalsContact O-N 3.14Å; L126-E128 VanDerWaalsContact C-N 3.31Å; E128-W130 VanDerWaalsContact C-N 3.33Å; E128-W130 PolarHBondContact O-N 2.57Å; E128-W131 PolarHBondContact O-N 3.45Å; E128-Q132 HydrophobicContact CG-CG 4.33Å; E128-Q132 VanDerWaalsContact O-CG 3.28Å; E128-Q132 WeakPolarHBondContact O-CG 3.5Å; E128-Q132 PolarHBondContact O-N 2.89Å
129	I	89.9	Confident	86.4	Confident	7 Å²	7	44 Å²	44	4%	0.036	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-44	174.9	-66.8	173.1	0	0	0	111.3	L97 L98 I109 E125 L126 W131 Q132 A133	L97-I129 HydrophobicContact CB-CD1 3.96Å; L97-I129 HydrophobicContact CB-CG2 4.31Å; L97-I129 HydrophobicContact CD1-CD1 4.38Å; L98-I129 HydrophobicContact CD2-CD1 4.32Å; L98-I129 HydrophobicContact CD2-CG1 4.46Å; I109-I129 HydrophobicContact CG2-CG2 4.06Å; E125-I129 WeakPolarHBondContact O-CG1 3.3Å; E125-I129 PolarHBondContact O-N 3.17Å; L126-I129 PolarHBondContact O-N 3.29Å; I129-W131 VanDerWaalsContact C-N 3.32Å; I129-W131 PolarHBondContact O-N 3.13Å; I129-Q132 PolarHBondContact O-N 2.83Å; I129-A133 WeakPolarHBondContact O-CB 3.39Å; I129-A133 PolarHBondContact O-N 3.35Å
130	W	90.9	Very high	86.9	Confident	21 Å²	21	42.9 Å²	42.9	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-46.9	176.1	175.6	-92.3	0	0	0	111.7	Y110 L113 L126 Q127 E128 A133 H134 H158 P159 P160 P161 I164	Y110-W130 AromaticContact CD1-CE3 3.97Å; Y110-W130 HydrophobicContact CD1-CE3 3.97Å; Y110-W130 HydrophobicContact CD1-CH2 4.2Å; Y110-W130 AromaticContact CD1-CZ3 3.69Å; Y110-W130 HydrophobicContact CD1-CZ3 3.69Å; Y110-W130 HydrophobicContact CG-CZ3 4.3Å; L113-W130 HydrophobicContact CB-CE3 4.34Å; L113-W130 HydrophobicContact CD1-CB 4.11Å; L113-W130 HydrophobicContact CD1-CE3 3.8Å; L126-W130 WeakPolarHBondContact O-CB 3.28Å; L126-W130 PolarHBondContact O-N 3.1Å; Q127-W130 WeakPolarHBondContact O-CB 3.49Å; Q127-W130 PolarHBondContact O-N 3.04Å; E128-W130 VanDerWaalsContact C-N 3.33Å; E128-W130 PolarHBondContact O-N 2.57Å; W130-A133 PolarHBondContact O-N 3.08Å; W130-H134 AromaticContact CE2-CD2 3.68Å; W130-H134 AromaticContact CE2-NE2 3.48Å; W130-H134 AromaticContact CH2-NE2 3.97Å; W130-H134 AromaticContact CZ2-NE2 3.36Å; W130-H134 WeakPolarHBondContact CZ2-NE2 3.42Å; W130-H134 AromaticContact NE1-CD2 3.58Å; W130-H134 AromaticContact NE1-NE2 3.82Å; W130-H134 PolarHBondContact O-CD2 3.01Å; W130-H134 PolarHBondContact O-N 2.69Å; W130-H158 HydrophobicContact CZ2-CB 4.38Å; W130-H158 PolarHBondContact NE1-O 2.99Å; W130-P159 WeakPolarHBondContact CZ2-O 3.4Å; W130-P160 HydrophobicContact CG-CB 4.49Å; W130-P161 HydrophobicContact CE3-CG 4.25Å; W130-P161 HydrophobicContact CH2-CG 4.4Å; W130-P161 HydrophobicContact CZ3-CG 3.98Å; W130-I164 HydrophobicContact CB-CD1 4.15Å
131	W	90.7	Very high	87.2	Confident	46 Å²	46	46.4 Å²	46.4	17%	0.174	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-44	178	-63.9	130.5	0	0	0	112.8	Q127 E128 I129 A133 H134 Y135 R155 H158 P160	Q127-W131 VanDerWaalsContact O-CG 3.3Å; Q127-W131 PolarHBondContact O-N 3.18Å; E128-W131 PolarHBondContact O-N 3.45Å; I129-W131 VanDerWaalsContact C-N 3.32Å; I129-W131 PolarHBondContact O-N 3.13Å; W131-A133 VanDerWaalsContact C-N 3.35Å; W131-A133 PolarHBondContact O-N 3.26Å; W131-H134 PolarHBondContact O-N 3.5Å; W131-Y135 HydrophobicContact CB-CE2 3.96Å; W131-Y135 WeakPolarHBondContact O-CB 3.26Å; W131-Y135 WeakPolarHBondContact O-CD1 3.44Å; W131-Y135 WeakPolarHBondContact O-CD2 3.5Å; W131-Y135 PolarHBondContact O-N 2.63Å; W131-R155 HydrophobicContact CD2-CG 3.88Å; W131-R155 HydrophobicContact CE3-CB 4.38Å; W131-R155 HydrophobicContact CE3-CG 3.62Å; W131-R155 HydrophobicContact CH2-CB 3.81Å; W131-R155 HydrophobicContact CH2-CG 3.82Å; W131-R155 HydrophobicContact CZ2-CB 4.33Å; W131-R155 HydrophobicContact CZ2-CG 4.06Å; W131-R155 VanDerWaalsContact CZ3-CA 3.41Å; W131-R155 HydrophobicContact CZ3-CB 3.87Å; W131-R155 HydrophobicContact CZ3-CG 3.63Å; W131-H158 WeakPolarHBondContact CH2-O 2.95Å; W131-H158 WeakPolarHBondContact CZ3-O 3.2Å; W131-P160 HydrophobicContact CZ2-CG 4.26Å
132	Q	90.4	Very high	87.5	Confident	38 Å²	38	46.3 Å²	46.3	18%	0.178	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-41.5	178.3	-66.2	-61.1	-11.7	0	0	111.6	L101 E128 I129 H134 Y135 M136	L101-Q132 HydrophobicContact CD1-CB 4.28Å; L101-Q132 HydrophobicContact CD2-CB 4.07Å; E128-Q132 HydrophobicContact CG-CG 4.33Å; E128-Q132 VanDerWaalsContact O-CG 3.28Å; E128-Q132 WeakPolarHBondContact O-CG 3.5Å; E128-Q132 PolarHBondContact O-N 2.89Å; I129-Q132 PolarHBondContact O-N 2.83Å; Q132-H134 PolarHBondContact O-N 3.37Å; Q132-Y135 PolarHBondContact O-N 3.49Å; Q132-M136 WeakPolarHBondContact O-CB 3.38Å; Q132-M136 VanDerWaalsContact O-CG 3.29Å; Q132-M136 WeakPolarHBondContact O-CG 3.32Å; Q132-M136 PolarHBondContact O-N 3.34Å
133	A	91.6	Very high	87.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.5	-48.4	176.7	0	0	0	0	0	111.5	L101 F106 I109 Y110 I129 W130 W131 Y135 M136 E137	L101-A133 HydrophobicContact CD1-CB 3.94Å; F106-A133 HydrophobicContact CD1-CB 4.03Å; I109-A133 HydrophobicContact CD1-CB 4.09Å; I109-A133 HydrophobicContact CG2-CB 4.21Å; Y110-A133 HydrophobicContact CE1-CB 3.79Å; I129-A133 WeakPolarHBondContact O-CB 3.39Å; I129-A133 PolarHBondContact O-N 3.35Å; W130-A133 PolarHBondContact O-N 3.08Å; W131-A133 VanDerWaalsContact C-N 3.35Å; W131-A133 PolarHBondContact O-N 3.26Å; A133-Y135 PolarHBondContact O-N 3.19Å; A133-M136 PolarHBondContact O-N 3.03Å; A133-E137 VanDerWaalsContact O-CB 3.26Å; A133-E137 WeakPolarHBondContact O-CB 3.26Å; A133-E137 PolarHBondContact O-N 2.94Å
134	H	91.1	Very high	87.5	Confident	8 Å²	8	56.9 Å²	56.9	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-67	-35.3	176.7	-81.3	-56.5	0	0	0	113.7	Y110 W130 W131 Q132 E137 L138 H158	Y110-H134 AromaticContact CE1-CD2 3.92Å; Y110-H134 AromaticContact CE1-CE1 3.6Å; Y110-H134 AromaticContact CE1-NE2 3.57Å; Y110-H134 AromaticContact CE2-CE1 3.95Å; Y110-H134 AromaticContact CZ-CE1 3.36Å; Y110-H134 AromaticContact CZ-ND1 3.58Å; Y110-H134 AromaticContact CZ-NE2 3.85Å; Y110-H134 PolarHBondContact OH-CE1 3.21Å; Y110-H134 PolarHBondContact OH-ND1 2.93Å; W130-H134 AromaticContact CE2-CD2 3.68Å; W130-H134 AromaticContact CE2-NE2 3.48Å; W130-H134 AromaticContact CH2-NE2 3.97Å; W130-H134 AromaticContact CZ2-NE2 3.36Å; W130-H134 WeakPolarHBondContact CZ2-NE2 3.42Å; W130-H134 AromaticContact NE1-CD2 3.58Å; W130-H134 AromaticContact NE1-NE2 3.82Å; W130-H134 PolarHBondContact O-CD2 3.01Å; W130-H134 PolarHBondContact O-N 2.69Å; W131-H134 PolarHBondContact O-N 3.5Å; Q132-H134 PolarHBondContact O-N 3.37Å; H134-E137 IonicContact ND1-OE2 3.7Å; H134-L138 PolarHBondContact O-N 3.49Å; H134-H158 AromaticContact CE1-CD2 3.92Å; H134-H158 AromaticContact CE1-CG 3.53Å; H134-H158 AromaticContact CE1-ND1 3.68Å; H134-H158 AromaticContact ND1-CD2 3.94Å; H134-H158 AromaticContact ND1-CG 3.96Å; H134-H158 WeakPolarHBondContact NE2-CB 3.28Å; H134-H158 AromaticContact NE2-CG 3.66Å; H134-H158 AromaticContact NE2-ND1 4Å
135	Y	91	Very high	87.6	Confident	16 Å²	16	58.3 Å²	58.3	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-50	175.8	-63.2	-17.1	0	0	0	110.6	W131 Q132 A133 E137 L138 E139 L146 K151 L154 R155	W131-Y135 HydrophobicContact CB-CE2 3.96Å; W131-Y135 WeakPolarHBondContact O-CB 3.26Å; W131-Y135 WeakPolarHBondContact O-CD1 3.44Å; W131-Y135 WeakPolarHBondContact O-CD2 3.5Å; W131-Y135 PolarHBondContact O-N 2.63Å; Q132-Y135 PolarHBondContact O-N 3.49Å; A133-Y135 PolarHBondContact O-N 3.19Å; Y135-E137 PolarHBondContact O-N 3.23Å; Y135-L138 PolarHBondContact O-N 3.43Å; Y135-E139 WeakPolarHBondContact O-CB 3.29Å; Y135-E139 VanDerWaalsContact O-CG 3.31Å; Y135-E139 WeakPolarHBondContact O-CG 3.37Å; Y135-E139 PolarHBondContact O-N 3.47Å; Y135-L146 HydrophobicContact CD1-CD1 4.25Å; Y135-L146 HydrophobicContact CG-CD1 4.41Å; Y135-L146 VanDerWaalsContact O-CD1 3.32Å; Y135-L146 WeakPolarHBondContact O-CD1 3.32Å; Y135-K151 HydrophobicContact CD1-CB 4.38Å; Y135-K151 HydrophobicContact CD1-CG 4.04Å; Y135-K151 HydrophobicContact CD2-CD 4.15Å; Y135-K151 HydrophobicContact CD2-CG 4.43Å; Y135-K151 HydrophobicContact CE1-CB 3.77Å; Y135-K151 HydrophobicContact CE1-CG 3.9Å; Y135-K151 HydrophobicContact CE2-CB 4.47Å; Y135-K151 HydrophobicContact CE2-CD 3.98Å; Y135-K151 HydrophobicContact CE2-CG 4.26Å; Y135-K151 HydrophobicContact CG-CD 4.49Å; Y135-K151 HydrophobicContact CG-CG 4.33Å; Y135-L154 HydrophobicContact CD1-CB 4.47Å; Y135-L154 HydrophobicContact CD1-CD1 3.67Å; Y135-L154 HydrophobicContact CE1-CB 4.17Å; Y135-L154 HydrophobicContact CE1-CD1 4.18Å; Y135-R155 WeakPolarHBondContact OH-CD 3.44Å; Y135-R155 VanDerWaalsContact OH-CG 3.24Å; Y135-R155 WeakPolarHBondContact OH-CG 3.36Å; Y135-R155 PolarHBondContact OH-NH1 3.2Å
136	M	88.2	Confident	87.6	Confident	12 Å²	12	56.3 Å²	56.3	6%	0.059	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-42.2	179.1	-70	179	67.5	0	0	112	L14 L101 F106 Q132 A133 L138 E139 Q140	L14-M136 HydrophobicContact CD1-CE 3.83Å; L101-M136 HydrophobicContact CD1-SD 3.67Å; L101-M136 HydrophobicContact CD2-SD 4.35Å; L101-M136 HydrophobicContact CG-SD 3.77Å; F106-M136 HydrophobicContact CE1-CB 3.67Å; F106-M136 HydrophobicContact CZ-CB 3.74Å; Q132-M136 WeakPolarHBondContact O-CB 3.38Å; Q132-M136 VanDerWaalsContact O-CG 3.29Å; Q132-M136 WeakPolarHBondContact O-CG 3.32Å; Q132-M136 PolarHBondContact O-N 3.34Å; A133-M136 PolarHBondContact O-N 3.03Å; M136-L138 VanDerWaalsContact C-N 3.31Å; M136-L138 PolarHBondContact O-N 2.89Å; M136-E139 PolarHBondContact O-N 2.86Å; M136-Q140 WeakPolarHBondContact O-CB 3.43Å; M136-Q140 VanDerWaalsContact O-CG 3.3Å; M136-Q140 WeakPolarHBondContact O-CG 3.35Å; M136-Q140 PolarHBondContact O-N 3.11Å
137	E	90.5	Very high	87.6	Confident	70 Å²	70	57.9 Å²	57.9	33%	0.327	29%	0.286	S	S	.	.	H	α-helix	trans	-58.3	-43.1	176.9	-174.9	173.6	-144.5	0	0	111.7	F106 Y110 A133 H134 Y135 F141	F106-E137 HydrophobicContact CD2-CB 3.58Å; F106-E137 HydrophobicContact CD2-CG 3.78Å; F106-E137 HydrophobicContact CE2-CB 3.82Å; F106-E137 HydrophobicContact CE2-CG 4.26Å; F106-E137 HydrophobicContact CG-CB 3.96Å; F106-E137 HydrophobicContact CG-CG 4.39Å; F106-E137 HydrophobicContact CZ-CB 4.39Å; Y110-E137 WeakPolarHBondContact CE2-OE2 3.28Å; Y110-E137 PolarHBondContact OH-OE2 3.46Å; A133-E137 VanDerWaalsContact O-CB 3.26Å; A133-E137 WeakPolarHBondContact O-CB 3.26Å; A133-E137 PolarHBondContact O-N 2.94Å; H134-E137 IonicContact ND1-OE2 3.7Å; Y135-E137 PolarHBondContact O-N 3.23Å; E137-F141 PolarHBondContact O-N 2.84Å; E137-F141 VanDerWaalsContact O-N 3.11Å
138	L	88	Confident	87.6	Confident	46 Å²	46	59.6 Å²	59.6	24%	0.241	31%	0.309	C	S	.	.	H	α-helix	trans	-76.5	-35.4	178.7	-174.8	63.8	0	0	0	112.7	H134 Y135 M136 F141 R142 L146 L154	H134-L138 PolarHBondContact O-N 3.49Å; Y135-L138 PolarHBondContact O-N 3.43Å; M136-L138 VanDerWaalsContact C-N 3.31Å; M136-L138 PolarHBondContact O-N 2.89Å; L138-F141 PolarHBondContact O-N 3.3Å; L138-R142 HydrophobicContact CD1-CG 3.98Å; L138-R142 HydrophobicContact CG-CG 4.34Å; L138-R142 WeakPolarHBondContact O-CB 3.31Å; L138-R142 WeakPolarHBondContact O-CG 3.43Å; L138-R142 PolarHBondContact O-N 2.82Å; L138-L146 HydrophobicContact CB-CD1 4.19Å; L138-L146 HydrophobicContact CB-CD2 4.47Å; L138-L146 HydrophobicContact CD2-CD1 4.28Å; L138-L146 HydrophobicContact CD2-CD2 3.47Å; L138-L146 VanDerWaalsContact CD2-CD2 3.47Å; L138-L146 HydrophobicContact CG-CD1 4.47Å; L138-L146 HydrophobicContact CG-CD2 3.87Å; L138-L154 HydrophobicContact CB-CD1 4.04Å; L138-L154 HydrophobicContact CD2-CD1 3.57Å; L138-L154 HydrophobicContact CD2-CD2 4.1Å; L138-L154 HydrophobicContact CD2-CG 3.89Å; L138-L154 HydrophobicContact CG-CD1 4.44Å
139	E	89.2	Confident	87.5	Confident	43 Å²	43	60.5 Å²	60.5	20%	0.201	32%	0.319	C	S	.	.	H	α-helix	trans	-62.7	-42.3	173.3	-75.5	-178.6	159	0	0	111.2	Y135 M136 R142 C143 L146	Y135-E139 WeakPolarHBondContact O-CB 3.29Å; Y135-E139 VanDerWaalsContact O-CG 3.31Å; Y135-E139 WeakPolarHBondContact O-CG 3.37Å; Y135-E139 PolarHBondContact O-N 3.47Å; M136-E139 PolarHBondContact O-N 2.86Å; E139-R142 PolarHBondContact O-N 3.29Å; E139-C143 WeakPolarHBondContact O-CA 3.37Å; E139-C143 PolarHBondContact O-N 3.38Å; E139-L146 HydrophobicContact CG-CB 4.24Å; E139-L146 HydrophobicContact CG-CD1 3.69Å; E139-L146 HydrophobicContact CG-CG 3.53Å; E139-L146 PolarHBondContact OE1-N 3.49Å
140	Q	85	Confident	87.4	Confident	93 Å²	93	62 Å²	62	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-42.3	173.9	-76	-174.5	3.3	0	0	111.8	F106 M136 R142	F106-Q140 VanDerWaalsContact CE2-OE1 3.31Å; M136-Q140 WeakPolarHBondContact O-CB 3.43Å; M136-Q140 VanDerWaalsContact O-CG 3.3Å; M136-Q140 WeakPolarHBondContact O-CG 3.35Å; M136-Q140 PolarHBondContact O-N 3.11Å; Q140-R142 VanDerWaalsContact C-N 3.33Å; Q140-R142 PolarHBondContact O-N 3.33Å
141	F	84.4	Confident	87.3	Confident	151 Å²	151	64.2 Å²	64.2	66%	0.662	34%	0.336	S	S	*	.	H	α-helix	trans	-69	-29.9	178.6	-176.2	-101.1	0	0	0	113.4	E137 L138	E137-F141 PolarHBondContact O-N 2.84Å; E137-F141 VanDerWaalsContact O-N 3.11Å; L138-F141 PolarHBondContact O-N 3.3Å
142	R	82.7	Confident	87.1	Confident	140 Å²	140	67.7 Å²	67.7	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-101.5	-13.6	-174.6	-65.7	-66.4	-179.5	178.2	-6.4	114.5	L138 E139 Q140 R144	L138-R142 HydrophobicContact CD1-CG 3.98Å; L138-R142 HydrophobicContact CG-CG 4.34Å; L138-R142 WeakPolarHBondContact O-CB 3.31Å; L138-R142 WeakPolarHBondContact O-CG 3.43Å; L138-R142 PolarHBondContact O-N 2.82Å; E139-R142 PolarHBondContact O-N 3.29Å; Q140-R142 VanDerWaalsContact C-N 3.33Å; Q140-R142 PolarHBondContact O-N 3.33Å; R142-R144 HydrophobicContact CB-CG 3.92Å; R142-R144 PolarHBondContact O-N 2.94Å; R142-R144 VanDerWaalsContact O-N 3.15Å
143	C	81.2	Confident	87.1	Confident	121 Å²	121	73.8 Å²	73.8	82%	0.818	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	30.9	-174.6	-55.7	0	0	0	0	113.3	E139	E139-C143 WeakPolarHBondContact O-CA 3.37Å; E139-C143 PolarHBondContact O-N 3.38Å
144	R	83.3	Confident	86.9	Confident	124 Å²	124	74.6 Å²	74.6	47%	0.468	38%	0.376	S	S	.	.	S	Bend	trans	-145.1	147.5	177.8	71.9	-173.3	174.3	119.6	6.2	110	R142 E150	R142-R144 HydrophobicContact CB-CG 3.92Å; R142-R144 PolarHBondContact O-N 2.94Å; R142-R144 VanDerWaalsContact O-N 3.15Å; R144-E150 IonicContact CZ-OE1 3.6Å; R144-E150 IonicContact NH1-OE1 3.87Å; R144-E150 IonicContact NH2-OE1 2.73Å; R144-E150 PolarHBondContact NH2-OE1 3.11Å
145	P	84	Confident	86.9	Confident	111 Å²	111	79 Å²	79	72%	0.721	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-65.8	143.7	177.8	28	-34.8	0	0	0	111
146	L	84.5	Confident	86.5	Confident	15 Å²	15	84 Å²	84	8%	0.079	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-78.9	129.2	-179.3	-73.3	167.5	0	0	0	112.5	Y135 L138 E139 E150 K151 L154	Y135-L146 HydrophobicContact CD1-CD1 4.25Å; Y135-L146 HydrophobicContact CG-CD1 4.41Å; Y135-L146 VanDerWaalsContact O-CD1 3.32Å; Y135-L146 WeakPolarHBondContact O-CD1 3.32Å; L138-L146 HydrophobicContact CB-CD1 4.19Å; L138-L146 HydrophobicContact CB-CD2 4.47Å; L138-L146 HydrophobicContact CD2-CD1 4.28Å; L138-L146 HydrophobicContact CD2-CD2 3.47Å; L138-L146 VanDerWaalsContact CD2-CD2 3.47Å; L138-L146 HydrophobicContact CG-CD1 4.47Å; L138-L146 HydrophobicContact CG-CD2 3.87Å; E139-L146 HydrophobicContact CG-CB 4.24Å; E139-L146 HydrophobicContact CG-CD1 3.69Å; E139-L146 HydrophobicContact CG-CG 3.53Å; E139-L146 PolarHBondContact OE1-N 3.49Å; L146-E150 HydrophobicContact CB-CB 4.47Å; L146-E150 HydrophobicContact CD2-CB 3.68Å; L146-E150 HydrophobicContact CD2-CG 4.43Å; L146-K151 HydrophobicContact CB-CG 3.98Å; L146-L154 HydrophobicContact CD1-CD1 3.95Å
147	G	88.2	Confident	86.5	Confident	34 Å²	34	90.7 Å²	90.7	35%	0.351	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-71.1	162.3	169.4	0	0	0	0	0	112.7	V149 E150 K151	G147-V149 VanDerWaalsContact C-N 3.25Å; G147-V149 PolarHBondContact O-N 3.46Å; G147-E150 PolarHBondContact N-OE2 2.84Å; G147-E150 PolarHBondContact O-N 3.15Å; G147-K151 PolarHBondContact O-N 3.45Å
148	A	87.7	Confident	86.4	Confident	85 Å²	85	90.1 Å²	90.1	70%	0.702	44%	0.44	S	S	*	.	H	α-helix	trans	-56.8	-37.3	179.6	0	0	0	0	0	113.5	E150 Y152	A148-E150 VanDerWaalsContact C-N 3.33Å; A148-Y152 PolarHBondContact O-N 3.32Å
149	V	85.4	Confident	86.3	Confident	90 Å²	90	91.4 Å²	91.4	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-65.9	-37.9	177.8	179.5	0	0	0	0	111.2	G147 Y152 R153	G147-V149 VanDerWaalsContact C-N 3.25Å; G147-V149 PolarHBondContact O-N 3.46Å; V149-Y152 WeakPolarHBondContact O-CB 3.4Å; V149-Y152 PolarHBondContact O-N 2.99Å; V149-R153 WeakPolarHBondContact O-CG 3.24Å; V149-R153 PolarHBondContact O-N 2.89Å
150	E	86.7	Confident	86	Confident	38 Å²	38	90 Å²	90	18%	0.178	45%	0.446	C	S	.	.	H	α-helix	trans	-72	-43.4	-179.5	-60.6	175.8	123.3	0	0	110.7	R144 L146 G147 A148 Y152 R153 L154	R144-E150 IonicContact CZ-OE1 3.6Å; R144-E150 IonicContact NH1-OE1 3.87Å; R144-E150 IonicContact NH2-OE1 2.73Å; R144-E150 PolarHBondContact NH2-OE1 3.11Å; L146-E150 HydrophobicContact CB-CB 4.47Å; L146-E150 HydrophobicContact CD2-CB 3.68Å; L146-E150 HydrophobicContact CD2-CG 4.43Å; G147-E150 PolarHBondContact N-OE2 2.84Å; G147-E150 PolarHBondContact O-N 3.15Å; A148-E150 VanDerWaalsContact C-N 3.33Å; E150-Y152 VanDerWaalsContact C-N 3.25Å; E150-Y152 PolarHBondContact O-N 3.44Å; E150-R153 PolarHBondContact O-N 2.89Å; E150-R153 VanDerWaalsContact O-N 3.12Å; E150-L154 PolarHBondContact O-N 2.96Å
151	K	89.9	Confident	85.8	Confident	68 Å²	68	86.7 Å²	86.7	30%	0.296	43%	0.432	S	S	.	.	H	α-helix	trans	-56.4	-41.3	171.1	-65.4	-172.3	-179.4	-171.6	0	111.5	Y135 L146 G147 L154 R155	Y135-K151 HydrophobicContact CD1-CB 4.38Å; Y135-K151 HydrophobicContact CD1-CG 4.04Å; Y135-K151 HydrophobicContact CD2-CD 4.15Å; Y135-K151 HydrophobicContact CD2-CG 4.43Å; Y135-K151 HydrophobicContact CE1-CB 3.77Å; Y135-K151 HydrophobicContact CE1-CG 3.9Å; Y135-K151 HydrophobicContact CE2-CB 4.47Å; Y135-K151 HydrophobicContact CE2-CD 3.98Å; Y135-K151 HydrophobicContact CE2-CG 4.26Å; Y135-K151 HydrophobicContact CG-CD 4.49Å; Y135-K151 HydrophobicContact CG-CG 4.33Å; L146-K151 HydrophobicContact CB-CG 3.98Å; G147-K151 PolarHBondContact O-N 3.45Å; K151-L154 PolarHBondContact O-N 3.28Å; K151-R155 WeakPolarHBondContact O-CG 3.3Å; K151-R155 PolarHBondContact O-N 2.83Å
152	Y	86.4	Confident	85.2	Confident	118 Å²	118	83.7 Å²	83.7	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-62.9	-46	174.3	172.8	-99	0	0	0	112.8	A148 V149 E150 L154 R155 K156	A148-Y152 PolarHBondContact O-N 3.32Å; V149-Y152 WeakPolarHBondContact O-CB 3.4Å; V149-Y152 PolarHBondContact O-N 2.99Å; E150-Y152 VanDerWaalsContact C-N 3.25Å; E150-Y152 PolarHBondContact O-N 3.44Å; Y152-L154 VanDerWaalsContact C-N 3.31Å; Y152-L154 PolarHBondContact O-N 3.44Å; Y152-R155 PolarHBondContact O-N 2.84Å; Y152-K156 HydrophobicContact CE1-CG 4.26Å; Y152-K156 HydrophobicContact CE2-CG 4.2Å; Y152-K156 PolarHBondContact O-N 3Å
153	R	89.9	Confident	84.9	Confident	167 Å²	167	78.3 Å²	78.3	63%	0.63	42%	0.418	S	S	*	.	H	α-helix	trans	-59.8	-41.7	176.7	-73.7	173.4	179	164.6	-0.4	111.5	V149 E150 K156 K157	V149-R153 WeakPolarHBondContact O-CG 3.24Å; V149-R153 PolarHBondContact O-N 2.89Å; E150-R153 PolarHBondContact O-N 2.89Å; E150-R153 VanDerWaalsContact O-N 3.12Å; R153-K156 PolarHBondContact O-N 3.13Å; R153-K157 WeakPolarHBondContact O-CB 3.34Å; R153-K157 PolarHBondContact O-N 3.11Å
154	L	88.7	Confident	84.5	Confident	16 Å²	16	72.6 Å²	72.6	8%	0.084	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-45.7	174.6	-83.5	177	0	0	0	111.9	Y135 L138 L146 E150 K151 Y152 K156 K157 H158	Y135-L154 HydrophobicContact CD1-CB 4.47Å; Y135-L154 HydrophobicContact CD1-CD1 3.67Å; Y135-L154 HydrophobicContact CE1-CB 4.17Å; Y135-L154 HydrophobicContact CE1-CD1 4.18Å; L138-L154 HydrophobicContact CB-CD1 4.04Å; L138-L154 HydrophobicContact CD2-CD1 3.57Å; L138-L154 HydrophobicContact CD2-CD2 4.1Å; L138-L154 HydrophobicContact CD2-CG 3.89Å; L138-L154 HydrophobicContact CG-CD1 4.44Å; L146-L154 HydrophobicContact CD1-CD1 3.95Å; E150-L154 PolarHBondContact O-N 2.96Å; K151-L154 PolarHBondContact O-N 3.28Å; Y152-L154 VanDerWaalsContact C-N 3.31Å; Y152-L154 PolarHBondContact O-N 3.44Å; L154-K156 VanDerWaalsContact C-N 3.26Å; L154-K156 PolarHBondContact O-N 2.87Å; L154-K157 PolarHBondContact O-N 2.93Å; L154-K157 VanDerWaalsContact O-N 3.08Å; L154-H158 PolarHBondContact O-N 2.89Å
155	R	89.2	Confident	83.8	Confident	100 Å²	100	69.7 Å²	69.7	38%	0.377	37%	0.368	S	S	.	.	H	α-helix	trans	-59.5	-36.3	177	-70	-167.4	-60.6	-87.7	0.7	113.6	W131 Y135 K151 Y152	W131-R155 HydrophobicContact CD2-CG 3.88Å; W131-R155 HydrophobicContact CE3-CB 4.38Å; W131-R155 HydrophobicContact CE3-CG 3.62Å; W131-R155 HydrophobicContact CH2-CB 3.81Å; W131-R155 HydrophobicContact CH2-CG 3.82Å; W131-R155 HydrophobicContact CZ2-CB 4.33Å; W131-R155 HydrophobicContact CZ2-CG 4.06Å; W131-R155 VanDerWaalsContact CZ3-CA 3.41Å; W131-R155 HydrophobicContact CZ3-CB 3.87Å; W131-R155 HydrophobicContact CZ3-CG 3.63Å; Y135-R155 WeakPolarHBondContact OH-CD 3.44Å; Y135-R155 VanDerWaalsContact OH-CG 3.24Å; Y135-R155 WeakPolarHBondContact OH-CG 3.36Å; Y135-R155 PolarHBondContact OH-NH1 3.2Å; K151-R155 WeakPolarHBondContact O-CG 3.3Å; K151-R155 PolarHBondContact O-N 2.83Å; Y152-R155 PolarHBondContact O-N 2.84Å
156	K	84.3	Confident	82.6	Confident	122 Å²	122	70.1 Å²	70.1	53%	0.53	37%	0.365	S	S	.	.	H	α-helix	trans	-74.4	-31.7	175.3	-83.2	-70.7	-179.5	-171.8	0	113.2	Y152 R153 L154 E169	Y152-K156 HydrophobicContact CE1-CG 4.26Å; Y152-K156 HydrophobicContact CE2-CG 4.2Å; Y152-K156 PolarHBondContact O-N 3Å; R153-K156 PolarHBondContact O-N 3.13Å; L154-K156 VanDerWaalsContact C-N 3.26Å; L154-K156 PolarHBondContact O-N 2.87Å; K156-E169 IonicContact NZ-OE1 3.84Å; K156-E169 PolarHBondContact NZ-OE1 3Å
157	K	88.5	Confident	81.3	Confident	153 Å²	153	71.5 Å²	71.5	67%	0.665	38%	0.383	S	S	*	.	H	α-helix	trans	-78.3	-37.6	-179.8	-171.9	-177.8	175	-163.7	0	112.6	R153 L154 P159	R153-K157 WeakPolarHBondContact O-CB 3.34Å; R153-K157 PolarHBondContact O-N 3.11Å; L154-K157 PolarHBondContact O-N 2.93Å; L154-K157 VanDerWaalsContact O-N 3.08Å; K157-P159 WeakPolarHBondContact O-CD 3.34Å
158	H	86.9	Confident	79.5	Confident	57 Å²	57	74.7 Å²	74.7	26%	0.264	39%	0.388	S	S	.	.	S	Bend	trans	-124.1	70.9	-173.9	-64.6	-72.9	0	0	0	110.7	W130 W131 H134 L154	W130-H158 HydrophobicContact CZ2-CB 4.38Å; W130-H158 PolarHBondContact NE1-O 2.99Å; W131-H158 WeakPolarHBondContact CH2-O 2.95Å; W131-H158 WeakPolarHBondContact CZ3-O 3.2Å; H134-H158 AromaticContact CE1-CD2 3.92Å; H134-H158 AromaticContact CE1-CG 3.53Å; H134-H158 AromaticContact CE1-ND1 3.68Å; H134-H158 AromaticContact ND1-CD2 3.94Å; H134-H158 AromaticContact ND1-CG 3.96Å; H134-H158 WeakPolarHBondContact NE2-CB 3.28Å; H134-H158 AromaticContact NE2-CG 3.66Å; H134-H158 AromaticContact NE2-ND1 4Å; L154-H158 PolarHBondContact O-N 2.89Å
159	P	85.6	Confident	77.6	Confident	73 Å²	73	75.3 Å²	75.3	47%	0.474	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-58	149.5	173	28	-34.5	0	0	0	110.5	W130 K157	W130-P159 WeakPolarHBondContact CZ2-O 3.4Å; K157-P159 WeakPolarHBondContact O-CD 3.34Å
160	P	83	Confident	76.1	Confident	15 Å²	15	74.8 Å²	74.8	10%	0.097	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-61.7	146	176.6	27.3	-32.7	0	0	0	109.9	Q127 W130 W131 I164 W165	Q127-P160 HydrophobicContact CG-CB 4.28Å; W130-P160 HydrophobicContact CG-CB 4.49Å; W131-P160 HydrophobicContact CZ2-CG 4.26Å; P160-I164 HydrophobicContact CB-CD1 3.98Å; P160-I164 HydrophobicContact CB-CG1 3.96Å; P160-W165 HydrophobicContact CB-CB 4.17Å; P160-W165 HydrophobicContact CG-CB 3.85Å; P160-W165 HydrophobicContact CG-CD2 3.98Å; P160-W165 HydrophobicContact CG-CE3 4.12Å; P160-W165 HydrophobicContact CG-CG 3.87Å
161	P	80.8	Confident	74.4	Confident	23 Å²	23	74.9 Å²	74.9	15%	0.149	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-65.2	154.4	178.2	26.4	-32.5	0	0	0	111	L113 W130 T163 I164 W165	L113-P161 HydrophobicContact CB-CG 4.44Å; W130-P161 HydrophobicContact CE3-CG 4.25Å; W130-P161 HydrophobicContact CH2-CG 4.4Å; W130-P161 HydrophobicContact CZ3-CG 3.98Å; P161-T163 PolarHBondContact O-N 3.43Å; P161-I164 HydrophobicContact CG-CD1 4.15Å; P161-I164 HydrophobicContact CG-CG1 3.99Å; P161-I164 WeakPolarHBondContact O-CG1 3.39Å; P161-I164 PolarHBondContact O-N 2.98Å; P161-I164 VanDerWaalsContact O-N 3.1Å; P161-W165 PolarHBondContact O-N 3.05Å
162	A	73.3	Confident	72.8	Confident	87 Å²	87	79.1 Å²	79.1	72%	0.719	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.3	-177.6	0	0	0	0	0	114	I164 W165	A162-I164 VanDerWaalsContact C-N 3.33Å; A162-W165 CarbonylContact C-O 3.48Å; A162-W165 WeakPolarHBondContact CA-O 3.36Å; A162-W165 VanDerWaalsContact O-O 3.05Å
163	T	74.7	Confident	71.5	Confident	28 Å²	28	78 Å²	78	17%	0.172	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.1	176.1	44	0	0	0	0	114	L113 N116 P161	L113-T163 WeakPolarHBondContact O-CB 3.24Å; L113-T163 PolarHBondContact O-OG1 3.05Å; N116-T163 WeakPolarHBondContact O-CB 3.28Å; N116-T163 WeakPolarHBondContact O-CG2 3.27Å; P161-T163 PolarHBondContact O-N 3.43Å
164	I	74.1	Confident	70	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	-118.9	9.9	179.9	67.3	174.7	0	0	0	112	L113 F118 H123 L126 Q127 W130 P160 P161 A162	L113-I164 HydrophobicContact CD1-CD1 4.44Å; L113-I164 HydrophobicContact CD2-CG2 4.21Å; F118-I164 HydrophobicContact CD2-CG2 3.54Å; F118-I164 HydrophobicContact CE2-CG2 3.99Å; F118-I164 HydrophobicContact CG-CG2 4.34Å; H123-I164 WeakPolarHBondContact CB-O 3.38Å; L126-I164 HydrophobicContact CB-CB 4.22Å; L126-I164 HydrophobicContact CB-CD1 4.31Å; L126-I164 HydrophobicContact CB-CG2 3.97Å; L126-I164 HydrophobicContact CD1-CG2 3.81Å; Q127-I164 HydrophobicContact CG-CD1 4.27Å; Q127-I164 HydrophobicContact CG-CG1 4.34Å; Q127-I164 PolarHBondContact NE2-O 2.89Å; W130-I164 HydrophobicContact CB-CD1 4.15Å; P160-I164 HydrophobicContact CB-CD1 3.98Å; P160-I164 HydrophobicContact CB-CG1 3.96Å; P161-I164 HydrophobicContact CG-CD1 4.15Å; P161-I164 HydrophobicContact CG-CG1 3.99Å; P161-I164 WeakPolarHBondContact O-CG1 3.39Å; P161-I164 PolarHBondContact O-N 2.98Å; P161-I164 VanDerWaalsContact O-N 3.1Å; A162-I164 VanDerWaalsContact C-N 3.33Å
165	W	67.6	Low	69	Low	63 Å²	63	76.5 Å²	76.5	24%	0.239	40%	0.399	C	S	.	.			trans	-155.7	119.3	-175.7	-177.9	52.5	0	0	0	110.5	P160 P161 A162 G167 E168 E169	P160-W165 HydrophobicContact CB-CB 4.17Å; P160-W165 HydrophobicContact CG-CB 3.85Å; P160-W165 HydrophobicContact CG-CD2 3.98Å; P160-W165 HydrophobicContact CG-CE3 4.12Å; P160-W165 HydrophobicContact CG-CG 3.87Å; P161-W165 PolarHBondContact O-N 3.05Å; A162-W165 CarbonylContact C-O 3.48Å; A162-W165 WeakPolarHBondContact CA-O 3.36Å; A162-W165 VanDerWaalsContact O-O 3.05Å; W165-G167 PolarHBondContact O-N 3.05Å; W165-E168 VanDerWaalsContact CZ2-O 3.24Å; W165-E168 WeakPolarHBondContact CZ2-O 3.39Å; W165-E168 PolarHBondContact NE1-O 3.2Å; W165-E169 HydrophobicContact CZ2-CB 4.45Å
166	D	60.2	Low	68.2	Low	120 Å²	120	74.9 Å²	74.9	64%	0.642	40%	0.396	S	S	*	.			trans	-67.9	12.4	-177.5	-55.3	-35.9	0	0	0	114.4	H123 E168	H123-D166 IonicContact CE1-OD1 2.63Å; H123-D166 IonicContact ND1-OD1 3.57Å; D166-E168 PolarHBondContact O-N 3.42Å; D166-E168 VanDerWaalsContact O-N 3.11Å
167	G	56.1	Low	67.9	Low	45 Å²	45	74.9 Å²	74.9	46%	0.464	40%	0.402	S	S	.	.	S	Bend	trans	72.8	-1.5	177.9	0	0	0	0	0	115.1	W165 E169	W165-G167 PolarHBondContact O-N 3.05Å; G167-E169 PolarHBondContact O-N 3.23Å
168	E	50.4	Low	67.6	Low	100 Å²	100	68 Å²	68	47%	0.467	37%	0.373	S	S	.	.			trans	-70.6	102.6	173.2	-74.1	-158.9	161.7	0	0	110.5	W165 D166 T170	W165-E168 VanDerWaalsContact CZ2-O 3.24Å; W165-E168 WeakPolarHBondContact CZ2-O 3.39Å; W165-E168 PolarHBondContact NE1-O 3.2Å; D166-E168 PolarHBondContact O-N 3.42Å; D166-E168 VanDerWaalsContact O-N 3.11Å; E168-T170 PolarHBondContact O-N 3.27Å
169	E	47.6	Very low	67.4	Low	99 Å²	99	68 Å²	68	46%	0.463	37%	0.37	S	S	.	.			trans	-61.7	91.7	175.4	-157	-173.8	-172.5	0	0	111.3	K156 W165 G167 V171	K156-E169 IonicContact NZ-OE1 3.84Å; K156-E169 PolarHBondContact NZ-OE1 3Å; W165-E169 HydrophobicContact CZ2-CB 4.45Å; G167-E169 PolarHBondContact O-N 3.23Å; E169-V171 VanDerWaalsContact C-N 3.32Å; E169-V171 HydrophobicContact CG-CG2 3.78Å; E169-V171 PolarHBondContact O-N 3.09Å
170	T	53.4	Low	67.5	Low	79 Å²	79	69.8 Å²	69.8	49%	0.485	37%	0.372	S	S	.	.			trans	-75	86.9	169.3	59.3	0	0	0	0	109.9	E168 Y172 F174	E168-T170 PolarHBondContact O-N 3.27Å; T170-Y172 PolarHBondContact O-N 3.07Å; T170-F174 WeakPolarHBondContact CA-O 3.3Å
171	V	51.5	Low	67.8	Low	39 Å²	39	70.9 Å²	70.9	24%	0.236	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-76.2	109.3	170.7	-176.5	0	0	0	0	108	E169 F174	E169-V171 VanDerWaalsContact C-N 3.32Å; E169-V171 HydrophobicContact CG-CG2 3.78Å; E169-V171 PolarHBondContact O-N 3.09Å; V171-F174 VanDerWaalsContact O-CD2 3.3Å; V171-F174 WeakPolarHBondContact O-CD2 3.42Å
172	Y	55.7	Low	68.3	Low	158 Å²	158	69.8 Å²	69.8	62%	0.62	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	31	-177.4	-51.4	-74.5	0	0	0	116.3	T170 F174 R221	T170-Y172 PolarHBondContact O-N 3.07Å; Y172-F174 VanDerWaalsContact C-N 3.31Å; Y172-R221 PolarHBondContact OH-NH2 3.13Å
173	S	59.9	Low	69.1	Low	93 Å²	93	71.2 Å²	71.2	65%	0.65	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	12.6	-176	-24.6	0	0	0	0	115.1
174	F	58	Low	69.9	Low	17 Å²	17	75.4 Å²	75.4	8%	0.075	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-95	125.2	176.1	-60.2	-64.3	0	0	0	110.4	T170 V171 Y172 R179 L182 L206 Q210	T170-F174 WeakPolarHBondContact CA-O 3.3Å; V171-F174 VanDerWaalsContact O-CD2 3.3Å; V171-F174 WeakPolarHBondContact O-CD2 3.42Å; Y172-F174 VanDerWaalsContact C-N 3.31Å; F174-R179 HydrophobicContact CB-CG 3.65Å; F174-L182 HydrophobicContact CD1-CD1 4.39Å; F174-L182 HydrophobicContact CE1-CD1 4.47Å; F174-L206 HydrophobicContact CD1-CD1 3.52Å; F174-L206 HydrophobicContact CD1-CD2 3.51Å; F174-L206 HydrophobicContact CD1-CG 4.14Å; F174-L206 HydrophobicContact CE1-CD1 3.49Å; F174-L206 VanDerWaalsContact CE1-CD1 3.49Å; F174-L206 HydrophobicContact CE1-CD2 3.75Å; F174-L206 HydrophobicContact CE1-CG 4.16Å; F174-Q210 HydrophobicContact CE1-CB 3.93Å; F174-Q210 HydrophobicContact CZ-CB 4Å
175	K	68.4	Low	70.8	Confident	135 Å²	135	76.7 Å²	76.7	59%	0.587	38%	0.383	S	S	*	.			trans	-64.9	153.1	166.6	-64.8	-167.9	176.9	-165.5	0	110.3	N177 S178 R179	K175-N177 VanDerWaalsContact C-N 3.26Å; K175-N177 PolarHBondContact O-N 2.88Å; K175-S178 PolarHBondContact N-OG 2.66Å; K175-S178 PolarHBondContact O-N 3.23Å; K175-S178 PolarHBondContact O-OG 3.2Å; K175-R179 PolarHBondContact O-N 3.01Å; K175-R179 VanDerWaalsContact O-N 3.14Å
176	E	72.3	Confident	72	Confident	67 Å²	67	74.1 Å²	74.1	31%	0.313	37%	0.374	S	S	.	.	H	α-helix	trans	-57.3	-39.7	-177.1	-172.8	55.8	-150	0	0	112.3	S178 R179 Q180	E176-S178 PolarHBondContact O-N 2.89Å; E176-R179 WeakPolarHBondContact O-CB 3.48Å; E176-R179 PolarHBondContact O-N 3.03Å; E176-R179 VanDerWaalsContact O-N 3.09Å; E176-R179 IonicContact OE2-CZ 3.28Å; E176-R179 IonicContact OE2-NE 2.88Å; E176-R179 IonicContact OE2-NH1 3.93Å; E176-R179 PolarHBondContact OE2-NH1 3.3Å; E176-Q180 WeakPolarHBondContact O-CG 3.4Å; E176-Q180 PolarHBondContact O-N 2.94Å
177	N	77.8	Confident	73.5	Confident	122 Å²	122	71.7 Å²	71.7	65%	0.652	38%	0.376	S	S	*	.	H	α-helix	trans	-56.9	-48.2	174.7	-172.3	19.7	0	0	0	112.5	K175 R179 Q180 L181	K175-N177 VanDerWaalsContact C-N 3.26Å; K175-N177 PolarHBondContact O-N 2.88Å; N177-R179 PolarHBondContact O-N 3.22Å; N177-Q180 PolarHBondContact O-N 3.11Å; N177-L181 PolarHBondContact O-N 3.36Å
178	S	83.4	Confident	75.2	Confident	8 Å²	8	75.7 Å²	75.7	6%	0.056	38%	0.383	C	S	.	.	H	α-helix	trans	-62	-32.9	177.3	71.3	0	0	0	0	112.4	K175 E176 L182	K175-S178 PolarHBondContact N-OG 2.66Å; K175-S178 PolarHBondContact O-N 3.23Å; K175-S178 PolarHBondContact O-OG 3.2Å; E176-S178 PolarHBondContact O-N 2.89Å; S178-L182 WeakPolarHBondContact O-CB 3.33Å; S178-L182 WeakPolarHBondContact O-CD1 3.42Å; S178-L182 VanDerWaalsContact O-CG 3.22Å; S178-L182 WeakPolarHBondContact O-CG 3.47Å; S178-L182 PolarHBondContact O-N 3.14Å
179	R	82.8	Confident	77.1	Confident	58 Å²	58	73.4 Å²	73.4	22%	0.219	37%	0.374	C	S	.	.	H	α-helix	trans	-70	-40.8	176.8	-63.6	173.4	69.3	-160.6	10.1	111.9	F174 K175 E176 N177 K183	F174-R179 HydrophobicContact CB-CG 3.65Å; K175-R179 PolarHBondContact O-N 3.01Å; K175-R179 VanDerWaalsContact O-N 3.14Å; E176-R179 WeakPolarHBondContact O-CB 3.48Å; E176-R179 PolarHBondContact O-N 3.03Å; E176-R179 VanDerWaalsContact O-N 3.09Å; E176-R179 IonicContact OE2-CZ 3.28Å; E176-R179 IonicContact OE2-NE 2.88Å; E176-R179 IonicContact OE2-NH1 3.93Å; E176-R179 PolarHBondContact OE2-NH1 3.3Å; N177-R179 PolarHBondContact O-N 3.22Å; R179-K183 WeakPolarHBondContact O-CG 3.49Å; R179-K183 PolarHBondContact O-N 3.26Å
180	Q	85.6	Confident	79.3	Confident	110 Å²	110	73.4 Å²	73.4	51%	0.514	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-45.7	177	-69	178.9	17.8	0	0	110.6	E176 N177 L182 K183 Q184	E176-Q180 WeakPolarHBondContact O-CG 3.4Å; E176-Q180 PolarHBondContact O-N 2.94Å; N177-Q180 PolarHBondContact O-N 3.11Å; Q180-L182 PolarHBondContact O-N 2.94Å; Q180-K183 WeakPolarHBondContact O-CB 3.18Å; Q180-K183 PolarHBondContact O-N 3.03Å; Q180-K183 VanDerWaalsContact O-N 3.14Å; Q180-Q184 PolarHBondContact O-N 3.29Å
181	L	90.3	Very high	81.2	Confident	37 Å²	37	76.9 Å²	76.9	19%	0.194	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-42.3	178.8	-170	58.4	0	0	0	112.3	N177 K183 Q184 F185 K203 C204	N177-L181 PolarHBondContact O-N 3.36Å; L181-K183 VanDerWaalsContact C-N 3.33Å; L181-K183 PolarHBondContact O-N 3.28Å; L181-Q184 WeakPolarHBondContact O-CB 3.22Å; L181-Q184 PolarHBondContact O-N 3.3Å; L181-F185 HydrophobicContact CD1-CD2 4.07Å; L181-F185 HydrophobicContact CD1-CE2 3.56Å; L181-F185 HydrophobicContact CD1-CZ 4.32Å; L181-F185 HydrophobicContact CD2-CE2 4.17Å; L181-F185 HydrophobicContact CG-CD2 3.92Å; L181-F185 HydrophobicContact CG-CE2 3.58Å; L181-F185 WeakPolarHBondContact O-CD2 3.46Å; L181-F185 PolarHBondContact O-N 3.02Å; L181-K203 HydrophobicContact CD2-CB 3.98Å; L181-C204 HydrophobicContact CD2-CB 4.45Å; L181-C204 VanDerWaalsContact CD2-SG 3.53Å
182	L	90.7	Very high	83.2	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-39.8	172.7	-76.4	167.2	0	0	0	112.7	F174 S178 Q180 Y186 I200 L206 V211 W214 F215	F174-L182 HydrophobicContact CD1-CD1 4.39Å; F174-L182 HydrophobicContact CE1-CD1 4.47Å; S178-L182 WeakPolarHBondContact O-CB 3.33Å; S178-L182 WeakPolarHBondContact O-CD1 3.42Å; S178-L182 VanDerWaalsContact O-CG 3.22Å; S178-L182 WeakPolarHBondContact O-CG 3.47Å; S178-L182 PolarHBondContact O-N 3.14Å; Q180-L182 PolarHBondContact O-N 2.94Å; L182-Y186 VanDerWaalsContact O-CB 3.3Å; L182-Y186 WeakPolarHBondContact O-CB 3.22Å; L182-Y186 PolarHBondContact O-N 3.35Å; L182-I200 HydrophobicContact CD2-CG2 3.75Å; L182-L206 HydrophobicContact CD1-CD1 3.71Å; L182-L206 HydrophobicContact CG-CD1 4.33Å; L182-V211 HydrophobicContact CD2-CG1 4.17Å; L182-V211 HydrophobicContact CD2-CG2 4.35Å; L182-W214 HydrophobicContact CB-CD2 4.01Å; L182-W214 HydrophobicContact CB-CE3 4.11Å; L182-W214 HydrophobicContact CB-CH2 3.82Å; L182-W214 HydrophobicContact CB-CZ2 3.67Å; L182-W214 HydrophobicContact CB-CZ3 4.03Å; L182-W214 HydrophobicContact CD1-CD2 3.95Å; L182-W214 HydrophobicContact CD1-CG 3.84Å; L182-W214 HydrophobicContact CD2-CD2 4.2Å; L182-W214 HydrophobicContact CD2-CE3 4.09Å; L182-W214 HydrophobicContact CG-CD2 4.29Å; L182-W214 VanDerWaalsContact O-CH2 3.28Å; L182-W214 WeakPolarHBondContact O-CH2 3.41Å; L182-W214 WeakPolarHBondContact O-CZ3 3.37Å; L182-F215 HydrophobicContact CD2-CE2 4.11Å
183	K	90.4	Very high	85	Confident	118 Å²	118	71.9 Å²	71.9	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-65.1	-40	175.5	-74.4	172.3	-178.9	173.1	0	111.8	R179 Q180 L181 Y186 G187 W214	R179-K183 WeakPolarHBondContact O-CG 3.49Å; R179-K183 PolarHBondContact O-N 3.26Å; Q180-K183 WeakPolarHBondContact O-CB 3.18Å; Q180-K183 PolarHBondContact O-N 3.03Å; Q180-K183 VanDerWaalsContact O-N 3.14Å; L181-K183 VanDerWaalsContact C-N 3.33Å; L181-K183 PolarHBondContact O-N 3.28Å; K183-Y186 PolarHBondContact O-N 2.87Å; K183-G187 PolarHBondContact O-N 2.96Å; K183-W214 HydrophobicContact CG-CZ2 4.3Å
184	Q	92.5	Very high	86.6	Confident	116 Å²	116	70.4 Å²	70.4	54%	0.542	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-54.2	176.1	-177.2	-178.8	-4.8	0	0	110.8	Q180 L181 Y186 G187 E188	Q180-Q184 PolarHBondContact O-N 3.29Å; L181-Q184 WeakPolarHBondContact O-CB 3.22Å; L181-Q184 PolarHBondContact O-N 3.3Å; Q184-Y186 PolarHBondContact O-N 3.35Å; Q184-G187 WeakPolarHBondContact O-CA 3.43Å; Q184-G187 PolarHBondContact O-N 3.05Å; Q184-E188 PolarHBondContact O-N 3.29Å
185	F	92.3	Very high	88.3	Confident	27 Å²	27	75 Å²	75	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-59.3	-35.4	177.3	-77.7	-62.8	0	0	0	113.2	L181 G187 E188 N189 I200 K203 F215	L181-F185 HydrophobicContact CD1-CD2 4.07Å; L181-F185 HydrophobicContact CD1-CE2 3.56Å; L181-F185 HydrophobicContact CD1-CZ 4.32Å; L181-F185 HydrophobicContact CD2-CE2 4.17Å; L181-F185 HydrophobicContact CG-CD2 3.92Å; L181-F185 HydrophobicContact CG-CE2 3.58Å; L181-F185 WeakPolarHBondContact O-CD2 3.46Å; L181-F185 PolarHBondContact O-N 3.02Å; F185-G187 VanDerWaalsContact C-N 3.32Å; F185-E188 PolarHBondContact O-N 2.9Å; F185-N189 PolarHBondContact O-N 3.45Å; F185-I200 HydrophobicContact CB-CD1 3.87Å; F185-I200 HydrophobicContact CB-CG1 4.14Å; F185-I200 HydrophobicContact CD1-CD1 4.13Å; F185-I200 HydrophobicContact CD1-CG1 3.81Å; F185-I200 HydrophobicContact CD2-CB 4.29Å; F185-I200 HydrophobicContact CD2-CD1 4.41Å; F185-I200 HydrophobicContact CD2-CG1 3.74Å; F185-I200 HydrophobicContact CD2-CG2 3.83Å; F185-I200 HydrophobicContact CE1-CG1 4.13Å; F185-I200 HydrophobicContact CE2-CB 4.49Å; F185-I200 HydrophobicContact CE2-CG1 4.04Å; F185-I200 HydrophobicContact CE2-CG2 4.31Å; F185-I200 HydrophobicContact CG-CD1 3.9Å; F185-I200 HydrophobicContact CG-CG1 3.63Å; F185-I200 HydrophobicContact CG-CG2 4.36Å; F185-I200 HydrophobicContact CZ-CG1 4.25Å; F185-K203 HydrophobicContact CE2-CD 4.12Å; F185-K203 HydrophobicContact CZ-CD 3.56Å; F185-F215 HydrophobicContact CB-CZ 4.18Å
186	Y	92.8	Very high	89.5	Confident	9 Å²	9	72.3 Å²	72.3	4%	0.035	37%	0.369	C	S	.	.	H	α-helix	trans	-66.5	-33.8	175.4	-169.8	-90	0	0	0	113.3	L182 K183 Q184 E188 K190 W214 F215 R218 R219 E222	L182-Y186 VanDerWaalsContact O-CB 3.3Å; L182-Y186 WeakPolarHBondContact O-CB 3.22Å; L182-Y186 PolarHBondContact O-N 3.35Å; K183-Y186 PolarHBondContact O-N 2.87Å; Q184-Y186 PolarHBondContact O-N 3.35Å; Y186-E188 VanDerWaalsContact C-N 3.33Å; Y186-K190 HydrophobicContact CD1-CG 4.35Å; Y186-K190 HydrophobicContact CE1-CD 4Å; Y186-K190 HydrophobicContact CE1-CG 3.83Å; Y186-K190 HydrophobicContact CE2-CB 4.23Å; Y186-K190 HydrophobicContact CE2-CG 4.34Å; Y186-W214 HydrophobicContact CD2-CH2 4.3Å; Y186-W214 AromaticContact CD2-CZ3 3.77Å; Y186-W214 HydrophobicContact CD2-CZ3 3.77Å; Y186-W214 HydrophobicContact CG-CH2 4.17Å; Y186-W214 HydrophobicContact CG-CZ3 4.04Å; Y186-F215 AromaticContact CD2-CD1 3.62Å; Y186-F215 HydrophobicContact CD2-CD1 3.62Å; Y186-F215 AromaticContact CD2-CE1 3.68Å; Y186-F215 HydrophobicContact CD2-CE1 3.68Å; Y186-F215 HydrophobicContact CE2-CD1 4.17Å; Y186-F215 HydrophobicContact CG-CE1 4.39Å; Y186-R218 HydrophobicContact CD1-CG 4.07Å; Y186-R218 HydrophobicContact CD2-CB 4.21Å; Y186-R218 HydrophobicContact CD2-CG 3.7Å; Y186-R218 HydrophobicContact CE1-CG 3.84Å; Y186-R218 HydrophobicContact CE2-CB 3.86Å; Y186-R218 HydrophobicContact CE2-CG 3.43Å; Y186-R218 VanDerWaalsContact CE2-CG 3.43Å; Y186-R218 HydrophobicContact CG-CG 4.01Å; Y186-R218 VanDerWaalsContact CZ-CG 3.5Å; Y186-R219 HydrophobicContact CE2-CG 3.99Å; Y186-R219 WeakPolarHBondContact OH-CG 3.3Å; Y186-E222 WeakPolarHBondContact CE1-OE1 3.47Å; Y186-E222 PolarHBondContact OH-OE2 3.08Å
187	G	91.4	Very high	90.5	Very high	68 Å²	68	70.8 Å²	70.8	70%	0.701	36%	0.361	S	S	*	.	H	α-helix	trans	-66.5	-35.7	174.5	0	0	0	0	0	112.5	K183 Q184 F185	K183-G187 PolarHBondContact O-N 2.96Å; Q184-G187 WeakPolarHBondContact O-CA 3.43Å; Q184-G187 PolarHBondContact O-N 3.05Å; F185-G187 VanDerWaalsContact C-N 3.32Å
188	E	92.5	Very high	91.3	Very high	129 Å²	129	69.7 Å²	69.7	60%	0.603	35%	0.351	S	S	*	.	H	α-helix	trans	-72.9	-50.7	176	-66.1	172.8	-169.5	0	0	111.9	Q184 F185 Y186	Q184-E188 PolarHBondContact O-N 3.29Å; F185-E188 PolarHBondContact O-N 2.9Å; Y186-E188 VanDerWaalsContact C-N 3.33Å
189	N	90.9	Very high	91.8	Very high	53 Å²	53	72.3 Å²	72.3	28%	0.283	37%	0.366	S	S	.	.			trans	-145.4	114.2	-178.7	-175.8	0.7	0	0	0	111.9	F185 Y191 E196 F215	F185-N189 PolarHBondContact O-N 3.45Å; N189-Y191 VanDerWaalsContact C-N 3.27Å; N189-Y191 PolarHBondContact ND2-O 3.36Å; N189-Y191 PolarHBondContact O-N 3.46Å; N189-Y191 VanDerWaalsContact OD1-C 3.26Å; N189-Y191 PolarHBondContact OD1-N 3.29Å; N189-Y191 PolarHBondContact OD1-O 2.82Å; N189-E196 PolarHBondContact ND2-OE1 3.33Å; N189-E196 PolarHBondContact ND2-OE2 3.37Å; N189-F215 WeakPolarHBondContact O-CE1 3.39Å
190	K	92.7	Very high	92.3	Very high	98 Å²	98	69.8 Å²	69.8	43%	0.426	36%	0.357	S	S	.	.	S	Bend	trans	-73	-17.6	178.3	-60.2	-169.6	178.1	-161.6	0	113.9	Y186 P192 R219 E222	Y186-K190 HydrophobicContact CD1-CG 4.35Å; Y186-K190 HydrophobicContact CE1-CD 4Å; Y186-K190 HydrophobicContact CE1-CG 3.83Å; Y186-K190 HydrophobicContact CE2-CB 4.23Å; Y186-K190 HydrophobicContact CE2-CG 4.34Å; K190-P192 VanDerWaalsContact C-CD 3.49Å; K190-R219 PolarHBondContact O-NH1 3.47Å; K190-E222 IonicContact NZ-OE1 3.54Å; K190-E222 IonicContact NZ-OE2 3.57Å; K190-E222 PolarHBondContact NZ-OE2 2.87Å
191	Y	94.3	Very high	92.6	Very high	153 Å²	153	64.8 Å²	64.8	60%	0.6	33%	0.334	S	S	*	.	S	Bend	trans	-129	66.6	-176.8	-63.1	-85.7	0	0	0	110.6	N189 T193	N189-Y191 VanDerWaalsContact C-N 3.27Å; N189-Y191 PolarHBondContact ND2-O 3.36Å; N189-Y191 PolarHBondContact O-N 3.46Å; N189-Y191 VanDerWaalsContact OD1-C 3.26Å; N189-Y191 PolarHBondContact OD1-N 3.29Å; N189-Y191 PolarHBondContact OD1-O 2.82Å; Y191-T193 PolarHBondContact O-N 3.21Å
192	P	92.7	Very high	92.7	Very high	11 Å²	11	69.2 Å²	69.2	7%	0.071	36%	0.358	C	S	.	.			trans	-64.4	139.3	177.9	28.9	-36	0	0	0	110.6	K190 E196 K197 I200 F215	K190-P192 VanDerWaalsContact C-CD 3.49Å; P192-E196 WeakPolarHBondContact CA-OE2 3.2Å; P192-E196 HydrophobicContact CB-CB 3.85Å; P192-K197 HydrophobicContact CB-CG 4.02Å; P192-K197 HydrophobicContact CG-CG 3.78Å; P192-K197 VanDerWaalsContact O-CE 3.3Å; P192-K197 WeakPolarHBondContact O-CE 3.3Å; P192-I200 HydrophobicContact CB-CD1 4.26Å; P192-F215 VanDerWaalsContact CD-CD1 3.42Å; P192-F215 HydrophobicContact CG-CD1 3.58Å; P192-F215 HydrophobicContact CG-CD2 4.18Å; P192-F215 HydrophobicContact CG-CE1 3.54Å; P192-F215 HydrophobicContact CG-CE2 4.15Å; P192-F215 HydrophobicContact CG-CG 3.92Å; P192-F215 HydrophobicContact CG-CZ 3.85Å
193	T	94.2	Very high	92.8	Very high	81 Å²	81	75.6 Å²	75.6	50%	0.497	39%	0.386	S	S	.	.			trans	-61.1	166.6	169.3	60.8	0	0	0	0	110.9	Y191 E195 E196 K197	Y191-T193 PolarHBondContact O-N 3.21Å; T193-E195 PolarHBondContact O-N 2.9Å; T193-E196 WeakPolarHBondContact CB-OE2 3.43Å; T193-E196 WeakPolarHBondContact CG2-OE2 3.34Å; T193-E196 PolarHBondContact N-OE2 3.03Å; T193-E196 PolarHBondContact O-N 2.89Å; T193-E196 WeakPolarHBondContact OG1-CG 3.45Å; T193-E196 PolarHBondContact OG1-N 3.22Å; T193-E196 PolarHBondContact OG1-OE2 2.63Å; T193-K197 WeakPolarHBondContact O-CG 3.39Å; T193-K197 PolarHBondContact O-N 3.21Å
194	A	93.7	Very high	92.7	Very high	61 Å²	61	70.7 Å²	70.7	50%	0.504	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-34.2	177.5	0	0	0	0	0	112.1	K198 F208	A194-K198 PolarHBondContact O-N 3.42Å; A194-F208 WeakPolarHBondContact O-CE2 3.28Å
195	E	93	Very high	92.5	Very high	114 Å²	114	68.5 Å²	68.5	53%	0.533	37%	0.374	S	S	.	.	H	α-helix	trans	-74.6	-45.2	-179.5	-162.2	55.9	-149.4	0	0	111.8	T193 K197 K198 V199	T193-E195 PolarHBondContact O-N 2.9Å; E195-K197 VanDerWaalsContact C-N 3.26Å; E195-K197 PolarHBondContact O-N 3.12Å; E195-K198 WeakPolarHBondContact O-CB 3.28Å; E195-K198 PolarHBondContact O-N 2.95Å; E195-K198 IonicContact OE2-NZ 2.9Å; E195-K198 PolarHBondContact OE2-NZ 3.01Å; E195-V199 PolarHBondContact O-N 3.41Å; E195-V199 VanDerWaalsContact O-N 3.11Å
196	E	93.4	Very high	92.2	Very high	79 Å²	79	68.3 Å²	68.3	37%	0.369	38%	0.375	S	S	.	.	H	α-helix	trans	-58.3	-39.4	173.3	-71.1	165.8	125	0	0	111.5	N189 P192 T193 K198 V199 I200	N189-E196 PolarHBondContact ND2-OE1 3.33Å; N189-E196 PolarHBondContact ND2-OE2 3.37Å; P192-E196 WeakPolarHBondContact CA-OE2 3.2Å; P192-E196 HydrophobicContact CB-CB 3.85Å; T193-E196 WeakPolarHBondContact CB-OE2 3.43Å; T193-E196 WeakPolarHBondContact CG2-OE2 3.34Å; T193-E196 PolarHBondContact N-OE2 3.03Å; T193-E196 PolarHBondContact O-N 2.89Å; T193-E196 WeakPolarHBondContact OG1-CG 3.45Å; T193-E196 PolarHBondContact OG1-N 3.22Å; T193-E196 PolarHBondContact OG1-OE2 2.63Å; E196-K198 VanDerWaalsContact C-N 3.29Å; E196-K198 PolarHBondContact O-N 3.01Å; E196-V199 PolarHBondContact O-N 3.14Å; E196-I200 WeakPolarHBondContact O-CD1 3.38Å; E196-I200 WeakPolarHBondContact O-CG1 3.48Å; E196-I200 PolarHBondContact O-N 3.47Å
197	K	93.5	Very high	92	Very high	34 Å²	34	72.7 Å²	72.7	15%	0.148	40%	0.399	C	S	.	.	H	α-helix	trans	-61.5	-35	175.8	-76	177.1	-172.6	175.1	0	113.2	P192 T193 E195 A201 F208 V211 S212	P192-K197 HydrophobicContact CB-CG 4.02Å; P192-K197 HydrophobicContact CG-CG 3.78Å; P192-K197 VanDerWaalsContact O-CE 3.3Å; P192-K197 WeakPolarHBondContact O-CE 3.3Å; T193-K197 WeakPolarHBondContact O-CG 3.39Å; T193-K197 PolarHBondContact O-N 3.21Å; E195-K197 VanDerWaalsContact C-N 3.26Å; E195-K197 PolarHBondContact O-N 3.12Å; K197-A201 VanDerWaalsContact O-CB 3.28Å; K197-A201 WeakPolarHBondContact O-CB 3.44Å; K197-A201 PolarHBondContact O-N 2.73Å; K197-F208 HydrophobicContact CB-CD2 3.99Å; K197-F208 HydrophobicContact CB-CE2 3.53Å; K197-F208 HydrophobicContact CB-CZ 4.4Å; K197-F208 HydrophobicContact CD-CE2 4.19Å; K197-F208 HydrophobicContact CD-CZ 4.28Å; K197-V211 HydrophobicContact CB-CG1 4.5Å; K197-V211 HydrophobicContact CG-CG1 4.48Å; K197-S212 PolarHBondContact NZ-OG 3.25Å
198	K	94	Very high	92	Very high	100 Å²	100	73.3 Å²	73.3	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-67.6	-46.3	174.2	-69.7	178.1	-168.9	158.9	0	110.6	A194 E195 E196 I200 A201 D202 F208	A194-K198 PolarHBondContact O-N 3.42Å; E195-K198 WeakPolarHBondContact O-CB 3.28Å; E195-K198 PolarHBondContact O-N 2.95Å; E195-K198 IonicContact OE2-NZ 2.9Å; E195-K198 PolarHBondContact OE2-NZ 3.01Å; E196-K198 VanDerWaalsContact C-N 3.29Å; E196-K198 PolarHBondContact O-N 3.01Å; K198-I200 VanDerWaalsContact C-N 3.27Å; K198-I200 PolarHBondContact O-N 2.97Å; K198-A201 WeakPolarHBondContact O-CA 3.47Å; K198-A201 WeakPolarHBondContact O-CB 3.35Å; K198-A201 PolarHBondContact O-N 2.99Å; K198-D202 PolarHBondContact O-N 3.28Å; K198-F208 HydrophobicContact CG-CD2 3.83Å; K198-F208 HydrophobicContact CG-CE2 4.09Å
199	V	94.4	Very high	91.9	Very high	62 Å²	62	72 Å²	72	38%	0.376	38%	0.379	S	S	.	.	H	α-helix	trans	-57.9	-41.4	176.3	177	0	0	0	0	111.4	E195 E196 K203	E195-V199 PolarHBondContact O-N 3.41Å; E195-V199 VanDerWaalsContact O-N 3.11Å; E196-V199 PolarHBondContact O-N 3.14Å; V199-K203 HydrophobicContact CG1-CD 4.11Å; V199-K203 WeakPolarHBondContact O-CB 3.39Å; V199-K203 VanDerWaalsContact O-CG 3.3Å; V199-K203 WeakPolarHBondContact O-CG 3.36Å; V199-K203 PolarHBondContact O-N 3.45Å
200	I	92.9	Very high	91.8	Very high	6 Å²	6	72.5 Å²	72.5	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-66.5	-41.7	175.8	-64	164.2	0	0	0	110.9	L182 F185 P192 E196 K198 K203 C204 V211 F215	L182-I200 HydrophobicContact CD2-CG2 3.75Å; F185-I200 HydrophobicContact CB-CD1 3.87Å; F185-I200 HydrophobicContact CB-CG1 4.14Å; F185-I200 HydrophobicContact CD1-CD1 4.13Å; F185-I200 HydrophobicContact CD1-CG1 3.81Å; F185-I200 HydrophobicContact CD2-CB 4.29Å; F185-I200 HydrophobicContact CD2-CD1 4.41Å; F185-I200 HydrophobicContact CD2-CG1 3.74Å; F185-I200 HydrophobicContact CD2-CG2 3.83Å; F185-I200 HydrophobicContact CE1-CG1 4.13Å; F185-I200 HydrophobicContact CE2-CB 4.49Å; F185-I200 HydrophobicContact CE2-CG1 4.04Å; F185-I200 HydrophobicContact CE2-CG2 4.31Å; F185-I200 HydrophobicContact CG-CD1 3.9Å; F185-I200 HydrophobicContact CG-CG1 3.63Å; F185-I200 HydrophobicContact CG-CG2 4.36Å; F185-I200 HydrophobicContact CZ-CG1 4.25Å; P192-I200 HydrophobicContact CB-CD1 4.26Å; E196-I200 WeakPolarHBondContact O-CD1 3.38Å; E196-I200 WeakPolarHBondContact O-CG1 3.48Å; E196-I200 PolarHBondContact O-N 3.47Å; K198-I200 VanDerWaalsContact C-N 3.27Å; K198-I200 PolarHBondContact O-N 2.97Å; I200-K203 PolarHBondContact O-N 3.33Å; I200-C204 WeakPolarHBondContact O-CB 3.34Å; I200-C204 PolarHBondContact O-N 3.43Å; I200-C204 PolarHBondContact O-SG 3.48Å; I200-V211 HydrophobicContact CB-CG1 4.13Å; I200-V211 HydrophobicContact CG2-CG1 3.76Å; I200-V211 HydrophobicContact CG2-CG2 4.36Å; I200-F215 HydrophobicContact CD1-CE2 3.96Å; I200-F215 HydrophobicContact CD1-CZ 3.83Å; I200-F215 HydrophobicContact CG2-CE2 4.42Å
201	A	92.7	Very high	91.7	Very high	4 Å²	4	67.9 Å²	67.9	3%	0.033	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-47.1	177.2	0	0	0	0	0	111.3	K197 K198 C204 G205 L206 V211	K197-A201 VanDerWaalsContact O-CB 3.28Å; K197-A201 WeakPolarHBondContact O-CB 3.44Å; K197-A201 PolarHBondContact O-N 2.73Å; K198-A201 WeakPolarHBondContact O-CA 3.47Å; K198-A201 WeakPolarHBondContact O-CB 3.35Å; K198-A201 PolarHBondContact O-N 2.99Å; A201-C204 PolarHBondContact O-N 3.07Å; A201-G205 PolarHBondContact O-N 3.34Å; A201-L206 CarbonylContact C-O 3.57Å; A201-L206 WeakPolarHBondContact CB-O 3.36Å; A201-L206 PolarHBondContact O-N 2.97Å; A201-V211 HydrophobicContact CB-CG2 3.82Å
202	D	92.5	Very high	91.5	Very high	130 Å²	130	62 Å²	62	70%	0.695	34%	0.341	S	S	*	.	H	α-helix	trans	-63.9	-47	178.2	-65.7	-17.5	0	0	0	111.5	K198 C204 G205	K198-D202 PolarHBondContact O-N 3.28Å; D202-C204 PolarHBondContact O-N 2.76Å; D202-G205 PolarHBondContact O-N 2.72Å
203	K	91.4	Very high	91.4	Very high	134 Å²	134	64.1 Å²	64.1	58%	0.583	35%	0.352	S	S	*	.	H	α-helix	trans	-65.8	-36	179.2	-72.6	179.4	174.9	-176.6	0	113.3	L181 F185 V199 I200	L181-K203 HydrophobicContact CD2-CB 3.98Å; F185-K203 HydrophobicContact CE2-CD 4.12Å; F185-K203 HydrophobicContact CZ-CD 3.56Å; V199-K203 HydrophobicContact CG1-CD 4.11Å; V199-K203 WeakPolarHBondContact O-CB 3.39Å; V199-K203 VanDerWaalsContact O-CG 3.3Å; V199-K203 WeakPolarHBondContact O-CG 3.36Å; V199-K203 PolarHBondContact O-N 3.45Å; I200-K203 PolarHBondContact O-N 3.33Å
204	C	88.8	Confident	91.3	Very high	16 Å²	16	62.1 Å²	62.1	11%	0.108	34%	0.335	C	S	.	.	H	α-helix	trans	-83.5	-11.8	178.6	-66.2	0	0	0	0	113.3	L181 I200 A201 D202 L206	L181-C204 HydrophobicContact CD2-CB 4.45Å; L181-C204 VanDerWaalsContact CD2-SG 3.53Å; I200-C204 WeakPolarHBondContact O-CB 3.34Å; I200-C204 PolarHBondContact O-N 3.43Å; I200-C204 PolarHBondContact O-SG 3.48Å; A201-C204 PolarHBondContact O-N 3.07Å; D202-C204 PolarHBondContact O-N 2.76Å; C204-L206 HydrophobicContact CB-CB 4.3Å; C204-L206 HydrophobicContact CB-CD1 3.58Å; C204-L206 HydrophobicContact CB-CG 3.72Å
205	G	88	Confident	91.2	Very high	69 Å²	69	59.2 Å²	59.2	71%	0.711	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	35	-171.4	0	0	0	0	0	113.2	A201 D202	A201-G205 PolarHBondContact O-N 3.34Å; D202-G205 PolarHBondContact O-N 2.72Å
206	L	87	Confident	91	Very high	24 Å²	24	58 Å²	58	13%	0.126	30%	0.304	C	S	.	.			trans	-117	159.2	-175.3	-61.1	173.4	0	0	0	111.3	F174 L182 A201 C204 V211	F174-L206 HydrophobicContact CD1-CD1 3.52Å; F174-L206 HydrophobicContact CD1-CD2 3.51Å; F174-L206 HydrophobicContact CD1-CG 4.14Å; F174-L206 HydrophobicContact CE1-CD1 3.49Å; F174-L206 VanDerWaalsContact CE1-CD1 3.49Å; F174-L206 HydrophobicContact CE1-CD2 3.75Å; F174-L206 HydrophobicContact CE1-CG 4.16Å; L182-L206 HydrophobicContact CD1-CD1 3.71Å; L182-L206 HydrophobicContact CG-CD1 4.33Å; A201-L206 CarbonylContact C-O 3.57Å; A201-L206 WeakPolarHBondContact CB-O 3.36Å; A201-L206 PolarHBondContact O-N 2.97Å; C204-L206 HydrophobicContact CB-CB 4.3Å; C204-L206 HydrophobicContact CB-CD1 3.58Å; C204-L206 HydrophobicContact CB-CG 3.72Å; L206-V211 HydrophobicContact CB-CG2 4Å; L206-V211 HydrophobicContact CD1-CG2 4.3Å
207	N	88.9	Confident	90.8	Very high	101 Å²	101	57.3 Å²	57.3	54%	0.54	30%	0.302	S	S	.	.			trans	-72.1	141.5	170.8	-169.1	-14.1	0	0	0	110.1	L209 Q210 V211	N207-L209 PolarHBondContact O-N 3.1Å; N207-L209 VanDerWaalsContact O-N 3.11Å; N207-Q210 HydrophobicContact CB-CG 4.11Å; N207-Q210 WeakPolarHBondContact O-CA 3.47Å; N207-Q210 VanDerWaalsContact O-CB 3.3Å; N207-Q210 WeakPolarHBondContact O-CB 3.25Å; N207-Q210 PolarHBondContact O-N 3.1Å; N207-V211 PolarHBondContact O-N 3.41Å; N207-V211 VanDerWaalsContact O-N 3.13Å
208	F	90.6	Very high	90.6	Very high	80 Å²	80	60.2 Å²	60.2	35%	0.351	31%	0.313	S	S	.	.	H	α-helix	trans	-47.4	-41.7	175.4	174.9	-94.1	0	0	0	112.8	A194 K197 K198 Q210 V211 S212	A194-F208 WeakPolarHBondContact O-CE2 3.28Å; K197-F208 HydrophobicContact CB-CD2 3.99Å; K197-F208 HydrophobicContact CB-CE2 3.53Å; K197-F208 HydrophobicContact CB-CZ 4.4Å; K197-F208 HydrophobicContact CD-CE2 4.19Å; K197-F208 HydrophobicContact CD-CZ 4.28Å; K198-F208 HydrophobicContact CG-CD2 3.83Å; K198-F208 HydrophobicContact CG-CE2 4.09Å; F208-Q210 VanDerWaalsContact C-N 3.34Å; F208-Q210 PolarHBondContact O-N 3.28Å; F208-V211 PolarHBondContact O-N 2.81Å; F208-S212 WeakPolarHBondContact O-CB 3.33Å; F208-S212 PolarHBondContact O-N 3.21Å
209	L	90.4	Very high	90.4	Very high	103 Å²	103	57.8 Å²	57.8	54%	0.539	30%	0.301	S	S	.	.	H	α-helix	trans	-65.1	-37.1	178.4	-176.3	61.2	0	0	0	112.2	N207 S212 N213	N207-L209 PolarHBondContact O-N 3.1Å; N207-L209 VanDerWaalsContact O-N 3.11Å; L209-S212 PolarHBondContact O-N 3Å; L209-N213 VanDerWaalsContact O-CB 3.28Å; L209-N213 WeakPolarHBondContact O-CB 3.3Å; L209-N213 PolarHBondContact O-N 3.38Å; L209-N213 PolarHBondContact O-ND2 3.36Å
210	Q	88.3	Confident	89.9	Confident	63 Å²	63	60 Å²	60	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-45.3	176.5	-68.3	173.2	-60.3	0	0	110.5	F174 N207 F208 N213 W214	F174-Q210 HydrophobicContact CE1-CB 3.93Å; F174-Q210 HydrophobicContact CZ-CB 4Å; N207-Q210 HydrophobicContact CB-CG 4.11Å; N207-Q210 WeakPolarHBondContact O-CA 3.47Å; N207-Q210 VanDerWaalsContact O-CB 3.3Å; N207-Q210 WeakPolarHBondContact O-CB 3.25Å; N207-Q210 PolarHBondContact O-N 3.1Å; F208-Q210 VanDerWaalsContact C-N 3.34Å; F208-Q210 PolarHBondContact O-N 3.28Å; Q210-N213 PolarHBondContact O-N 2.96Å; Q210-W214 VanDerWaalsContact O-CB 3.25Å; Q210-W214 WeakPolarHBondContact O-CB 3.49Å; Q210-W214 PolarHBondContact O-N 2.87Å
211	V	90.3	Very high	89.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-49.2	175.7	178.9	0	0	0	0	110.6	L182 K197 I200 A201 L206 N207 F208 N213 W214 F215	L182-V211 HydrophobicContact CD2-CG1 4.17Å; L182-V211 HydrophobicContact CD2-CG2 4.35Å; K197-V211 HydrophobicContact CB-CG1 4.5Å; K197-V211 HydrophobicContact CG-CG1 4.48Å; I200-V211 HydrophobicContact CB-CG1 4.13Å; I200-V211 HydrophobicContact CG2-CG1 3.76Å; I200-V211 HydrophobicContact CG2-CG2 4.36Å; A201-V211 HydrophobicContact CB-CG2 3.82Å; L206-V211 HydrophobicContact CB-CG2 4Å; L206-V211 HydrophobicContact CD1-CG2 4.3Å; N207-V211 PolarHBondContact O-N 3.41Å; N207-V211 VanDerWaalsContact O-N 3.13Å; F208-V211 PolarHBondContact O-N 2.81Å; V211-N213 VanDerWaalsContact C-N 3.33Å; V211-N213 PolarHBondContact O-N 3.47Å; V211-W214 WeakPolarHBondContact O-CB 3.44Å; V211-W214 PolarHBondContact O-N 3.44Å; V211-W214 VanDerWaalsContact O-N 3.1Å; V211-F215 HydrophobicContact CG1-CD2 3.78Å; V211-F215 HydrophobicContact CG1-CE2 3.77Å; V211-F215 WeakPolarHBondContact O-CD2 3.44Å; V211-F215 PolarHBondContact O-N 3.43Å
212	S	91	Very high	88.7	Confident	30 Å²	30	68.2 Å²	68.2	21%	0.21	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-44.5	179.3	-166.9	0	0	0	0	112.1	K197 F208 L209 K216	K197-S212 PolarHBondContact NZ-OG 3.25Å; F208-S212 WeakPolarHBondContact O-CB 3.33Å; F208-S212 PolarHBondContact O-N 3.21Å; L209-S212 PolarHBondContact O-N 3Å; S212-K216 WeakPolarHBondContact O-CB 3.31Å; S212-K216 PolarHBondContact O-N 3.38Å; S212-K216 VanDerWaalsContact O-N 3.1Å
213	N	90.5	Very high	87.9	Confident	56 Å²	56	68.4 Å²	68.4	30%	0.299	33%	0.333	S	S	.	.	H	α-helix	trans	-67.2	-37.9	175.3	-79.4	-32.7	0	0	0	112.5	L209 Q210 V211 K216 N217	L209-N213 VanDerWaalsContact O-CB 3.28Å; L209-N213 WeakPolarHBondContact O-CB 3.3Å; L209-N213 PolarHBondContact O-N 3.38Å; L209-N213 PolarHBondContact O-ND2 3.36Å; Q210-N213 PolarHBondContact O-N 2.96Å; V211-N213 VanDerWaalsContact C-N 3.33Å; V211-N213 PolarHBondContact O-N 3.47Å; N213-K216 PolarHBondContact O-N 2.9Å; N213-K216 PolarHBondContact OD1-NZ 3.39Å; N213-N217 WeakPolarHBondContact O-CB 3.34Å; N213-N217 PolarHBondContact O-N 3.45Å; N213-N217 PolarHBondContact O-ND2 3.33Å; N213-N217 PolarHBondContact O-OD1 3.05Å
214	W	91.1	Very high	86.3	Confident	38 Å²	38	66.9 Å²	66.9	14%	0.144	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-49.2	177.4	-174.5	100.2	0	0	0	111.1	L182 K183 Y186 Q210 V211 K216 N217 R218	L182-W214 HydrophobicContact CB-CD2 4.01Å; L182-W214 HydrophobicContact CB-CE3 4.11Å; L182-W214 HydrophobicContact CB-CH2 3.82Å; L182-W214 HydrophobicContact CB-CZ2 3.67Å; L182-W214 HydrophobicContact CB-CZ3 4.03Å; L182-W214 HydrophobicContact CD1-CD2 3.95Å; L182-W214 HydrophobicContact CD1-CG 3.84Å; L182-W214 HydrophobicContact CD2-CD2 4.2Å; L182-W214 HydrophobicContact CD2-CE3 4.09Å; L182-W214 HydrophobicContact CG-CD2 4.29Å; L182-W214 VanDerWaalsContact O-CH2 3.28Å; L182-W214 WeakPolarHBondContact O-CH2 3.41Å; L182-W214 WeakPolarHBondContact O-CZ3 3.37Å; K183-W214 HydrophobicContact CG-CZ2 4.3Å; Y186-W214 HydrophobicContact CD2-CH2 4.3Å; Y186-W214 AromaticContact CD2-CZ3 3.77Å; Y186-W214 HydrophobicContact CD2-CZ3 3.77Å; Y186-W214 HydrophobicContact CG-CH2 4.17Å; Y186-W214 HydrophobicContact CG-CZ3 4.04Å; Q210-W214 VanDerWaalsContact O-CB 3.25Å; Q210-W214 WeakPolarHBondContact O-CB 3.49Å; Q210-W214 PolarHBondContact O-N 2.87Å; V211-W214 WeakPolarHBondContact O-CB 3.44Å; V211-W214 PolarHBondContact O-N 3.44Å; V211-W214 VanDerWaalsContact O-N 3.1Å; W214-K216 VanDerWaalsContact C-N 3.33Å; W214-K216 PolarHBondContact O-N 3.08Å; W214-N217 PolarHBondContact O-N 3.43Å; W214-R218 HydrophobicContact CE3-CB 4.35Å; W214-R218 HydrophobicContact CH2-CB 4.36Å; W214-R218 HydrophobicContact CH2-CG 4.1Å; W214-R218 HydrophobicContact CZ3-CB 4.18Å; W214-R218 HydrophobicContact CZ3-CG 4.27Å; W214-R218 VanDerWaalsContact O-CB 3.31Å; W214-R218 WeakPolarHBondContact O-CB 3.37Å; W214-R218 PolarHBondContact O-N 3.44Å
215	F	91.8	Very high	84.6	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.2	-41.9	177	-88	-92.9	0	0	0	111.8	L182 F185 Y186 N189 P192 I200 V211 R218 R219	L182-F215 HydrophobicContact CD2-CE2 4.11Å; F185-F215 HydrophobicContact CB-CZ 4.18Å; Y186-F215 AromaticContact CD2-CD1 3.62Å; Y186-F215 HydrophobicContact CD2-CD1 3.62Å; Y186-F215 AromaticContact CD2-CE1 3.68Å; Y186-F215 HydrophobicContact CD2-CE1 3.68Å; Y186-F215 HydrophobicContact CE2-CD1 4.17Å; Y186-F215 HydrophobicContact CG-CE1 4.39Å; N189-F215 WeakPolarHBondContact O-CE1 3.39Å; P192-F215 VanDerWaalsContact CD-CD1 3.42Å; P192-F215 HydrophobicContact CG-CD1 3.58Å; P192-F215 HydrophobicContact CG-CD2 4.18Å; P192-F215 HydrophobicContact CG-CE1 3.54Å; P192-F215 HydrophobicContact CG-CE2 4.15Å; P192-F215 HydrophobicContact CG-CG 3.92Å; P192-F215 HydrophobicContact CG-CZ 3.85Å; I200-F215 HydrophobicContact CD1-CE2 3.96Å; I200-F215 HydrophobicContact CD1-CZ 3.83Å; I200-F215 HydrophobicContact CG2-CE2 4.42Å; V211-F215 HydrophobicContact CG1-CD2 3.78Å; V211-F215 HydrophobicContact CG1-CE2 3.77Å; V211-F215 WeakPolarHBondContact O-CD2 3.44Å; V211-F215 PolarHBondContact O-N 3.43Å; F215-R218 PolarHBondContact O-N 3.37Å; F215-R219 WeakPolarHBondContact O-CG 3.4Å; F215-R219 PolarHBondContact O-N 2.9Å; F215-R219 VanDerWaalsContact O-N 3.08Å
216	K	89.1	Confident	82.7	Confident	89 Å²	89	72.5 Å²	72.5	39%	0.387	36%	0.358	S	S	.	.	H	α-helix	trans	-58.9	-52.1	175.1	-175.6	-176.1	75.1	-164.5	0	111.5	S212 N213 W214 R218 R219 Q220	S212-K216 WeakPolarHBondContact O-CB 3.31Å; S212-K216 PolarHBondContact O-N 3.38Å; S212-K216 VanDerWaalsContact O-N 3.1Å; N213-K216 PolarHBondContact O-N 2.9Å; N213-K216 PolarHBondContact OD1-NZ 3.39Å; W214-K216 VanDerWaalsContact C-N 3.33Å; W214-K216 PolarHBondContact O-N 3.08Å; K216-R218 VanDerWaalsContact C-N 3.33Å; K216-R218 PolarHBondContact O-N 3.04Å; K216-R219 PolarHBondContact O-N 3.19Å; K216-Q220 WeakPolarHBondContact O-CG 3.45Å; K216-Q220 PolarHBondContact O-N 3.46Å
217	N	89.1	Confident	81	Confident	64 Å²	64	76.6 Å²	76.6	34%	0.342	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-35.5	-178.4	-68.1	-9.3	0	0	0	111.6	N213 W214 Q220 R221	N213-N217 WeakPolarHBondContact O-CB 3.34Å; N213-N217 PolarHBondContact O-N 3.45Å; N213-N217 PolarHBondContact O-ND2 3.33Å; N213-N217 PolarHBondContact O-OD1 3.05Å; W214-N217 PolarHBondContact O-N 3.43Å; N217-Q220 PolarHBondContact O-N 2.99Å; N217-R221 WeakPolarHBondContact O-CG 3.44Å; N217-R221 PolarHBondContact O-N 3.38Å
218	R	89	Confident	79.4	Confident	95 Å²	95	78.8 Å²	78.8	36%	0.358	40%	0.396	S	S	.	.	H	α-helix	trans	-63.3	-48.3	176.5	-177.1	63.9	-176.8	122.8	-0.2	111.1	Y186 W214 F215 K216 Q220 R221 E222	Y186-R218 HydrophobicContact CD1-CG 4.07Å; Y186-R218 HydrophobicContact CD2-CB 4.21Å; Y186-R218 HydrophobicContact CD2-CG 3.7Å; Y186-R218 HydrophobicContact CE1-CG 3.84Å; Y186-R218 HydrophobicContact CE2-CB 3.86Å; Y186-R218 HydrophobicContact CE2-CG 3.43Å; Y186-R218 VanDerWaalsContact CE2-CG 3.43Å; Y186-R218 HydrophobicContact CG-CG 4.01Å; Y186-R218 VanDerWaalsContact CZ-CG 3.5Å; W214-R218 HydrophobicContact CE3-CB 4.35Å; W214-R218 HydrophobicContact CH2-CB 4.36Å; W214-R218 HydrophobicContact CH2-CG 4.1Å; W214-R218 HydrophobicContact CZ3-CB 4.18Å; W214-R218 HydrophobicContact CZ3-CG 4.27Å; W214-R218 VanDerWaalsContact O-CB 3.31Å; W214-R218 WeakPolarHBondContact O-CB 3.37Å; W214-R218 PolarHBondContact O-N 3.44Å; F215-R218 PolarHBondContact O-N 3.37Å; K216-R218 VanDerWaalsContact C-N 3.33Å; K216-R218 PolarHBondContact O-N 3.04Å; R218-Q220 VanDerWaalsContact C-N 3.32Å; R218-Q220 PolarHBondContact O-N 2.88Å; R218-R221 PolarHBondContact O-N 3.4Å; R218-E222 IonicContact CZ-OE1 3.5Å; R218-E222 IonicContact NE-OE1 2.76Å; R218-E222 IonicContact NH1-OE1 3.92Å; R218-E222 IonicContact NH2-OE1 3.3Å; R218-E222 PolarHBondContact NH2-OE1 3.43Å; R218-E222 PolarHBondContact O-N 3.04Å
219	R	91	Very high	77.2	Confident	49 Å²	49	78.4 Å²	78.4	19%	0.185	40%	0.403	C	S	.	.	H	α-helix	trans	-60.7	-39.5	174.7	-71.7	-168.5	-58.8	-88.7	-2.3	112.6	Y186 K190 F215 K216 E222 K223	Y186-R219 HydrophobicContact CE2-CG 3.99Å; Y186-R219 WeakPolarHBondContact OH-CG 3.3Å; K190-R219 PolarHBondContact O-NH1 3.47Å; F215-R219 WeakPolarHBondContact O-CG 3.4Å; F215-R219 PolarHBondContact O-N 2.9Å; F215-R219 VanDerWaalsContact O-N 3.08Å; K216-R219 PolarHBondContact O-N 3.19Å; R219-E222 PolarHBondContact O-N 3.33Å; R219-K223 WeakPolarHBondContact O-CG 3.14Å; R219-K223 PolarHBondContact O-N 3.24Å; R219-K223 VanDerWaalsContact O-N 3.13Å
220	Q	83.3	Confident	75	Confident	108 Å²	108	83.8 Å²	83.8	51%	0.505	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-44.3	175	-75.8	178.5	-19.6	0	0	111.6	K216 N217 R218 E222 K223 C224	K216-Q220 WeakPolarHBondContact O-CG 3.45Å; K216-Q220 PolarHBondContact O-N 3.46Å; N217-Q220 PolarHBondContact O-N 2.99Å; R218-Q220 VanDerWaalsContact C-N 3.32Å; R218-Q220 PolarHBondContact O-N 2.88Å; Q220-E222 VanDerWaalsContact C-N 3.33Å; Q220-E222 PolarHBondContact O-N 3.36Å; Q220-K223 PolarHBondContact O-N 3.21Å; Q220-C224 PolarHBondContact O-N 3.47Å; Q220-C224 PolarHBondContact O-SG 2.61Å; Q220-C224 VanDerWaalsContact O-SG 3.35Å
221	R	79.9	Confident	73.2	Confident	136 Å²	136	86.4 Å²	86.4	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-64.9	-34.9	177.5	-69.3	176	-163	-102.1	6.3	112.7	Y172 N217 R218 C224 C225	Y172-R221 PolarHBondContact OH-NH2 3.13Å; N217-R221 WeakPolarHBondContact O-CG 3.44Å; N217-R221 PolarHBondContact O-N 3.38Å; R218-R221 PolarHBondContact O-N 3.4Å; R221-C224 PolarHBondContact O-N 3.35Å; R221-C225 PolarHBondContact O-N 3.3Å
222	E	80.7	Confident	71.2	Confident	47 Å²	47	95.7 Å²	95.7	22%	0.22	48%	0.477	C	S	.	.	H	α-helix	trans	-64.4	-46	174.6	-68.9	-166.4	159.9	0	0	111.8	Y186 K190 R218 R219 Q220 C224 C225	Y186-E222 WeakPolarHBondContact CE1-OE1 3.47Å; Y186-E222 PolarHBondContact OH-OE2 3.08Å; K190-E222 IonicContact NZ-OE1 3.54Å; K190-E222 IonicContact NZ-OE2 3.57Å; K190-E222 PolarHBondContact NZ-OE2 2.87Å; R218-E222 IonicContact CZ-OE1 3.5Å; R218-E222 IonicContact NE-OE1 2.76Å; R218-E222 IonicContact NH1-OE1 3.92Å; R218-E222 IonicContact NH2-OE1 3.3Å; R218-E222 PolarHBondContact NH2-OE1 3.43Å; R218-E222 PolarHBondContact O-N 3.04Å; R219-E222 PolarHBondContact O-N 3.33Å; Q220-E222 VanDerWaalsContact C-N 3.33Å; Q220-E222 PolarHBondContact O-N 3.36Å; E222-C224 PolarHBondContact O-N 3.04Å; E222-C225 PolarHBondContact O-N 3.44Å
223	K	75.2	Confident	69.1	Low	134 Å²	134	103.1 Å²	103.1	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-58.4	-34	177.2	-68.1	177.1	-178.7	-167.9	0	113	R219 Q220 C225	R219-K223 WeakPolarHBondContact O-CG 3.14Å; R219-K223 PolarHBondContact O-N 3.24Å; R219-K223 VanDerWaalsContact O-N 3.13Å; Q220-K223 PolarHBondContact O-N 3.21Å; K223-C225 VanDerWaalsContact C-N 3.3Å; K223-C225 PolarHBondContact O-N 3.49Å
224	C	57.6	Low	67	Low	102 Å²	102	111.3 Å²	111.3	69%	0.689	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.5	179.5	-64.3	0	0	0	0	114.2	Q220 R221 E222	Q220-C224 PolarHBondContact O-N 3.47Å; Q220-C224 PolarHBondContact O-SG 2.61Å; Q220-C224 VanDerWaalsContact O-SG 3.35Å; R221-C224 PolarHBondContact O-N 3.35Å; E222-C224 PolarHBondContact O-N 3.04Å
225	C	53.3	Low	64.9	Low	102 Å²	102	119.8 Å²	119.8	69%	0.689	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-4.5	179	-78.3	0	0	0	0	113.9	R221 E222 K223 P227	R221-C225 PolarHBondContact O-N 3.3Å; E222-C225 PolarHBondContact O-N 3.44Å; K223-C225 VanDerWaalsContact C-N 3.3Å; K223-C225 PolarHBondContact O-N 3.49Å; C225-P227 VanDerWaalsContact O-CD 3.26Å; C225-P227 WeakPolarHBondContact O-CD 3.26Å
226	D	49	Very low	63.6	Low	101 Å²	101	125.8 Å²	125.8	54%	0.54	62%	0.62	S	S	.	*			trans	-80.1	112.2	171.2	-74.2	-39.5	0	0	0	110.4	I228 S229	D226-I228 PolarHBondContact O-N 3Å; D226-S229 PolarHBondContact O-OG 3.43Å
227	P	51	Low	62.2	Low	110 Å²	110	127.7 Å²	127.7	71%	0.714	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-10.8	-178.3	-18.5	31.8	0	0	0	114.1	C225	C225-P227 VanDerWaalsContact O-CD 3.26Å; C225-P227 WeakPolarHBondContact O-CD 3.26Å
228	I	54.8	Low	60.7	Low	147 Å²	147	131.2 Å²	131.2	75%	0.754	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-15.4	-166.2	-59.9	173.6	0	0	0	112.4	D226	D226-I228 PolarHBondContact O-N 3Å
229	S	45.5	Very low	59.1	Low	72 Å²	72	133.4 Å²	133.4	50%	0.503	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-83.5	-18.9	-178.3	60.1	0	0	0	0	114.7	D226 V231	D226-S229 PolarHBondContact O-OG 3.43Å; S229-V231 VanDerWaalsContact C-N 3.28Å; S229-V231 PolarHBondContact O-N 3.29Å
230	R	43.5	Very low	57.1	Low	216 Å²	216	138.6 Å²	138.6	82%	0.815	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-76.5	-5.4	-177	-72.1	-167.5	-173.9	-157.3	2.8	115.4
231	V	50.5	Low	55.3	Low	119 Å²	119	140.7 Å²	140.7	72%	0.721	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-95.1	-12.6	-175.3	-177.5	0	0	0	0	112.9	S229	S229-V231 VanDerWaalsContact C-N 3.28Å; S229-V231 PolarHBondContact O-N 3.29Å
232	K	48.6	Very low	53.6	Low	195 Å²	195	141 Å²	141	85%	0.848	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	4.6	-174.2	-78.7	-172.4	175.2	-177	0	116.7
233	E	47	Very low	51.5	Low	186 Å²	186	148.2 Å²	148.2	87%	0.869	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	22.8	177.1	-78.7	177.8	160.5	0	0	113.5
234	R	45.8	Very low	49.5	Very low	228 Å²	228	149.4 Å²	149.4	86%	0.86	78%	0.776	S	S	*	*			trans	-128.9	63.6	170	-65.4	-168.1	-162.3	-164.2	4.7	111.4
235	V	47.7	Very low	48.8	Very low	215 Å²	215	153.7 Å²	153.7	100%	1.303	78%	0.783	S	S	*	*			trans	-142.7	0	156.3	-177.7	0	0	0	0	107.3

Retrieved 235 of 235 residues in 286.3 ms (Link to these results)

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