A0A087XSU2_POEFO Loading...

NADH dehydrogenase [ubiquinone] iron-sulfur protein 2, mitochondrial

AlphaFold DB , UniProt , Accession A0A087XSU2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 467 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	42.9	Very low	32.8	Very low	250 Å²	250	163.1 Å²	163.1	100%	1.232	88%	0.881	S	S	*	*				0	72.9	0	-77.3	-174.7	-113.5	0	0	108.6
2	A	26.3	Very low	32.6	Very low	103 Å²	103	163.8 Å²	163.8	85%	0.851	88%	0.882	S	S	*	*			trans	-109.9	104.2	-169.9	0	0	0	0	0	109.1
3	A	33.8	Very low	33.3	Very low	97 Å²	97	157.8 Å²	157.8	80%	0.802	88%	0.882	S	S	*	*			trans	-147.6	51.6	169.1	0	0	0	0	0	109.1
4	T	40.9	Very low	33	Very low	138 Å²	138	151.2 Å²	151.2	85%	0.847	87%	0.868	S	S	*	*			trans	-148.2	26	-178	38.8	0	0	0	0	114.3
5	M	31.4	Very low	33.5	Very low	171 Å²	171	158.1 Å²	158.1	84%	0.842	87%	0.874	S	S	*	*			trans	-137.7	40.6	-176	-86.2	-93.1	-137.7	0	0	113.4
6	L	29.3	Very low	33.5	Very low	180 Å²	180	155.1 Å²	155.1	94%	0.942	86%	0.864	S	S	*	*			trans	-127	46.9	172.6	-83.9	164.3	0	0	0	111.3
7	R	32.6	Very low	33.2	Very low	248 Å²	248	152.2 Å²	152.2	94%	0.936	86%	0.857	S	S	*	*	S	Bend	trans	-141.8	52.7	173.5	-105.7	-167.5	-174	-175.4	2.7	111.4
8	S	31.2	Very low	33.2	Very low	91 Å²	91	151.9 Å²	151.9	64%	0.636	85%	0.853	S	S	*	*	S	Bend	trans	-172.2	111.9	165.4	51.8	0	0	0	0	108.1
9	L	28.6	Very low	33.4	Very low	166 Å²	166	151.7 Å²	151.7	87%	0.869	85%	0.85	S	S	*	*			trans	150.1	32.9	158.2	-78	157.5	0	0	0	112.4	R11	L9-R11 VanDerWaalsContact C-N 3.32Å
10	S	29.2	Very low	33.1	Very low	127 Å²	127	151.3 Å²	151.3	89%	0.888	85%	0.851	S	S	*	*			trans	-97.2	30.5	163.1	58.4	0	0	0	0	112.7
11	R	34.6	Very low	33.2	Very low	223 Å²	223	151.9 Å²	151.9	84%	0.842	85%	0.851	S	S	*	*			trans	-133.2	105	165.6	-77.7	-173.9	-178.6	-175.8	0.2	107.5	L9	L9-R11 VanDerWaalsContact C-N 3.32Å
12	L	30.5	Very low	32.7	Very low	171 Å²	171	148.4 Å²	148.4	90%	0.895	84%	0.837	S	S	*	*			trans	171	107	137.5	-89.7	160.1	0	0	0	106.4	G14	L12-G14 PolarHBondContact O-N 2.76Å
13	G	41.4	Very low	32.7	Very low	86 Å²	86	151.1 Å²	151.1	89%	0.887	84%	0.836	S	S	*	*			trans	-61.1	132.9	165	0	0	0	0	0	109.2
14	G	28.7	Very low	32.8	Very low	66 Å²	66	156.5 Å²	156.5	68%	0.68	84%	0.842	S	S	*	*			trans	176.8	113.2	175.3	0	0	0	0	0	108.3	L12 P16	L12-G14 PolarHBondContact O-N 2.76Å; G14-P16 WeakPolarHBondContact O-CD 3.41Å
15	R	41.2	Very low	32.4	Very low	254 Å²	254	154.9 Å²	154.9	96%	0.958	84%	0.836	S	S	*	*			trans	-57.3	143.2	171.8	-70.1	176.7	171.6	179	-3.3	109.9
16	P	33.4	Very low	32.4	Very low	110 Å²	110	154.9 Å²	154.9	71%	0.714	84%	0.839	S	S	*	*			trans	-134.3	116.2	138.3	31.2	-15	0	0	0	109.8	G14	G14-P16 WeakPolarHBondContact O-CD 3.41Å
17	S	28.6	Very low	32.6	Very low	106 Å²	106	153.7 Å²	153.7	74%	0.741	83%	0.832	S	S	*	*				51.3	105.7	85.5	72.8	0	0	0	0	114.5
18	N	33.1	Very low	32.8	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	82%	0.816	S	S	*	*	S	Bend	trans	30.6	132.5	148	-69	-6.3	0	0	0	121.4
19	N	37.4	Very low	33.3	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	83%	0.828	S	S	*	*			trans	72.2	99.8	146.5	-64.8	-18.1	0	0	0	118.7
20	V	27.5	Very low	33.7	Very low	144 Å²	144	142.2 Å²	142.2	87%	0.873	81%	0.808	S	S	*	*			trans	-142.1	99.5	137.3	-175.7	0	0	0	0	111
21	L	34.2	Very low	34.3	Very low	164 Å²	164	139 Å²	139	86%	0.859	78%	0.784	S	S	*	*			trans	1.4	116.5	149.2	-65.6	155.7	0	0	0	118.8
22	L	32.4	Very low	34.5	Very low	177 Å²	177	132.1 Å²	132.1	93%	0.927	77%	0.77	S	S	*	*			trans	-77	125.2	161.8	-83.5	162.1	0	0	0	110.9
23	N	27.9	Very low	35.1	Very low	159 Å²	159	130.5 Å²	130.5	85%	0.85	76%	0.762	S	S	*	*			trans	-63.5	133	179.1	-104.4	-22.8	0	0	0	113.1	S25	N23-S25 PolarHBondContact O-N 2.69Å
24	K	34	Very low	35.3	Very low	211 Å²	211	131.8 Å²	131.8	92%	0.917	75%	0.748	S	S	*	*	S	Bend	trans	-79.5	84.3	175.3	-69.8	174.7	174.9	176.6	0	111.4
25	S	32.6	Very low	36.1	Very low	103 Å²	103	134.1 Å²	134.1	72%	0.72	74%	0.741	S	S	*	*			trans	-162	24.8	168	65.6	0	0	0	0	117.2	N23	N23-S25 PolarHBondContact O-N 2.69Å
26	L	33	Very low	36.2	Very low	172 Å²	172	126.9 Å²	126.9	90%	0.901	72%	0.721	S	S	*	*			trans	-135.3	74	170.9	-76.9	168.8	0	0	0	110.2
27	L	33.1	Very low	37	Very low	154 Å²	154	130.1 Å²	130.1	81%	0.806	72%	0.719	S	S	*	*			trans	-104.3	93	171.8	-73.2	168.6	0	0	0	109.1	C31	L27-C31 HydrophobicContact CD2-CB 4.26Å
28	S	36.3	Very low	38.2	Very low	84 Å²	84	132.8 Å²	132.8	59%	0.587	72%	0.72	S	S	*	*			trans	-71.8	148.4	158.2	64.8	0	0	0	0	109	G30 C31	S28-G30 PolarHBondContact O-N 3.23Å; S28-C31 PolarHBondContact O-N 3.49Å
29	P	41	Very low	39.4	Very low	139 Å²	139	133.9 Å²	133.9	90%	0.903	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	20.7	-178.1	32.1	-34.3	0	0	0	113
30	G	37.9	Very low	41.3	Very low	42 Å²	42	132.8 Å²	132.8	43%	0.433	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.3	4.1	169.3	0	0	0	0	0	113.6	S28 S32	S28-G30 PolarHBondContact O-N 3.23Å; G30-S32 PolarHBondContact O-N 2.69Å; G30-S32 VanDerWaalsContact O-N 3.13Å
31	C	41.1	Very low	43.9	Very low	59 Å²	59	133.2 Å²	133.2	40%	0.399	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	21.5	-178.2	-157.6	0	0	0	0	114.4	L27 S28	L27-C31 HydrophobicContact CD2-CB 4.26Å; S28-C31 PolarHBondContact O-N 3.49Å
32	S	39.2	Very low	46.2	Very low	78 Å²	78	131.1 Å²	131.1	55%	0.545	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.8	-22.1	169.7	56.5	0	0	0	0	113	G30	G30-S32 PolarHBondContact O-N 2.69Å; G30-S32 VanDerWaalsContact O-N 3.13Å
33	L	42.2	Very low	48.6	Very low	137 Å²	137	126 Å²	126	72%	0.717	66%	0.657	S	S	*	*	H	α-helix	trans	-82.9	-22.5	176.5	-86	162	0	0	0	113.5
34	L	47	Very low	51.4	Low	113 Å²	113	123.6 Å²	123.6	59%	0.592	64%	0.644	S	S	*	*	H	α-helix	trans	-80.8	-22.2	172.1	-72	171.1	0	0	0	112.8	R37 Q38	L34-R37 PolarHBondContact O-N 3.01Å; L34-Q38 WeakPolarHBondContact O-CG 3.23Å; L34-Q38 PolarHBondContact O-N 3.28Å
35	Q	44.4	Very low	53.8	Low	116 Å²	116	118.7 Å²	118.7	54%	0.542	63%	0.632	S	S	.	*	H	α-helix	trans	-71.7	-27.6	173.2	-77.5	-175.6	-16.9	0	0	113
36	N	44.8	Very low	56.3	Low	101 Å²	101	121.1 Å²	121.1	54%	0.54	63%	0.631	S	S	.	*	H	α-helix	trans	-85.5	-19.5	175.2	-83.3	-17.6	0	0	0	113.5	K39	N36-K39 PolarHBondContact O-N 3.22Å
37	R	48.9	Very low	58.8	Low	179 Å²	179	118.1 Å²	118.1	68%	0.675	61%	0.608	S	S	*	*	H	α-helix	trans	-77.9	-20.6	167.1	-76.2	-170.2	177.8	-174.3	-0	113.2	L34 K39 Q40	L34-R37 PolarHBondContact O-N 3.01Å; R37-K39 PolarHBondContact O-N 3.06Å; R37-Q40 PolarHBondContact O-N 3.41Å
38	Q	53.9	Low	61.2	Low	162 Å²	162	117.8 Å²	117.8	76%	0.757	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-16.1	167.8	-73.1	176.4	-12.4	0	0	113.3	L34	L34-Q38 WeakPolarHBondContact O-CG 3.23Å; L34-Q38 PolarHBondContact O-N 3.28Å
39	K	59.4	Low	63.5	Low	171 Å²	171	120.2 Å²	120.2	74%	0.743	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-11.3	175.1	-63.7	178.4	-179.7	170.2	0	113.3	N36 R37	N36-K39 PolarHBondContact O-N 3.22Å; R37-K39 PolarHBondContact O-N 3.06Å
40	Q	75.7	Confident	65.5	Low	123 Å²	123	119 Å²	119	58%	0.575	59%	0.589	S	S	*	*	S	Bend	trans	-82.1	120.8	177.2	-171.5	172	4.7	0	0	108	R37 Q42	R37-Q40 PolarHBondContact O-N 3.41Å; Q40-Q42 PolarHBondContact O-N 3.1Å
41	W	82.8	Confident	67.7	Low	153 Å²	153	123.6 Å²	123.6	58%	0.58	59%	0.594	S	S	*	*			trans	-53.3	125.6	-179.9	-178.9	83.8	0	0	0	110.4	P43 W47	W41-P43 HydrophobicContact CH2-CB 3.96Å; W41-P43 HydrophobicContact CZ3-CB 4.33Å; W41-W47 AromaticContact CH2-CD2 3.4Å; W41-W47 HydrophobicContact CH2-CD2 3.4Å; W41-W47 VanDerWaalsContact CH2-CD2 3.4Å; W41-W47 AromaticContact CH2-CE2 3.56Å; W41-W47 AromaticContact CH2-CE3 3.65Å; W41-W47 HydrophobicContact CH2-CE3 3.65Å; W41-W47 AromaticContact CH2-CG 3.8Å; W41-W47 HydrophobicContact CH2-CG 3.8Å; W41-W47 HydrophobicContact CH2-CH2 4.16Å; W41-W47 AromaticContact CH2-CZ2 3.95Å; W41-W47 HydrophobicContact CH2-CZ2 3.95Å; W41-W47 HydrophobicContact CH2-CZ3 4.02Å; W41-W47 AromaticContact CH2-NE1 3.99Å; W41-W47 AromaticContact CZ2-CD2 3.87Å; W41-W47 HydrophobicContact CZ2-CD2 3.87Å; W41-W47 AromaticContact CZ2-CE3 3.74Å; W41-W47 HydrophobicContact CZ2-CE3 3.74Å; W41-W47 HydrophobicContact CZ2-CG 4.21Å; W41-W47 HydrophobicContact CZ2-CZ3 4.22Å
42	Q	83.3	Confident	69.5	Low	121 Å²	121	123 Å²	123	57%	0.565	60%	0.598	S	S	*	*			trans	-108	145.4	171	-65.7	-62.1	-47.3	0	0	107.5	Q40 D44	Q40-Q42 PolarHBondContact O-N 3.1Å; Q42-D44 PolarHBondContact O-N 3.06Å
43	P	82.8	Confident	71.5	Confident	70 Å²	70	121.4 Å²	121.4	46%	0.455	59%	0.594	S	S	.	*			trans	-63.6	121.5	174	23.9	-30.8	0	0	0	110.4	W41 W47	W41-P43 HydrophobicContact CH2-CB 3.96Å; W41-P43 HydrophobicContact CZ3-CB 4.33Å; P43-W47 HydrophobicContact CB-CB 3.85Å; P43-W47 HydrophobicContact CB-CG 3.6Å
44	D	85.3	Confident	73.4	Confident	108 Å²	108	117.7 Å²	117.7	58%	0.578	58%	0.577	S	S	*	*			trans	-73.8	170.7	173.9	-61.5	-36.2	0	0	0	110.7	Q42 E46 W47 M48	Q42-D44 PolarHBondContact O-N 3.06Å; D44-E46 PolarHBondContact O-N 3Å; D44-W47 WeakPolarHBondContact O-CA 3.32Å; D44-W47 WeakPolarHBondContact O-CB 3.38Å; D44-W47 PolarHBondContact O-N 2.94Å; D44-M48 PolarHBondContact O-N 3.11Å; D44-M48 VanDerWaalsContact O-N 3.11Å
45	V	85.8	Confident	75.2	Confident	107 Å²	107	114.3 Å²	114.3	65%	0.648	56%	0.561	S	S	*	*	H	α-helix	trans	-55.4	-40	-179.8	179	0	0	0	0	111.6	W47 M48 E49	V45-W47 VanDerWaalsContact C-N 3.28Å; V45-W47 PolarHBondContact O-N 3.25Å; V45-M48 PolarHBondContact O-N 3.17Å; V45-M48 VanDerWaalsContact O-N 3.09Å; V45-E49 HydrophobicContact CG1-CG 4.36Å; V45-E49 WeakPolarHBondContact O-CG 3.34Å; V45-E49 PolarHBondContact O-N 3.14Å
46	E	84.6	Confident	77	Confident	154 Å²	154	113 Å²	113	72%	0.72	56%	0.555	S	S	*	*	H	α-helix	trans	-61	-35.6	176	-63.4	-178.1	179.9	0	0	112.6	D44 Q50	D44-E46 PolarHBondContact O-N 3Å; E46-Q50 WeakPolarHBondContact O-CG 3.5Å
47	W	85.4	Confident	79	Confident	109 Å²	109	117.1 Å²	117.1	41%	0.413	57%	0.565	S	S	.	*	H	α-helix	trans	-69.8	-37.5	175	-175.4	-83.7	0	0	0	111.3	W41 P43 D44 V45 Y51	W41-W47 AromaticContact CH2-CD2 3.4Å; W41-W47 HydrophobicContact CH2-CD2 3.4Å; W41-W47 VanDerWaalsContact CH2-CD2 3.4Å; W41-W47 AromaticContact CH2-CE2 3.56Å; W41-W47 AromaticContact CH2-CE3 3.65Å; W41-W47 HydrophobicContact CH2-CE3 3.65Å; W41-W47 AromaticContact CH2-CG 3.8Å; W41-W47 HydrophobicContact CH2-CG 3.8Å; W41-W47 HydrophobicContact CH2-CH2 4.16Å; W41-W47 AromaticContact CH2-CZ2 3.95Å; W41-W47 HydrophobicContact CH2-CZ2 3.95Å; W41-W47 HydrophobicContact CH2-CZ3 4.02Å; W41-W47 AromaticContact CH2-NE1 3.99Å; W41-W47 AromaticContact CZ2-CD2 3.87Å; W41-W47 HydrophobicContact CZ2-CD2 3.87Å; W41-W47 AromaticContact CZ2-CE3 3.74Å; W41-W47 HydrophobicContact CZ2-CE3 3.74Å; W41-W47 HydrophobicContact CZ2-CG 4.21Å; W41-W47 HydrophobicContact CZ2-CZ3 4.22Å; P43-W47 HydrophobicContact CB-CB 3.85Å; P43-W47 HydrophobicContact CB-CG 3.6Å; D44-W47 WeakPolarHBondContact O-CA 3.32Å; D44-W47 WeakPolarHBondContact O-CB 3.38Å; D44-W47 PolarHBondContact O-N 2.94Å; V45-W47 VanDerWaalsContact C-N 3.28Å; V45-W47 PolarHBondContact O-N 3.25Å; W47-Y51 AromaticContact CD1-CE2 3.89Å; W47-Y51 AromaticContact CE2-CE2 3.98Å; W47-Y51 HydrophobicContact CZ2-CE2 4.49Å; W47-Y51 AromaticContact NE1-CE2 3.46Å; W47-Y51 VanDerWaalsContact O-CD2 3.29Å; W47-Y51 WeakPolarHBondContact O-CD2 3.45Å
48	M	82.9	Confident	80.5	Confident	147 Å²	147	113.7 Å²	113.7	72%	0.724	57%	0.566	S	S	*	*	H	α-helix	trans	-73.9	-34.8	-178.8	-154.5	170.7	-166.8	0	0	112.5	D44 V45 Q50 Y51 G52	D44-M48 PolarHBondContact O-N 3.11Å; D44-M48 VanDerWaalsContact O-N 3.11Å; V45-M48 PolarHBondContact O-N 3.17Å; V45-M48 VanDerWaalsContact O-N 3.09Å; M48-Q50 VanDerWaalsContact C-N 3.26Å; M48-Q50 PolarHBondContact O-N 3.2Å; M48-Y51 PolarHBondContact O-N 3.4Å; M48-Y51 VanDerWaalsContact O-N 3.14Å; M48-G52 PolarHBondContact O-N 2.94Å
49	E	84.1	Confident	82.1	Confident	136 Å²	136	109.5 Å²	109.5	64%	0.636	55%	0.551	S	S	*	*	H	α-helix	trans	-63.6	-30	175.9	-74.8	179.7	-179.2	0	0	112.8	V45 Y51 G52	V45-E49 HydrophobicContact CG1-CG 4.36Å; V45-E49 WeakPolarHBondContact O-CG 3.34Å; V45-E49 PolarHBondContact O-N 3.14Å; E49-Y51 PolarHBondContact O-N 2.93Å; E49-G52 PolarHBondContact O-N 2.81Å; E49-G52 VanDerWaalsContact O-N 3.09Å
50	Q	84.1	Confident	83.1	Confident	113 Å²	113	110.5 Å²	110.5	53%	0.528	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	-27.5	174.2	-68.5	172.4	14.5	0	0	113	E46 M48	E46-Q50 WeakPolarHBondContact O-CG 3.5Å; M48-Q50 VanDerWaalsContact C-N 3.26Å; M48-Q50 PolarHBondContact O-N 3.2Å
51	Y	83.6	Confident	83.2	Confident	139 Å²	139	112.4 Å²	112.4	55%	0.545	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.4	-6.3	176.8	-64.7	-86.6	0	0	0	113.5	W47 M48 E49 M56	W47-Y51 AromaticContact CD1-CE2 3.89Å; W47-Y51 AromaticContact CE2-CE2 3.98Å; W47-Y51 HydrophobicContact CZ2-CE2 4.49Å; W47-Y51 AromaticContact NE1-CE2 3.46Å; W47-Y51 VanDerWaalsContact O-CD2 3.29Å; W47-Y51 WeakPolarHBondContact O-CD2 3.45Å; M48-Y51 PolarHBondContact O-N 3.4Å; M48-Y51 VanDerWaalsContact O-N 3.14Å; E49-Y51 PolarHBondContact O-N 2.93Å; Y51-M56 HydrophobicContact CD1-CE 3.64Å; Y51-M56 HydrophobicContact CD1-SD 3.76Å; Y51-M56 HydrophobicContact CE1-CE 3.35Å; Y51-M56 HydrophobicContact CE1-SD 4.01Å; Y51-M56 HydrophobicContact CG-CE 4.38Å
52	G	79.4	Confident	83	Confident	47 Å²	47	106.6 Å²	106.6	49%	0.485	55%	0.546	S	S	.	.	S	Bend	trans	-91.8	-3.9	-176.3	0	0	0	0	0	115	M48 E49	M48-G52 PolarHBondContact O-N 2.94Å; E49-G52 PolarHBondContact O-N 2.81Å; E49-G52 VanDerWaalsContact O-N 3.09Å
53	G	81.7	Confident	82.8	Confident	44 Å²	44	108.9 Å²	108.9	45%	0.454	55%	0.554	S	S	.	*	S	Bend	trans	-74.5	168	178	0	0	0	0	0	113.6	V55	G53-V55 PolarHBondContact O-N 3.22Å
54	V	81.3	Confident	82.9	Confident	59 Å²	59	112.2 Å²	112.2	36%	0.358	57%	0.568	S	S	.	*	S	Bend	trans	-62.3	-36	175.7	-168.8	0	0	0	0	112	W65 K66 V67	V54-W65 HydrophobicContact CB-CB 4.24Å; V54-W65 HydrophobicContact CG1-CB 4.01Å; V54-W65 HydrophobicContact CG1-CE3 4.16Å; V54-W65 HydrophobicContact CG2-CB 4.2Å; V54-W65 WeakPolarHBondContact CG2-O 3.33Å; V54-K66 WeakPolarHBondContact CG2-O 3.33Å; V54-V67 HydrophobicContact CG2-CB 4.43Å; V54-V67 HydrophobicContact CG2-CG2 3.91Å; V54-V67 VanDerWaalsContact CG2-N 3.27Å
55	V	84.6	Confident	82.9	Confident	42 Å²	42	113.4 Å²	113.4	26%	0.255	56%	0.564	S	S	.	*	S	Bend	trans	-133.9	146.1	-179.5	-67.6	0	0	0	0	109	G53 Y57 N62 W65	G53-V55 PolarHBondContact O-N 3.22Å; V55-Y57 VanDerWaalsContact C-N 3.27Å; V55-Y57 PolarHBondContact O-N 3.28Å; V55-N62 HydrophobicContact CG2-CB 4.1Å; V55-W65 HydrophobicContact CG1-CE3 3.77Å; V55-W65 HydrophobicContact CG1-CZ3 3.75Å
56	M	83.6	Confident	82.8	Confident	88 Å²	88	117.1 Å²	117.1	43%	0.433	57%	0.572	S	S	.	*	S	Bend	trans	-65.3	-30.1	-179	-167.9	67.4	-161.9	0	0	112.9	Y51	Y51-M56 HydrophobicContact CD1-CE 3.64Å; Y51-M56 HydrophobicContact CD1-SD 3.76Å; Y51-M56 HydrophobicContact CE1-CE 3.35Å; Y51-M56 HydrophobicContact CE1-SD 4.01Å; Y51-M56 HydrophobicContact CG-CE 4.38Å
57	Y	85.3	Confident	82.8	Confident	187 Å²	187	113.4 Å²	113.4	73%	0.733	56%	0.559	S	S	*	*	S	Bend	trans	-129.7	102.3	-179.8	-58.3	-73.3	0	0	0	110.1	V55 T59	V55-Y57 VanDerWaalsContact C-N 3.27Å; V55-Y57 PolarHBondContact O-N 3.28Å; Y57-T59 PolarHBondContact O-N 3.17Å
58	P	80.9	Confident	82.8	Confident	107 Å²	107	111.7 Å²	111.7	70%	0.695	56%	0.562	S	S	*	*			trans	-73.4	119.7	179.5	27.2	-31.7	0	0	0	110.9
59	T	86.9	Confident	83	Confident	75 Å²	75	106.7 Å²	106.7	46%	0.46	54%	0.541	S	S	.	.			trans	-102.3	168.7	171.3	58	0	0	0	0	110.5	Y57 F61 N62 K63	Y57-T59 PolarHBondContact O-N 3.17Å; T59-F61 PolarHBondContact O-N 2.87Å; T59-F61 VanDerWaalsContact O-N 3.14Å; T59-N62 PolarHBondContact O-N 3.17Å; T59-N62 VanDerWaalsContact O-N 3.1Å; T59-K63 PolarHBondContact O-N 3.23Å
60	E	80.5	Confident	83.2	Confident	191 Å²	191	112.1 Å²	112.1	89%	0.893	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-30.9	176.6	-65.9	-173.3	166	0	0	112.9
61	F	79.4	Confident	83.5	Confident	163 Å²	163	111.6 Å²	111.6	72%	0.715	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-40	176.9	-177.5	-106.2	0	0	0	113.2	T59 W65	T59-F61 PolarHBondContact O-N 2.87Å; T59-F61 VanDerWaalsContact O-N 3.14Å; F61-W65 HydrophobicContact CE1-CZ2 4.2Å
62	N	78.1	Confident	83.7	Confident	31 Å²	31	111.6 Å²	111.6	17%	0.166	57%	0.566	C	S	.	*	G	3₁₀ helix	trans	-90.7	1.3	-173.3	-67.5	-16.6	0	0	0	114	V55 T59 N64 W65	V55-N62 HydrophobicContact CG2-CB 4.1Å; T59-N62 PolarHBondContact O-N 3.17Å; T59-N62 VanDerWaalsContact O-N 3.1Å; N62-N64 PolarHBondContact O-N 3.24Å; N62-N64 VanDerWaalsContact O-N 3.16Å; N62-W65 HydrophobicContact CB-CD2 4.32Å; N62-W65 HydrophobicContact CB-CE3 4.32Å; N62-W65 PolarHBondContact O-N 2.82Å; N62-W65 WeakPolarHBondContact OD1-CH2 3.47Å; N62-W65 VanDerWaalsContact OD1-CZ2 3.32Å; N62-W65 WeakPolarHBondContact OD1-CZ2 3.18Å
63	K	79	Confident	83.9	Confident	170 Å²	170	116.6 Å²	116.6	74%	0.739	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-61.9	-25.5	-173.9	-166.9	173.3	-178.6	177.3	0	114	T59	T59-K63 PolarHBondContact O-N 3.23Å
64	N	84.4	Confident	84.2	Confident	140 Å²	140	120.6 Å²	120.6	75%	0.749	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-88.9	-4.3	-176.6	-65.7	-15.5	0	0	0	113.6	N62	N62-N64 PolarHBondContact O-N 3.24Å; N62-N64 VanDerWaalsContact O-N 3.16Å
65	W	85.7	Confident	84.4	Confident	132 Å²	132	123 Å²	123	50%	0.5	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-78.2	130	-178.1	-62.6	-0.2	0	0	0	110.4	V54 V55 F61 N62	V54-W65 HydrophobicContact CB-CB 4.24Å; V54-W65 HydrophobicContact CG1-CB 4.01Å; V54-W65 HydrophobicContact CG1-CE3 4.16Å; V54-W65 HydrophobicContact CG2-CB 4.2Å; V54-W65 WeakPolarHBondContact CG2-O 3.33Å; V55-W65 HydrophobicContact CG1-CE3 3.77Å; V55-W65 HydrophobicContact CG1-CZ3 3.75Å; F61-W65 HydrophobicContact CE1-CZ2 4.2Å; N62-W65 HydrophobicContact CB-CD2 4.32Å; N62-W65 HydrophobicContact CB-CE3 4.32Å; N62-W65 PolarHBondContact O-N 2.82Å; N62-W65 WeakPolarHBondContact OD1-CH2 3.47Å; N62-W65 VanDerWaalsContact OD1-CZ2 3.32Å; N62-W65 WeakPolarHBondContact OD1-CZ2 3.18Å
66	K	83.9	Confident	84.4	Confident	186 Å²	186	126.4 Å²	126.4	81%	0.809	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-101	148.5	177.9	-63.5	-178.7	-177.4	177.3	0	109.9	V54	V54-K66 WeakPolarHBondContact CG2-O 3.33Å
67	V	83.6	Confident	84.4	Confident	75 Å²	75	126 Å²	126	46%	0.455	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-59.3	131.9	174.9	-174.8	0	0	0	0	107.8	V54	V54-V67 HydrophobicContact CG2-CB 4.43Å; V54-V67 HydrophobicContact CG2-CG2 3.91Å; V54-V67 VanDerWaalsContact CG2-N 3.27Å
68	P	85.6	Confident	84	Confident	74 Å²	74	125.8 Å²	125.8	48%	0.481	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-57.2	147.4	176.8	24.8	-34	0	0	0	109.4	W70	P68-W70 PolarHBondContact O-N 3.19Å
69	P	88.2	Confident	83.9	Confident	42 Å²	42	129 Å²	129	27%	0.273	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-61.4	142.3	176.3	29.4	-35	0	0	0	109.3	N71 D72 K73	P69-N71 WeakPolarHBondContact CB-OD1 3.37Å; P69-N71 PolarHBondContact O-N 3.24Å; P69-D72 PolarHBondContact O-N 3.26Å; P69-K73 WeakPolarHBondContact CG-O 3.42Å
70	W	86.9	Confident	83.2	Confident	250 Å²	250	132.9 Å²	132.9	95%	0.947	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-16.7	-174.4	-59.3	101.6	0	0	0	115.4	P68	P68-W70 PolarHBondContact O-N 3.19Å
71	N	90.8	Very high	82.7	Confident	102 Å²	102	129.8 Å²	129.8	55%	0.545	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.7	6.2	178.8	63.6	-7.1	0	0	0	113.1	P69 K73	P69-N71 WeakPolarHBondContact CB-OD1 3.37Å; P69-N71 PolarHBondContact O-N 3.24Å; N71-K73 PolarHBondContact O-N 2.91Å; N71-K73 PolarHBondContact OD1-N 3.2Å; N71-K73 VanDerWaalsContact OD1-N 3.16Å; N71-K73 PolarHBondContact OD1-O 2.79Å
72	D	87.4	Confident	82.5	Confident	138 Å²	138	127.2 Å²	127.2	74%	0.738	66%	0.659	S	S	*	*	S	Bend	trans	51.1	22.2	-174.9	-59.6	-39.9	0	0	0	114.1	P69	P69-D72 PolarHBondContact O-N 3.26Å
73	K	85	Confident	82.8	Confident	152 Å²	152	128.2 Å²	128.2	66%	0.661	66%	0.664	S	S	*	*			trans	-119.9	112	178.8	-72.3	179	-178.3	-177.4	0	108.6	P69 N71	P69-K73 WeakPolarHBondContact CG-O 3.42Å; N71-K73 PolarHBondContact O-N 2.91Å; N71-K73 PolarHBondContact OD1-N 3.2Å; N71-K73 VanDerWaalsContact OD1-N 3.16Å; N71-K73 PolarHBondContact OD1-O 2.79Å
74	D	87.9	Confident	83.2	Confident	128 Å²	128	125.2 Å²	125.2	68%	0.684	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-56.9	143.2	166.4	-67.2	-36	0	0	0	109.3	P76	D74-P76 VanDerWaalsContact O-N 3.14Å
75	P	84.9	Confident	83.6	Confident	110 Å²	110	123.2 Å²	123.2	71%	0.714	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-54.2	126.4	170.5	24.3	-32.3	0	0	0	107.4	A77	P75-A77 PolarHBondContact O-N 3.42Å; P75-A77 VanDerWaalsContact O-N 3.09Å
76	P	84.7	Confident	83.9	Confident	113 Å²	113	119.7 Å²	119.7	73%	0.734	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-56.8	124.7	-178.7	23.6	-32.5	0	0	0	107.9	D74 E78	D74-P76 VanDerWaalsContact O-N 3.14Å; P76-E78 PolarHBondContact O-N 3.16Å
77	A	83.4	Confident	84.2	Confident	81 Å²	81	114.9 Å²	114.9	67%	0.669	62%	0.622	S	S	*	*			trans	-66.4	105.4	169.8	0	0	0	0	0	106.9	P75 K79	P75-A77 PolarHBondContact O-N 3.42Å; P75-A77 VanDerWaalsContact O-N 3.09Å; A77-K79 PolarHBondContact O-N 2.94Å
78	E	76.9	Confident	84.3	Confident	182 Å²	182	112.6 Å²	112.6	85%	0.85	61%	0.606	S	S	*	*			trans	-64.3	90.9	170.5	-68.6	-180	178.2	0	0	107.5	P76	P76-E78 PolarHBondContact O-N 3.16Å
79	K	78.1	Confident	84.1	Confident	175 Å²	175	110.2 Å²	110.2	76%	0.761	60%	0.595	S	S	*	*			trans	-89.2	107.8	170.4	-68.7	-176.5	-178.5	179.1	0	106.6	A77 V81	A77-K79 PolarHBondContact O-N 2.94Å; K79-V81 PolarHBondContact O-N 3.22Å
80	D	72.5	Confident	83.7	Confident	156 Å²	156	110.9 Å²	110.9	83%	0.834	60%	0.599	S	S	*	*			trans	-63.1	111.5	170.5	-68.3	-25.4	0	0	0	108.5	S82	D80-S82 PolarHBondContact O-N 2.88Å
81	V	70.4	Confident	83.5	Confident	125 Å²	125	108.4 Å²	108.4	76%	0.758	60%	0.598	S	S	*	*			trans	-72.3	110.6	173.3	-179	0	0	0	0	106.8	K79 N83	K79-V81 PolarHBondContact O-N 3.22Å; V81-N83 PolarHBondContact O-N 3.28Å
82	S	74.3	Confident	83.2	Confident	109 Å²	109	107.3 Å²	107.3	76%	0.762	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-65.9	118.6	172.5	57.9	0	0	0	0	109.1	D80	D80-S82 PolarHBondContact O-N 2.88Å
83	N	84.8	Confident	83.1	Confident	52 Å²	52	105.7 Å²	105.7	28%	0.278	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-63	149.1	171.2	-63.3	-33.8	0	0	0	109.6	V81 T85 L105 K111	V81-N83 PolarHBondContact O-N 3.28Å; N83-T85 PolarHBondContact O-N 3.06Å; N83-L105 WeakPolarHBondContact CB-O 3.46Å; N83-K111 WeakPolarHBondContact ND2-CD 3.47Å; N83-K111 PolarHBondContact OD1-NZ 2.87Å
84	L	89	Confident	83	Confident	108 Å²	108	98.8 Å²	98.8	57%	0.565	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.5	119.1	179.1	-176.8	124.8	0	0	0	108.9	I86 L105	L84-I86 HydrophobicContact CD2-CD1 3.51Å; L84-I86 HydrophobicContact CD2-CG1 3.27Å; L84-I86 HydrophobicContact CG-CG1 4.43Å; L84-L105 HydrophobicContact CD2-CD1 4.47Å; L84-L105 PolarHBondContact N-O 3.33Å; L84-L105 PolarHBondContact O-N 2.96Å
85	T	91.8	Very high	82.6	Confident	98 Å²	98	92.7 Å²	92.7	60%	0.601	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	113.8	177.1	58.5	0	0	0	0	110	N83 M103 E104	N83-T85 PolarHBondContact O-N 3.06Å; T85-M103 CarbonylContact C-O 2.97Å; T85-M103 WeakPolarHBondContact CA-O 3.3Å; T85-E104 HydrophobicContact CG2-CG 4.25Å
86	I	91.6	Very high	82.2	Confident	58 Å²	58	89.8 Å²	89.8	30%	0.297	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.6	174.1	-55.2	-165.7	0	0	0	109.3	L84 M103 L105	L84-I86 HydrophobicContact CD2-CD1 3.51Å; L84-I86 HydrophobicContact CD2-CG1 3.27Å; L84-I86 HydrophobicContact CG-CG1 4.43Å; I86-M103 PolarHBondContact N-O 3.02Å; I86-M103 PolarHBondContact O-N 3.37Å; I86-L105 HydrophobicContact CD1-CD1 3.41Å; I86-L105 VanDerWaalsContact CD1-CD1 3.41Å; I86-L105 HydrophobicContact CG1-CD1 3.81Å; I86-L105 HydrophobicContact CG1-CG 4.45Å
87	N	90.3	Very high	82	Confident	84 Å²	84	86.5 Å²	86.5	45%	0.449	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	102.1	167.9	-171.4	16.6	0	0	0	108.7	G89 R100	N87-G89 PolarHBondContact O-N 2.99Å; N87-G89 VanDerWaalsContact O-N 3.16Å; N87-R100 PolarHBondContact ND2-NE 2.95Å; N87-R100 VanDerWaalsContact OD1-CG 3.24Å; N87-R100 WeakPolarHBondContact OD1-CG 3.16Å; N87-R100 PolarHBondContact OD1-NE 3.31Å; N87-R100 VanDerWaalsContact OD1-NE 3.1Å
88	F	86.7	Confident	82.1	Confident	28 Å²	28	85.3 Å²	85.3	12%	0.123	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	97.2	169	-171.2	-93.4	0	0	0	107.2	H92 A94 A95 R100 L101 M103	F88-H92 HydrophobicContact CD1-CB 4.44Å; F88-H92 HydrophobicContact CE1-CB 3.82Å; F88-H92 AromaticContact CE1-CG 3.85Å; F88-H92 AromaticContact CE1-ND1 3.95Å; F88-H92 HydrophobicContact CE2-CB 4.27Å; F88-H92 AromaticContact CE2-CD2 3.45Å; F88-H92 VanDerWaalsContact CE2-CD2 3.45Å; F88-H92 WeakPolarHBondContact CE2-CD2 3.47Å; F88-H92 AromaticContact CE2-CE1 3.62Å; F88-H92 AromaticContact CE2-CG 3.53Å; F88-H92 AromaticContact CE2-ND1 3.64Å; F88-H92 AromaticContact CE2-NE2 3.53Å; F88-H92 HydrophobicContact CZ-CB 3.76Å; F88-H92 AromaticContact CZ-CD2 3.69Å; F88-H92 AromaticContact CZ-CE1 3.5Å; F88-H92 AromaticContact CZ-CG 3.23Å; F88-H92 AromaticContact CZ-ND1 3.11Å; F88-H92 WeakPolarHBondContact CZ-ND1 3.08Å; F88-H92 AromaticContact CZ-NE2 3.86Å; F88-A94 HydrophobicContact CZ-CB 4.26Å; F88-A95 HydrophobicContact CE1-CB 4.12Å; F88-R100 CarbonylContact O-C 3.55Å; F88-R100 WeakPolarHBondContact O-CA 3.1Å; F88-L101 HydrophobicContact CB-CB 4.04Å; F88-L101 WeakPolarHBondContact CB-O 3.15Å; F88-L101 HydrophobicContact CD1-CB 4.5Å; F88-L101 HydrophobicContact CD1-CD1 4.26Å; F88-L101 HydrophobicContact CD1-CG 4.48Å; F88-L101 PolarHBondContact N-O 2.9Å; F88-L101 PolarHBondContact O-N 3.49Å; F88-M103 HydrophobicContact CB-CE 3.77Å; F88-M103 HydrophobicContact CD2-CE 4.37Å; F88-M103 HydrophobicContact CG-CE 4.34Å
89	G	79.8	Confident	82.8	Confident	24 Å²	24	76.7 Å²	76.7	25%	0.247	43%	0.432	C	S	.	.			trans	-74	172.5	-167.5	0	0	0	0	0	114.1	N87 Q91 L99	N87-G89 PolarHBondContact O-N 2.99Å; N87-G89 VanDerWaalsContact O-N 3.16Å; G89-Q91 PolarHBondContact O-N 3Å; G89-Q91 VanDerWaalsContact O-N 3.14Å; G89-L99 CarbonylContact C-O 3.59Å
90	P	80.3	Confident	83.5	Confident	55 Å²	55	73.3 Å²	73.3	36%	0.357	42%	0.415	S	S	.	.	S	Bend	trans	-65	-22.2	-173.5	-16.1	28.2	0	0	0	114.3	H92 V98 L99 R100 L119	P90-H92 PolarHBondContact O-N 3.07Å; P90-V98 HydrophobicContact CB-CG1 3.58Å; P90-L99 WeakPolarHBondContact CA-O 3.49Å; P90-R100 HydrophobicContact CG-CB 4.48Å; P90-L119 HydrophobicContact CB-CD1 4.06Å; P90-L119 HydrophobicContact CG-CD1 3.96Å
91	Q	82.3	Confident	84.4	Confident	198 Å²	198	65.9 Å²	65.9	93%	0.925	38%	0.375	S	S	*	.			trans	-100.6	76.6	-178.8	-167.4	169.7	7.1	0	0	109.4	G89	G89-Q91 PolarHBondContact O-N 3Å; G89-Q91 VanDerWaalsContact O-N 3.14Å
92	H	85.8	Confident	85.5	Confident	79 Å²	79	61.5 Å²	61.5	37%	0.366	35%	0.349	S	S	.	.			trans	-139.8	136.4	172.6	-169.9	-76.8	0	0	0	110.1	F88 P90 A94 A95	F88-H92 HydrophobicContact CD1-CB 4.44Å; F88-H92 HydrophobicContact CE1-CB 3.82Å; F88-H92 AromaticContact CE1-CG 3.85Å; F88-H92 AromaticContact CE1-ND1 3.95Å; F88-H92 HydrophobicContact CE2-CB 4.27Å; F88-H92 AromaticContact CE2-CD2 3.45Å; F88-H92 VanDerWaalsContact CE2-CD2 3.45Å; F88-H92 WeakPolarHBondContact CE2-CD2 3.47Å; F88-H92 AromaticContact CE2-CE1 3.62Å; F88-H92 AromaticContact CE2-CG 3.53Å; F88-H92 AromaticContact CE2-ND1 3.64Å; F88-H92 AromaticContact CE2-NE2 3.53Å; F88-H92 HydrophobicContact CZ-CB 3.76Å; F88-H92 AromaticContact CZ-CD2 3.69Å; F88-H92 AromaticContact CZ-CE1 3.5Å; F88-H92 AromaticContact CZ-CG 3.23Å; F88-H92 AromaticContact CZ-ND1 3.11Å; F88-H92 WeakPolarHBondContact CZ-ND1 3.08Å; F88-H92 AromaticContact CZ-NE2 3.86Å; P90-H92 PolarHBondContact O-N 3.07Å; H92-A94 WeakPolarHBondContact ND1-CB 2.84Å; H92-A94 PolarHBondContact ND1-N 2.99Å; H92-A94 PolarHBondContact O-N 3.04Å; H92-A95 HydrophobicContact CB-CB 4.32Å; H92-A95 VanDerWaalsContact O-CB 3.25Å; H92-A95 WeakPolarHBondContact O-CB 3.27Å; H92-A95 PolarHBondContact O-N 3.07Å
93	P	84.4	Confident	86.4	Confident	105 Å²	105	56.4 Å²	56.4	68%	0.682	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-54	-47.7	-179.3	-27.7	35	0	0	0	113.8	A95 H96	P93-A95 PolarHBondContact O-N 3.24Å; P93-A95 VanDerWaalsContact O-N 3.07Å; P93-H96 PolarHBondContact O-N 2.86Å
94	A	82.6	Confident	86.9	Confident	6 Å²	6	57.1 Å²	57.1	5%	0.05	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-68.5	-2.7	178.2	0	0	0	0	0	115.3	F88 H92 H96 V452	F88-A94 HydrophobicContact CZ-CB 4.26Å; H92-A94 WeakPolarHBondContact ND1-CB 2.84Å; H92-A94 PolarHBondContact ND1-N 2.99Å; H92-A94 PolarHBondContact O-N 3.04Å; A94-H96 VanDerWaalsContact C-N 3.28Å; A94-V452 HydrophobicContact CB-CB 4.4Å; A94-V452 HydrophobicContact CB-CG1 3.63Å; A94-V452 HydrophobicContact CB-CG2 3.96Å
95	A	79.8	Confident	87.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-82.4	-4.2	173	0	0	0	0	0	112.6	F88 H92 P93 G97 L99 F462	F88-A95 HydrophobicContact CE1-CB 4.12Å; H92-A95 HydrophobicContact CB-CB 4.32Å; H92-A95 VanDerWaalsContact O-CB 3.25Å; H92-A95 WeakPolarHBondContact O-CB 3.27Å; H92-A95 PolarHBondContact O-N 3.07Å; P93-A95 PolarHBondContact O-N 3.24Å; P93-A95 VanDerWaalsContact O-N 3.07Å; A95-G97 PolarHBondContact O-N 3.28Å; A95-G97 VanDerWaalsContact O-N 3.07Å; A95-L99 HydrophobicContact CB-CB 4.11Å; A95-F462 WeakPolarHBondContact O-CE2 3.35Å
96	H	77.1	Confident	87	Confident	50 Å²	50	49.8 Å²	49.8	23%	0.231	28%	0.276	C	S	.	.	S	Bend	trans	37.7	51.2	-179.3	-75.5	-52.6	0	0	0	114.7	P93 A94 D197	P93-H96 PolarHBondContact O-N 2.86Å; A94-H96 VanDerWaalsContact C-N 3.28Å; H96-D197 IonicContact CD2-OD1 2.76Å; H96-D197 IonicContact CD2-OD2 3.08Å; H96-D197 PolarHBondContact CD2-OD2 3.49Å; H96-D197 IonicContact CE1-OD1 2.73Å; H96-D197 PolarHBondContact CE1-OD1 3.43Å; H96-D197 IonicContact CE1-OD2 3.88Å; H96-D197 IonicContact NE2-OD1 3.61Å; H96-D197 PolarHBondContact NE2-OD1 3.34Å; H96-D197 IonicContact NE2-OD2 3.19Å; H96-D197 PolarHBondContact NE2-OD2 3.44Å
97	G	80.6	Confident	86.9	Confident	44 Å²	44	50.3 Å²	50.3	45%	0.454	30%	0.296	S	S	.	.	S	Bend	trans	129.8	-125.4	-172.5	0	0	0	0	0	109.9	A95	A95-G97 PolarHBondContact O-N 3.28Å; A95-G97 VanDerWaalsContact O-N 3.07Å
98	V	85.9	Confident	86.9	Confident	56 Å²	56	53.2 Å²	53.2	34%	0.339	31%	0.306	S	S	.	.	S	Bend	trans	-133.8	84.6	-168	-166.7	0	0	0	0	108.5	P90 L119	P90-V98 HydrophobicContact CB-CG1 3.58Å; V98-L119 HydrophobicContact CB-CB 4.33Å; V98-L119 HydrophobicContact CG1-CB 3.68Å; V98-L119 HydrophobicContact CG1-CD1 3.59Å; V98-L119 HydrophobicContact CG1-CG 4.23Å
99	L	89.9	Confident	87.2	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.316	C	S	.	.			trans	-120.2	134.8	176.8	177.8	65.2	0	0	0	110	G89 P90 A95 L101 P115 I117 I455 F462	G89-L99 CarbonylContact C-O 3.59Å; P90-L99 WeakPolarHBondContact CA-O 3.49Å; A95-L99 HydrophobicContact CB-CB 4.11Å; L99-L101 HydrophobicContact CD1-CD2 4.03Å; L99-L101 HydrophobicContact CD2-CD1 3.84Å; L99-L101 HydrophobicContact CD2-CD2 3.65Å; L99-L101 HydrophobicContact CD2-CG 3.65Å; L99-L101 HydrophobicContact CG-CD2 3.88Å; L99-L101 HydrophobicContact CG-CG 3.87Å; L99-P115 HydrophobicContact CD1-CB 4.27Å; L99-I117 HydrophobicContact CD1-CG2 4.12Å; L99-I455 HydrophobicContact CD2-CD1 4.44Å; L99-F462 HydrophobicContact CB-CE1 3.9Å; L99-F462 HydrophobicContact CB-CE2 4.17Å; L99-F462 HydrophobicContact CB-CZ 3.58Å; L99-F462 HydrophobicContact CD1-CE1 3.78Å; L99-F462 HydrophobicContact CD1-CZ 4.16Å; L99-F462 HydrophobicContact CD2-CE1 4.35Å; L99-F462 HydrophobicContact CD2-CZ 3.92Å; L99-F462 HydrophobicContact CG-CE1 4.2Å; L99-F462 HydrophobicContact CG-CZ 4.08Å
100	R	93.3	Very high	87.9	Confident	104 Å²	104	53 Å²	53	39%	0.392	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.9	170.2	179.1	-175.3	178.3	-168.9	-4.2	109.2	N87 F88 P90 H116 L119	N87-R100 PolarHBondContact ND2-NE 2.95Å; N87-R100 VanDerWaalsContact OD1-CG 3.24Å; N87-R100 WeakPolarHBondContact OD1-CG 3.16Å; N87-R100 PolarHBondContact OD1-NE 3.31Å; N87-R100 VanDerWaalsContact OD1-NE 3.1Å; F88-R100 CarbonylContact O-C 3.55Å; F88-R100 WeakPolarHBondContact O-CA 3.1Å; P90-R100 HydrophobicContact CG-CB 4.48Å; R100-H116 HydrophobicContact CB-CB 4.09Å; R100-H116 HydrophobicContact CG-CB 4.34Å; R100-H116 PolarHBondContact N-O 2.93Å; R100-H116 PolarHBondContact O-N 3.1Å; R100-L119 HydrophobicContact CB-CD1 4.36Å
101	L	91.9	Very high	88.5	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	173.7	-58.7	172.5	0	0	0	109.9	F88 L99 M103 P115 L439 V451 I455	F88-L101 HydrophobicContact CB-CB 4.04Å; F88-L101 WeakPolarHBondContact CB-O 3.15Å; F88-L101 HydrophobicContact CD1-CB 4.5Å; F88-L101 HydrophobicContact CD1-CD1 4.26Å; F88-L101 HydrophobicContact CD1-CG 4.48Å; F88-L101 PolarHBondContact N-O 2.9Å; F88-L101 PolarHBondContact O-N 3.49Å; L99-L101 HydrophobicContact CD1-CD2 4.03Å; L99-L101 HydrophobicContact CD2-CD1 3.84Å; L99-L101 HydrophobicContact CD2-CD2 3.65Å; L99-L101 HydrophobicContact CD2-CG 3.65Å; L99-L101 HydrophobicContact CG-CD2 3.88Å; L99-L101 HydrophobicContact CG-CG 3.87Å; L101-M103 HydrophobicContact CB-CG 4.31Å; L101-P115 HydrophobicContact CD2-CB 3.5Å; L101-L439 HydrophobicContact CD1-CD2 4.41Å; L101-L439 HydrophobicContact CD2-CD2 3.71Å; L101-V451 HydrophobicContact CD1-CG1 4.35Å; L101-I455 HydrophobicContact CD1-CD1 3.62Å
102	V	94.3	Very high	89.1	Confident	32 Å²	32	49.4 Å²	49.4	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	112.8	167.8	175.3	0	0	0	0	107.3	D114	V102-D114 HydrophobicContact CB-CB 4.39Å; V102-D114 PolarHBondContact N-O 3.14Å; V102-D114 PolarHBondContact O-N 3.4Å
103	M	93.1	Very high	89.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.3	-177.3	-65.1	-179.4	-71.5	0	0	110.2	T85 I86 F88 L101 L105 K112 L448 V451	T85-M103 CarbonylContact C-O 2.97Å; T85-M103 WeakPolarHBondContact CA-O 3.3Å; I86-M103 PolarHBondContact N-O 3.02Å; I86-M103 PolarHBondContact O-N 3.37Å; F88-M103 HydrophobicContact CB-CE 3.77Å; F88-M103 HydrophobicContact CD2-CE 4.37Å; F88-M103 HydrophobicContact CG-CE 4.34Å; L101-M103 HydrophobicContact CB-CG 4.31Å; M103-L105 HydrophobicContact CB-CD2 4.11Å; M103-L105 HydrophobicContact CB-CG 4.45Å; M103-K112 WeakPolarHBondContact CA-O 3.35Å; M103-L448 HydrophobicContact CE-CD1 3.21Å; M103-L448 HydrophobicContact SD-CD1 3.72Å; M103-V451 HydrophobicContact SD-CG1 4.3Å; M103-V451 HydrophobicContact SD-CG2 4.42Å
104	E	94.1	Very high	89.9	Confident	67 Å²	67	43.1 Å²	43.1	31%	0.313	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.6	168	-58.2	-170.2	176.7	0	0	109	T85 K111 K112	T85-E104 HydrophobicContact CG2-CG 4.25Å; E104-K111 PolarHBondContact O-N 3.06Å; E104-K112 HydrophobicContact CB-CB 4.11Å; E104-K112 HydrophobicContact CG-CB 4.24Å; E104-K112 PolarHBondContact N-O 3.17Å; E104-K112 PolarHBondContact O-N 3.3Å
105	L	93.4	Very high	90.4	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.1	-176.6	-57.2	-175.2	0	0	0	111.6	N83 L84 I86 M103 S109 V110	N83-L105 WeakPolarHBondContact CB-O 3.46Å; L84-L105 HydrophobicContact CD2-CD1 4.47Å; L84-L105 PolarHBondContact N-O 3.33Å; L84-L105 PolarHBondContact O-N 2.96Å; I86-L105 HydrophobicContact CD1-CD1 3.41Å; I86-L105 VanDerWaalsContact CD1-CD1 3.41Å; I86-L105 HydrophobicContact CG1-CD1 3.81Å; I86-L105 HydrophobicContact CG1-CG 4.45Å; M103-L105 HydrophobicContact CB-CD2 4.11Å; M103-L105 HydrophobicContact CB-CG 4.45Å; L105-S109 WeakPolarHBondContact CA-O 3.47Å; L105-V110 HydrophobicContact CD2-CB 4.19Å; L105-V110 HydrophobicContact CD2-CG2 3.62Å
106	S	90.7	Very high	91	Very high	46 Å²	46	49 Å²	49	32%	0.322	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	89.1	168.6	173.2	0	0	0	0	108.3	E108 S109	S106-E108 PolarHBondContact O-N 3.28Å; S106-S109 PolarHBondContact N-O 3.44Å; S106-S109 PolarHBondContact O-N 3.28Å; S106-S109 PolarHBondContact O-OG 3.12Å
107	G	88.8	Confident	91.8	Very high	69 Å²	69	49.7 Å²	49.7	71%	0.711	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	-117.5	-166	0	0	0	0	0	109.9
108	E	90.7	Very high	92.4	Very high	145 Å²	145	49.4 Å²	49.4	68%	0.678	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-17.3	176.9	-63.1	-178	167.4	0	0	113.5	S106 M447 L448	S106-E108 PolarHBondContact O-N 3.28Å; E108-M447 WeakPolarHBondContact O-CA 3.11Å; E108-L448 PolarHBondContact O-N 2.85Å
109	S	93.1	Very high	92.7	Very high	45 Å²	45	51.3 Å²	51.3	32%	0.315	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	135.2	-176.9	64.8	0	0	0	0	111.8	L105 S106	L105-S109 WeakPolarHBondContact CA-O 3.47Å; S106-S109 PolarHBondContact N-O 3.44Å; S106-S109 PolarHBondContact O-N 3.28Å; S106-S109 PolarHBondContact O-OG 3.12Å
110	V	94.3	Very high	92.8	Very high	2 Å²	2	54 Å²	54	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.9	176.1	176.7	0	0	0	0	109.5	L105 C113 A443 G445 H446 V451	L105-V110 HydrophobicContact CD2-CB 4.19Å; L105-V110 HydrophobicContact CD2-CG2 3.62Å; V110-C113 WeakPolarHBondContact CG1-SG 3.37Å; V110-A443 HydrophobicContact CG1-CB 4.29Å; V110-G445 PolarHBondContact O-N 2.81Å; V110-H446 WeakPolarHBondContact CB-O 3.39Å; V110-H446 WeakPolarHBondContact CG2-O 3.47Å; V110-H446 PolarHBondContact N-O 3.14Å; V110-V451 HydrophobicContact CG2-CG2 3.71Å
111	K	93	Very high	92.9	Very high	100 Å²	100	54.5 Å²	54.5	44%	0.435	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-39.4	172.8	-78	-178.5	170.8	165.7	0	112.4	N83 E104	N83-K111 WeakPolarHBondContact ND2-CD 3.47Å; N83-K111 PolarHBondContact OD1-NZ 2.87Å; E104-K111 PolarHBondContact O-N 3.06Å
112	K	93.8	Very high	93	Very high	77 Å²	77	60.2 Å²	60.2	34%	0.335	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	138.2	-177.1	-167.4	-177.2	-176.8	-134.7	0	110.2	M103 E104 D114 D440	M103-K112 WeakPolarHBondContact CA-O 3.35Å; E104-K112 HydrophobicContact CB-CB 4.11Å; E104-K112 HydrophobicContact CG-CB 4.24Å; E104-K112 PolarHBondContact N-O 3.17Å; E104-K112 PolarHBondContact O-N 3.3Å; K112-D114 WeakPolarHBondContact CE-OD1 3.46Å; K112-D114 VanDerWaalsContact NZ-CG 3.31Å; K112-D114 IonicContact NZ-OD1 2.87Å; K112-D114 PolarHBondContact NZ-OD1 2.94Å; K112-D114 VanDerWaalsContact NZ-OD1 3.08Å; K112-D114 IonicContact NZ-OD2 3.71Å; K112-D114 PolarHBondContact NZ-OD2 3.45Å; K112-D440 WeakPolarHBondContact CA-OD1 3.41Å
113	C	92.9	Very high	93	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	115.5	173.5	-77.3	0	0	0	0	110.1	V110 P115 D440 A443	V110-C113 WeakPolarHBondContact CG1-SG 3.37Å; C113-P115 VanDerWaalsContact O-CD 3.23Å; C113-P115 WeakPolarHBondContact O-CD 3.33Å; C113-D440 PolarHBondContact N-OD1 3.35Å; C113-D440 WeakPolarHBondContact O-CB 3.23Å; C113-A443 HydrophobicContact CB-CB 4.39Å
114	D	94.4	Very high	93	Very high	52 Å²	52	59.7 Å²	59.7	28%	0.278	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	101.8	174.3	-68	-21.6	0	0	0	109.7	V102 K112 H116	V102-D114 HydrophobicContact CB-CB 4.39Å; V102-D114 PolarHBondContact N-O 3.14Å; V102-D114 PolarHBondContact O-N 3.4Å; K112-D114 WeakPolarHBondContact CE-OD1 3.46Å; K112-D114 VanDerWaalsContact NZ-CG 3.31Å; K112-D114 IonicContact NZ-OD1 2.87Å; K112-D114 PolarHBondContact NZ-OD1 2.94Å; K112-D114 VanDerWaalsContact NZ-OD1 3.08Å; K112-D114 IonicContact NZ-OD2 3.71Å; K112-D114 PolarHBondContact NZ-OD2 3.45Å; D114-H116 PolarHBondContact O-N 3.44Å
115	P	93.6	Very high	93.1	Very high	40 Å²	40	57.1 Å²	57.1	26%	0.26	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	111.6	174.3	28.9	-32.4	0	0	0	111.6	L99 L101 C113 L436 L439	L99-P115 HydrophobicContact CD1-CB 4.27Å; L101-P115 HydrophobicContact CD2-CB 3.5Å; C113-P115 VanDerWaalsContact O-CD 3.23Å; C113-P115 WeakPolarHBondContact O-CD 3.33Å; P115-L436 HydrophobicContact CB-CD1 4.12Å; P115-L436 HydrophobicContact CB-CD2 4.32Å; P115-L436 HydrophobicContact CB-CG 4.14Å; P115-L436 HydrophobicContact CG-CG 4.25Å; P115-L439 HydrophobicContact CB-CD2 4.32Å; P115-L439 HydrophobicContact CG-CD2 4.45Å
116	H	93.4	Very high	93.2	Very high	90 Å²	90	61.4 Å²	61.4	42%	0.417	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	113.4	168.4	-66.7	-71.5	0	0	0	110.3	R100 D114	R100-H116 HydrophobicContact CB-CB 4.09Å; R100-H116 HydrophobicContact CG-CB 4.34Å; R100-H116 PolarHBondContact N-O 2.93Å; R100-H116 PolarHBondContact O-N 3.1Å; D114-H116 PolarHBondContact O-N 3.44Å
117	I	93.3	Very high	93.5	Very high	65 Å²	65	62.7 Å²	62.7	33%	0.333	34%	0.335	S	S	.	.			trans	-109	-179.5	176.7	61.3	171.8	0	0	0	111.2	L99 F433 L436 V465 D466	L99-I117 HydrophobicContact CD1-CG2 4.12Å; I117-F433 HydrophobicContact CD1-CD2 4.15Å; I117-F433 HydrophobicContact CD1-CE2 3.77Å; I117-L436 HydrophobicContact CG2-CD2 3.29Å; I117-V465 HydrophobicContact CB-CG1 4.42Å; I117-V465 HydrophobicContact CD1-CG1 3.82Å; I117-V465 HydrophobicContact CG2-CG1 4.15Å; I117-D466 WeakPolarHBondContact CB-OD1 3.47Å
118	G	92.3	Very high	93.9	Very high	38 Å²	38	59.4 Å²	59.4	39%	0.392	30%	0.301	S	S	.	.			trans	99.2	1.3	179.9	0	0	0	0	0	114.3	L120 H121 D466	G118-L120 PolarHBondContact O-N 3.35Å; G118-H121 WeakPolarHBondContact O-CB 3.34Å; G118-H121 PolarHBondContact O-N 2.98Å; G118-D466 VanDerWaalsContact CA-CG 3.46Å; G118-D466 WeakPolarHBondContact CA-OD1 3.29Å; G118-D466 VanDerWaalsContact CA-OD2 3.24Å; G118-D466 WeakPolarHBondContact CA-OD2 3.42Å; G118-D466 PolarHBondContact N-OD1 3.22Å; G118-D466 PolarHBondContact N-OD2 3.09Å
119	L	92.2	Very high	94.1	Very high	96 Å²	96	54.5 Å²	54.5	50%	0.503	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-23.5	178.5	-62.7	173.5	0	0	0	111.8	P90 V98 R100 D466	P90-L119 HydrophobicContact CB-CD1 4.06Å; P90-L119 HydrophobicContact CG-CD1 3.96Å; V98-L119 HydrophobicContact CB-CB 4.33Å; V98-L119 HydrophobicContact CG1-CB 3.68Å; V98-L119 HydrophobicContact CG1-CD1 3.59Å; V98-L119 HydrophobicContact CG1-CG 4.23Å; R100-L119 HydrophobicContact CB-CD1 4.36Å; L119-D466 PolarHBondContact N-OD2 3.24Å; L119-D466 VanDerWaalsContact N-OD2 3.16Å
120	L	93.3	Very high	94.3	Very high	57 Å²	57	59.4 Å²	59.4	30%	0.298	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	16.9	175.1	-157.5	118.5	0	0	0	112.8	G118 R122 D466	G118-L120 PolarHBondContact O-N 3.35Å; L120-R122 WeakPolarHBondContact O-CG 3.49Å; L120-R122 PolarHBondContact O-N 2.95Å; L120-D466 HydrophobicContact CB-CB 4.16Å; L120-D466 PolarHBondContact N-OD2 3.36Å
121	H	94.9	Very high	94.4	Very high	114 Å²	114	62.6 Å²	62.6	53%	0.528	30%	0.304	S	S	.	.			trans	-70.4	119.6	179.9	177.3	74	0	0	0	110.5	G118 D466 R467	G118-H121 WeakPolarHBondContact O-CB 3.34Å; G118-H121 PolarHBondContact O-N 2.98Å; H121-D466 HydrophobicContact CB-CB 4.23Å; H121-R467 VanDerWaalsContact CE1-C 3.43Å; H121-R467 PolarHBondContact CE1-O 3.25Å; H121-R467 PolarHBondContact ND1-O 3.16Å
122	R	92.9	Very high	94.6	Very high	121 Å²	121	58.4 Å²	58.4	46%	0.457	29%	0.287	S	S	.	.			trans	-111.4	3.1	-174.1	-70.8	173.9	-71.3	175.1	3.6	113.5	L120 T124 R142	L120-R122 WeakPolarHBondContact O-CG 3.49Å; L120-R122 PolarHBondContact O-N 2.95Å; R122-T124 VanDerWaalsContact C-N 3.26Å; R122-T124 HydrophobicContact CB-CG2 4Å; R122-T124 PolarHBondContact O-N 3.26Å; R122-R142 PolarHBondContact NH2-O 3.27Å
123	G	94.3	Very high	94.8	Very high	18 Å²	18	54.9 Å²	54.9	19%	0.186	27%	0.272	C	S	.	.			trans	59.9	37.4	-174.1	0	0	0	0	0	112.4	E125 K126 L127 R467	G123-E125 PolarHBondContact O-N 3.04Å; G123-K126 WeakPolarHBondContact O-CB 3.48Å; G123-K126 PolarHBondContact O-N 3.17Å; G123-K126 VanDerWaalsContact O-N 3.09Å; G123-L127 WeakPolarHBondContact O-CG 3.38Å; G123-L127 PolarHBondContact O-N 3.41Å; G123-R467 PolarHBondContact N-OXT 3.1Å
124	T	94.5	Very high	94.9	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-58.5	-46.6	-174.3	56.7	0	0	0	0	111.6	R122 K126 L127 I128 Y139 L143 R467	R122-T124 VanDerWaalsContact C-N 3.26Å; R122-T124 HydrophobicContact CB-CG2 4Å; R122-T124 PolarHBondContact O-N 3.26Å; T124-K126 PolarHBondContact O-N 3.21Å; T124-L127 PolarHBondContact O-N 2.9Å; T124-L127 VanDerWaalsContact O-N 3.15Å; T124-I128 WeakPolarHBondContact O-CG1 3.3Å; T124-I128 PolarHBondContact O-N 3.16Å; T124-Y139 HydrophobicContact CG2-CD1 4.46Å; T124-L143 HydrophobicContact CG2-CD2 4.19Å; T124-R467 WeakPolarHBondContact CB-OXT 3.29Å; T124-R467 PolarHBondContact N-OXT 3Å; T124-R467 PolarHBondContact OG1-OXT 3.33Å
125	E	94.6	Very high	95	Very high	14 Å²	14	59.4 Å²	59.4	7%	0.065	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-33.4	178.2	-60.8	-173.1	168	0	0	111.8	G123 R425 C426 K427 I428	G123-E125 PolarHBondContact O-N 3.04Å; E125-R425 IonicContact OE2-CZ 3.44Å; E125-R425 IonicContact OE2-NH1 3.85Å; E125-R425 IonicContact OE2-NH2 3.11Å; E125-R425 PolarHBondContact OE2-NH2 3.19Å; E125-C426 WeakPolarHBondContact CG-O 3.47Å; E125-K427 WeakPolarHBondContact OE1-CD 3.26Å; E125-K427 WeakPolarHBondContact OE1-CE 3.06Å; E125-K427 IonicContact OE1-NZ 3.76Å; E125-K427 PolarHBondContact OE1-NZ 3.1Å; E125-K427 IonicContact OE2-NZ 3.74Å; E125-K427 PolarHBondContact OE2-NZ 3.48Å; E125-I428 HydrophobicContact CG-CG1 4.48Å; E125-I428 PolarHBondContact OE1-N 3.19Å
126	K	96.6	Very high	95.1	Very high	97 Å²	97	57.5 Å²	57.5	42%	0.422	28%	0.28	S	S	.	.	H	α-helix	trans	-74.5	-38.4	177.4	-174.1	64.3	-169.6	166.3	0	112.3	G123 T124 I128 E129 Y130	G123-K126 WeakPolarHBondContact O-CB 3.48Å; G123-K126 PolarHBondContact O-N 3.17Å; G123-K126 VanDerWaalsContact O-N 3.09Å; T124-K126 PolarHBondContact O-N 3.21Å; K126-I128 VanDerWaalsContact C-N 3.27Å; K126-I128 PolarHBondContact O-N 3.41Å; K126-E129 WeakPolarHBondContact CD-OE2 3.4Å; K126-E129 IonicContact NZ-OE2 3.73Å; K126-E129 PolarHBondContact NZ-OE2 3.47Å; K126-E129 PolarHBondContact O-N 3.05Å; K126-Y130 HydrophobicContact CD-CE2 4.35Å; K126-Y130 WeakPolarHBondContact CE-OH 3.27Å; K126-Y130 HydrophobicContact CG-CE2 4.21Å; K126-Y130 PolarHBondContact NZ-OH 3.34Å; K126-Y130 WeakPolarHBondContact O-CD2 3.23Å
127	L	96.9	Very high	95.2	Very high	73 Å²	73	53.3 Å²	53.3	38%	0.382	26%	0.261	S	S	.	.	H	α-helix	trans	-65.8	-33	175.8	-67	173.8	0	0	0	111.7	G123 T124 E129 Y130 K131 Y139	G123-L127 WeakPolarHBondContact O-CG 3.38Å; G123-L127 PolarHBondContact O-N 3.41Å; T124-L127 PolarHBondContact O-N 2.9Å; T124-L127 VanDerWaalsContact O-N 3.15Å; L127-E129 VanDerWaalsContact C-N 3.33Å; L127-E129 PolarHBondContact O-N 2.86Å; L127-Y130 PolarHBondContact O-N 3.04Å; L127-K131 WeakPolarHBondContact O-CG 3.34Å; L127-Y139 HydrophobicContact CB-CE1 4.2Å; L127-Y139 HydrophobicContact CB-CE2 4.26Å; L127-Y139 HydrophobicContact CD1-CE1 3.92Å
128	I	96.6	Very high	95.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-39.7	176.6	-71.2	166.4	0	0	0	111.3	T124 K126 Y130 K131 A136 Y139 F140 P423 C426	T124-I128 WeakPolarHBondContact O-CG1 3.3Å; T124-I128 PolarHBondContact O-N 3.16Å; K126-I128 VanDerWaalsContact C-N 3.27Å; K126-I128 PolarHBondContact O-N 3.41Å; I128-Y130 PolarHBondContact O-N 3.45Å; I128-Y130 VanDerWaalsContact O-N 3.13Å; I128-K131 PolarHBondContact O-N 3.14Å; I128-A136 HydrophobicContact CG1-CB 4.24Å; I128-A136 HydrophobicContact CG2-CB 3.97Å; I128-Y139 HydrophobicContact CG1-CD2 3.78Å; I128-Y139 HydrophobicContact CG1-CE2 4.44Å; I128-Y139 HydrophobicContact CG1-CG 4.16Å; I128-F140 HydrophobicContact CD1-CE2 4.21Å; I128-F140 HydrophobicContact CD1-CZ 4.25Å; I128-P423 HydrophobicContact CG2-CB 4.42Å; I128-P423 HydrophobicContact CG2-CG 3.52Å; I128-C426 HydrophobicContact CB-CB 4.48Å; I128-C426 HydrophobicContact CG2-CB 3.68Å
129	E	96.1	Very high	95.6	Very high	41 Å²	41	52.2 Å²	52.2	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-24.9	179	-64.3	172.1	-170	0	0	113.3	K126 L127 R425	K126-E129 WeakPolarHBondContact CD-OE2 3.4Å; K126-E129 IonicContact NZ-OE2 3.73Å; K126-E129 PolarHBondContact NZ-OE2 3.47Å; K126-E129 PolarHBondContact O-N 3.05Å; L127-E129 VanDerWaalsContact C-N 3.33Å; L127-E129 PolarHBondContact O-N 2.86Å; E129-R425 VanDerWaalsContact OE1-CD 3.3Å; E129-R425 WeakPolarHBondContact OE1-CD 3.06Å; E129-R425 IonicContact OE1-CZ 4Å; E129-R425 IonicContact OE1-NE 3.97Å; E129-R425 IonicContact OE1-NH1 2.88Å; E129-R425 PolarHBondContact OE1-NH1 2.86Å
130	Y	96.6	Very high	95.7	Very high	149 Å²	149	47.7 Å²	47.7	58%	0.584	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-4	179.7	-63.5	-54.3	0	0	0	114.2	K126 L127 I128	K126-Y130 HydrophobicContact CD-CE2 4.35Å; K126-Y130 WeakPolarHBondContact CE-OH 3.27Å; K126-Y130 HydrophobicContact CG-CE2 4.21Å; K126-Y130 PolarHBondContact NZ-OH 3.34Å; K126-Y130 WeakPolarHBondContact O-CD2 3.23Å; L127-Y130 PolarHBondContact O-N 3.04Å; I128-Y130 PolarHBondContact O-N 3.45Å; I128-Y130 VanDerWaalsContact O-N 3.13Å
131	K	96.8	Very high	95.7	Very high	68 Å²	68	45 Å²	45	30%	0.296	21%	0.208	S	C	.	.	S	Bend	trans	-115.3	161.2	-175.6	-63.7	-155.2	-166	-171.6	0	112.1	L127 I128 Q135 Y139 P423	L127-K131 WeakPolarHBondContact O-CG 3.34Å; I128-K131 PolarHBondContact O-N 3.14Å; K131-Q135 HydrophobicContact CB-CB 3.96Å; K131-Q135 HydrophobicContact CD-CB 4.09Å; K131-Y139 HydrophobicContact CD-CE2 3.88Å; K131-Y139 WeakPolarHBondContact CE-OH 3.44Å; K131-Y139 PolarHBondContact NZ-OH 3.4Å; K131-P423 WeakPolarHBondContact O-CD 3.43Å
132	T	97.2	Very high	95.6	Very high	13 Å²	13	45.6 Å²	45.6	8%	0.08	21%	0.206	C	C	.	.			trans	-76.6	164	172.8	62.6	0	0	0	0	111.2	L134 Q135 A136 E391 S421 R422	T132-L134 VanDerWaalsContact C-N 3.28Å; T132-L134 PolarHBondContact O-N 3.27Å; T132-Q135 CarbonylContact O-C 3.51Å; T132-Q135 PolarHBondContact O-N 3.31Å; T132-Q135 VanDerWaalsContact OG1-CG 3.32Å; T132-Q135 WeakPolarHBondContact OG1-CG 3.42Å; T132-A136 WeakPolarHBondContact O-CB 3.31Å; T132-A136 PolarHBondContact O-N 3.35Å; T132-E391 WeakPolarHBondContact CG2-O 3.42Å; T132-S421 VanDerWaalsContact CA-O 3.32Å; T132-S421 WeakPolarHBondContact CA-O 3.42Å; T132-S421 WeakPolarHBondContact CB-O 3.44Å; T132-R422 HydrophobicContact CG2-CG 4.28Å
133	Y	96.4	Very high	95.4	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-54.6	-41.4	-178.3	-68	-83.8	0	0	0	113.7	A136 L137 Y155 V159 Y393 V395 S417 S421 R422 P423	Y133-A136 PolarHBondContact O-N 3.34Å; Y133-L137 PolarHBondContact O-N 3.37Å; Y133-Y155 WeakPolarHBondContact CA-OH 3.29Å; Y133-Y155 WeakPolarHBondContact O-CE1 3.28Å; Y133-Y155 PolarHBondContact O-OH 3.4Å; Y133-V159 HydrophobicContact CD1-CG2 3.93Å; Y133-Y393 VanDerWaalsContact CB-OH 3.32Å; Y133-Y393 WeakPolarHBondContact CB-OH 3.34Å; Y133-Y393 HydrophobicContact CD2-CD2 4.48Å; Y133-Y393 HydrophobicContact CD2-CE2 4.04Å; Y133-Y393 AromaticContact CG-CE2 4Å; Y133-Y393 HydrophobicContact CG-CE2 4Å; Y133-V395 HydrophobicContact CD1-CG2 4.3Å; Y133-V395 HydrophobicContact CD2-CB 4.49Å; Y133-V395 HydrophobicContact CD2-CG2 3.56Å; Y133-V395 HydrophobicContact CE1-CB 4.47Å; Y133-V395 HydrophobicContact CE1-CG2 4Å; Y133-V395 HydrophobicContact CE2-CB 3.7Å; Y133-V395 HydrophobicContact CE2-CG2 3.23Å; Y133-V395 HydrophobicContact CG-CG2 4.1Å; Y133-V395 VanDerWaalsContact CZ-CG2 3.48Å; Y133-S417 VanDerWaalsContact OH-CB 3.26Å; Y133-S417 WeakPolarHBondContact OH-CB 3.31Å; Y133-S421 WeakPolarHBondContact CD2-O 3.39Å; Y133-S421 VanDerWaalsContact CE2-C 3.5Å; Y133-S421 WeakPolarHBondContact CE2-O 3.38Å; Y133-S421 PolarHBondContact N-O 2.96Å; Y133-R422 PolarHBondContact OH-O 3.43Å; Y133-P423 HydrophobicContact CD1-CB 4.4Å; Y133-P423 HydrophobicContact CE1-CB 3.78Å; Y133-P423 HydrophobicContact CE1-CG 4.4Å
134	L	96.1	Very high	95.3	Very high	43 Å²	43	39 Å²	39	23%	0.225	18%	0.176	C	C	.	.	H	α-helix	trans	-70.5	-37.5	177.9	-176.3	65.1	0	0	0	112.3	T132 A136 L137 Y389	T132-L134 VanDerWaalsContact C-N 3.28Å; T132-L134 PolarHBondContact O-N 3.27Å; L134-A136 VanDerWaalsContact C-N 3.29Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-Y389 HydrophobicContact CD2-CD1 4.21Å; L134-Y389 HydrophobicContact CD2-CE1 3.88Å
135	Q	96.1	Very high	95.2	Very high	104 Å²	104	43.1 Å²	43.1	49%	0.486	19%	0.191	S	C	.	.	H	α-helix	trans	-73.7	-23.3	177.7	-70.2	177.1	-0.2	0	0	112.7	K131 T132 P138	K131-Q135 HydrophobicContact CB-CB 3.96Å; K131-Q135 HydrophobicContact CD-CB 4.09Å; T132-Q135 CarbonylContact O-C 3.51Å; T132-Q135 PolarHBondContact O-N 3.31Å; T132-Q135 VanDerWaalsContact OG1-CG 3.32Å; T132-Q135 WeakPolarHBondContact OG1-CG 3.42Å; Q135-P138 WeakPolarHBondContact O-CD 3.41Å
136	A	96.3	Very high	95.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-79.1	-24.9	176.8	0	0	0	0	0	112.9	I128 T132 Y133 L134 P138 Y139	I128-A136 HydrophobicContact CG1-CB 4.24Å; I128-A136 HydrophobicContact CG2-CB 3.97Å; T132-A136 WeakPolarHBondContact O-CB 3.31Å; T132-A136 PolarHBondContact O-N 3.35Å; Y133-A136 PolarHBondContact O-N 3.34Å; L134-A136 VanDerWaalsContact C-N 3.29Å; A136-P138 VanDerWaalsContact C-CD 3.49Å; A136-Y139 WeakPolarHBondContact O-CB 3.26Å; A136-Y139 WeakPolarHBondContact O-CD2 3.4Å; A136-Y139 PolarHBondContact O-N 3.46Å
137	L	96.3	Very high	95	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-48	-48.3	-179.1	175.7	72	0	0	0	113.8	Y133 L134 Y139 F140 E152 Y155 R232	Y133-L137 PolarHBondContact O-N 3.37Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L137-Y139 PolarHBondContact O-N 2.86Å; L137-F140 WeakPolarHBondContact O-CB 3.21Å; L137-F140 PolarHBondContact O-N 2.64Å; L137-E152 HydrophobicContact CD1-CB 4.14Å; L137-E152 HydrophobicContact CD1-CG 4.17Å; L137-Y155 HydrophobicContact CB-CD1 4.34Å; L137-Y155 HydrophobicContact CB-CE1 4.06Å; L137-Y155 HydrophobicContact CD1-CD1 3.57Å; L137-Y155 HydrophobicContact CD1-CE1 4.1Å; L137-R232 HydrophobicContact CD2-CB 4.45Å; L137-R232 HydrophobicContact CD2-CG 3.76Å
138	P	96.6	Very high	94.9	Very high	43 Å²	43	34.4 Å²	34.4	28%	0.279	15%	0.15	S	C	.	.	H	α-helix	trans	-69.5	-7.7	-176.3	-19.6	34.6	0	0	0	114.6	Q135 A136 F140 R142	Q135-P138 WeakPolarHBondContact O-CD 3.41Å; A136-P138 VanDerWaalsContact C-CD 3.49Å; P138-F140 VanDerWaalsContact C-N 3.34Å; P138-R142 WeakPolarHBondContact O-CD 3.42Å; P138-R142 WeakPolarHBondContact O-CG 3.31Å
139	Y	95.8	Very high	94.8	Very high	38 Å²	38	34.5 Å²	34.5	15%	0.149	15%	0.151	C	C	.	.	H	α-helix	trans	-68.2	-39.1	168.6	-74.4	-71.8	0	0	0	110.5	T124 L127 I128 K131 A136 L137 D141 R142 L143	T124-Y139 HydrophobicContact CG2-CD1 4.46Å; L127-Y139 HydrophobicContact CB-CE1 4.2Å; L127-Y139 HydrophobicContact CB-CE2 4.26Å; L127-Y139 HydrophobicContact CD1-CE1 3.92Å; I128-Y139 HydrophobicContact CG1-CD2 3.78Å; I128-Y139 HydrophobicContact CG1-CE2 4.44Å; I128-Y139 HydrophobicContact CG1-CG 4.16Å; K131-Y139 HydrophobicContact CD-CE2 3.88Å; K131-Y139 WeakPolarHBondContact CE-OH 3.44Å; K131-Y139 PolarHBondContact NZ-OH 3.4Å; A136-Y139 WeakPolarHBondContact O-CB 3.26Å; A136-Y139 WeakPolarHBondContact O-CD2 3.4Å; A136-Y139 PolarHBondContact O-N 3.46Å; L137-Y139 PolarHBondContact O-N 2.86Å; Y139-D141 VanDerWaalsContact C-N 3.31Å; Y139-D141 PolarHBondContact O-N 3.09Å; Y139-R142 PolarHBondContact O-N 3.35Å; Y139-L143 WeakPolarHBondContact O-CG 3.29Å; Y139-L143 PolarHBondContact O-N 3.17Å
140	F	95.1	Very high	94.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.2	-34.7	-178.5	-67.2	-86.1	0	0	0	112.6	I128 L137 P138 R142 L143 N151 Y155 F411 V413 I428	I128-F140 HydrophobicContact CD1-CE2 4.21Å; I128-F140 HydrophobicContact CD1-CZ 4.25Å; L137-F140 WeakPolarHBondContact O-CB 3.21Å; L137-F140 PolarHBondContact O-N 2.64Å; P138-F140 VanDerWaalsContact C-N 3.34Å; F140-R142 PolarHBondContact O-N 2.92Å; F140-L143 HydrophobicContact CD1-CD1 3.94Å; F140-L143 HydrophobicContact CG-CD1 4.49Å; F140-L143 PolarHBondContact O-N 3.3Å; F140-N151 HydrophobicContact CB-CB 4.09Å; F140-N151 WeakPolarHBondContact O-CB 3.43Å; F140-N151 PolarHBondContact O-ND2 2.68Å; F140-Y155 HydrophobicContact CD1-CG 4.44Å; F140-Y155 AromaticContact CD2-CD1 3.94Å; F140-Y155 HydrophobicContact CD2-CD1 3.94Å; F140-Y155 AromaticContact CD2-CD2 3.78Å; F140-Y155 HydrophobicContact CD2-CD2 3.78Å; F140-Y155 HydrophobicContact CD2-CE1 4.4Å; F140-Y155 HydrophobicContact CD2-CE2 4.27Å; F140-Y155 AromaticContact CD2-CG 3.56Å; F140-Y155 HydrophobicContact CD2-CG 3.56Å; F140-Y155 AromaticContact CE1-CD2 3.97Å; F140-Y155 HydrophobicContact CE1-CD2 3.97Å; F140-Y155 HydrophobicContact CE1-CG 4.3Å; F140-Y155 AromaticContact CE2-CD1 3.99Å; F140-Y155 HydrophobicContact CE2-CD1 3.99Å; F140-Y155 AromaticContact CE2-CD2 3.09Å; F140-Y155 HydrophobicContact CE2-CD2 3.09Å; F140-Y155 HydrophobicContact CE2-CE1 4.21Å; F140-Y155 AromaticContact CE2-CE2 3.37Å; F140-Y155 HydrophobicContact CE2-CE2 3.37Å; F140-Y155 AromaticContact CE2-CG 3.4Å; F140-Y155 HydrophobicContact CE2-CG 3.4Å; F140-Y155 VanDerWaalsContact CE2-CG 3.4Å; F140-Y155 AromaticContact CE2-CZ 3.9Å; F140-Y155 HydrophobicContact CG-CD2 4.46Å; F140-Y155 HydrophobicContact CG-CG 4.09Å; F140-Y155 AromaticContact CZ-CD2 3.18Å; F140-Y155 HydrophobicContact CZ-CD2 3.18Å; F140-Y155 AromaticContact CZ-CE2 3.7Å; F140-Y155 HydrophobicContact CZ-CE2 3.7Å; F140-Y155 AromaticContact CZ-CG 3.79Å; F140-Y155 HydrophobicContact CZ-CG 3.79Å; F140-F411 HydrophobicContact CD1-CE1 4.45Å; F140-F411 HydrophobicContact CD1-CZ 4.3Å; F140-V413 HydrophobicContact CD1-CG2 4.36Å; F140-V413 HydrophobicContact CE1-CG1 4.3Å; F140-V413 HydrophobicContact CE1-CG2 3.74Å; F140-V413 HydrophobicContact CZ-CG1 4.43Å; F140-I428 HydrophobicContact CD1-CD1 4.23Å; F140-I428 HydrophobicContact CE1-CD1 3.69Å; F140-I428 HydrophobicContact CE1-CG1 4.18Å; F140-I428 HydrophobicContact CZ-CD1 4.31Å
141	D	92.4	Very high	94.8	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.8	172.2	-74.1	-36	0	0	0	114.9	Y139 E152 H227 A229	Y139-D141 VanDerWaalsContact C-N 3.31Å; Y139-D141 PolarHBondContact O-N 3.09Å; D141-E152 VanDerWaalsContact CG-OE1 3.24Å; D141-E152 WeakPolarHBondContact OD1-CG 3.28Å; D141-E152 VanDerWaalsContact OD2-OE1 3.04Å; D141-H227 HydrophobicContact CB-CB 4.29Å; D141-H227 PolarHBondContact O-CE1 3.5Å; D141-H227 VanDerWaalsContact O-CE1 3.3Å; D141-H227 PolarHBondContact O-ND1 3.2Å; D141-A229 PolarHBondContact OD2-N 3.28Å
142	R	92.9	Very high	94.8	Very high	127 Å²	127	22.3 Å²	22.3	48%	0.479	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	0.4	-169.3	-62.6	177.2	-173.7	-168.4	1.5	113.2	R122 P138 Y139 F140	R122-R142 PolarHBondContact NH2-O 3.27Å; P138-R142 WeakPolarHBondContact O-CD 3.42Å; P138-R142 WeakPolarHBondContact O-CG 3.31Å; Y139-R142 PolarHBondContact O-N 3.35Å; F140-R142 PolarHBondContact O-N 2.92Å
143	L	90	Very high	94.7	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-84.5	174.4	-63.7	168.1	0	0	0	108.6	T124 Y139 F140 Y145 F411 I428 G463 E464 R467	T124-L143 HydrophobicContact CG2-CD2 4.19Å; Y139-L143 WeakPolarHBondContact O-CG 3.29Å; Y139-L143 PolarHBondContact O-N 3.17Å; F140-L143 HydrophobicContact CD1-CD1 3.94Å; F140-L143 HydrophobicContact CG-CD1 4.49Å; F140-L143 PolarHBondContact O-N 3.3Å; L143-Y145 PolarHBondContact O-N 2.9Å; L143-F411 HydrophobicContact CD1-CZ 4.27Å; L143-I428 HydrophobicContact CD1-CD1 3.24Å; L143-I428 HydrophobicContact CD1-CG2 4.35Å; L143-I428 HydrophobicContact CD2-CD1 4.35Å; L143-I428 HydrophobicContact CG-CD1 4.43Å; L143-G463 CarbonylContact O-C 3.53Å; L143-G463 WeakPolarHBondContact O-CA 3.39Å; L143-E464 PolarHBondContact O-N 3.27Å; L143-R467 HydrophobicContact CD2-CG 3.9Å
144	D	91.9	Very high	94.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-82.1	92.1	162.4	-176.2	3.2	0	0	0	108.5	V146 S147 N151 K408 E464	D144-V146 PolarHBondContact O-N 3.03Å; D144-V146 VanDerWaalsContact O-N 3.15Å; D144-V146 PolarHBondContact OD1-N 3.2Å; D144-S147 CarbonylContact O-C 3.44Å; D144-S147 PolarHBondContact O-N 3.49Å; D144-S147 PolarHBondContact OD1-N 3.17Å; D144-S147 PolarHBondContact OD2-OG 2.96Å; D144-N151 WeakPolarHBondContact CB-ND2 3.45Å; D144-N151 PolarHBondContact N-ND2 2.9Å; D144-N151 PolarHBondContact O-ND2 3.28Å; D144-N151 VanDerWaalsContact O-ND2 3.09Å; D144-K408 WeakPolarHBondContact OD1-CE 3.45Å; D144-K408 VanDerWaalsContact OD2-CD 3.23Å; D144-K408 WeakPolarHBondContact OD2-CD 3.31Å; D144-K408 WeakPolarHBondContact OD2-CE 3.29Å; D144-E464 HydrophobicContact CB-CB 4.24Å; D144-E464 HydrophobicContact CB-CG 4.38Å
145	Y	91	Very high	94.8	Very high	89 Å²	89	19.7 Å²	19.7	35%	0.349	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	1.7	-179.2	57.3	-104.4	0	0	0	113.6	L143 M148 V461	L143-Y145 PolarHBondContact O-N 2.9Å; Y145-M148 VanDerWaalsContact O-SD 3.42Å; Y145-V461 HydrophobicContact CD1-CG1 3.63Å; Y145-V461 HydrophobicContact CE1-CG1 3.25Å; Y145-V461 HydrophobicContact CE2-CG1 4.18Å; Y145-V461 HydrophobicContact CG-CG1 4.27Å
146	V	93.2	Very high	94.8	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.012	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-31.4	172.8	-169.2	0	0	0	0	111.1	D144 M148 N186 M189 V461	D144-V146 PolarHBondContact O-N 3.03Å; D144-V146 VanDerWaalsContact O-N 3.15Å; D144-V146 PolarHBondContact OD1-N 3.2Å; V146-M148 VanDerWaalsContact C-SD 3.6Å; V146-M148 VanDerWaalsContact O-SD 3.36Å; V146-N186 HydrophobicContact CG1-CB 4.06Å; V146-N186 WeakPolarHBondContact CG1-OD1 3.06Å; V146-M189 HydrophobicContact CG1-CB 3.82Å; V146-M189 HydrophobicContact CG1-CG 4.08Å; V146-M189 HydrophobicContact CG2-CG 4.36Å; V146-V461 HydrophobicContact CG2-CG2 3.89Å
147	S	94.8	Very high	94.8	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	-113.6	64.8	176.2	73.2	0	0	0	0	114.6	D144 N151	D144-S147 CarbonylContact O-C 3.44Å; D144-S147 PolarHBondContact O-N 3.49Å; D144-S147 PolarHBondContact OD1-N 3.17Å; D144-S147 PolarHBondContact OD2-OG 2.96Å; S147-N151 PolarHBondContact O-N 3.21Å; S147-N151 PolarHBondContact O-ND2 3.28Å; S147-N151 PolarHBondContact O-OD1 3.24Å
148	M	94.2	Very high	94.9	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-57.7	-59.3	-173.8	-50.1	78.8	76.5	0	0	112.4	Y145 V146 C150 N151 E152 F215 Y218 M226	Y145-M148 VanDerWaalsContact O-SD 3.42Å; V146-M148 VanDerWaalsContact C-SD 3.6Å; V146-M148 VanDerWaalsContact O-SD 3.36Å; M148-C150 VanDerWaalsContact C-N 3.33Å; M148-C150 PolarHBondContact O-N 3.42Å; M148-N151 PolarHBondContact O-N 3.27Å; M148-N151 VanDerWaalsContact O-N 3.13Å; M148-E152 PolarHBondContact O-N 3.15Å; M148-E152 VanDerWaalsContact O-N 3.12Å; M148-F215 HydrophobicContact CE-CE1 4.16Å; M148-Y218 HydrophobicContact CE-CD2 3.7Å; M148-Y218 HydrophobicContact CE-CE2 3.48Å; M148-Y218 VanDerWaalsContact CE-CE2 3.48Å; M148-M226 HydrophobicContact CE-CB 4.15Å; M148-M226 HydrophobicContact CE-CG 4.47Å; M148-M226 VanDerWaalsContact CE-O 3.25Å; M148-M226 WeakPolarHBondContact CE-O 3.44Å; M148-M226 WeakPolarHBondContact CG-O 3.41Å
149	M	95.7	Very high	94.9	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	6%	0.056	C	C	.	.	H	α-helix	trans	-66.1	-31.9	-174.3	-57.5	-70.7	-166.7	0	0	113	N151 E152 Q153 Y178 T182 Y218 A228 Y230 V231	M149-N151 VanDerWaalsContact C-N 3.31Å; M149-N151 PolarHBondContact O-N 2.91Å; M149-E152 PolarHBondContact O-N 2.95Å; M149-E152 VanDerWaalsContact SD-OE2 3.37Å; M149-Q153 WeakPolarHBondContact O-CB 3.44Å; M149-Q153 PolarHBondContact O-N 2.66Å; M149-Y178 HydrophobicContact CE-CD1 4.22Å; M149-T182 WeakPolarHBondContact CB-OG1 3.34Å; M149-Y218 HydrophobicContact CE-CD2 4.04Å; M149-Y218 HydrophobicContact CE-CE2 4.03Å; M149-Y218 HydrophobicContact CG-CE2 3.83Å; M149-A228 HydrophobicContact CE-CB 3.34Å; M149-A228 HydrophobicContact SD-CB 4.02Å; M149-Y230 HydrophobicContact CE-CD1 3.9Å; M149-Y230 HydrophobicContact CE-CG 4.14Å; M149-Y230 HydrophobicContact SD-CD1 4.17Å; M149-V231 HydrophobicContact SD-CG2 4.17Å
150	C	96	Very high	94.9	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.014	5%	0.052	C	C	.	.	H	α-helix	trans	-65.3	-37.2	176.5	-64.5	0	0	0	0	111.5	M148 Q153 C154 T182	M148-C150 VanDerWaalsContact C-N 3.33Å; M148-C150 PolarHBondContact O-N 3.42Å; C150-Q153 PolarHBondContact O-N 2.82Å; C150-C154 PolarHBondContact O-N 2.78Å; C150-T182 HydrophobicContact CB-CG2 4.49Å
151	N	95.8	Very high	94.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-71.4	-42.3	177.3	-58.5	-15.1	0	0	0	110.9	F140 D144 S147 M148 M149 Q153 C154 Y155 F411	F140-N151 HydrophobicContact CB-CB 4.09Å; F140-N151 WeakPolarHBondContact O-CB 3.43Å; F140-N151 PolarHBondContact O-ND2 2.68Å; D144-N151 WeakPolarHBondContact CB-ND2 3.45Å; D144-N151 PolarHBondContact N-ND2 2.9Å; D144-N151 PolarHBondContact O-ND2 3.28Å; D144-N151 VanDerWaalsContact O-ND2 3.09Å; S147-N151 PolarHBondContact O-N 3.21Å; S147-N151 PolarHBondContact O-ND2 3.28Å; S147-N151 PolarHBondContact O-OD1 3.24Å; M148-N151 PolarHBondContact O-N 3.27Å; M148-N151 VanDerWaalsContact O-N 3.13Å; M149-N151 VanDerWaalsContact C-N 3.31Å; M149-N151 PolarHBondContact O-N 2.91Å; N151-Q153 VanDerWaalsContact C-N 3.27Å; N151-Q153 PolarHBondContact O-N 3.27Å; N151-C154 PolarHBondContact O-N 2.79Å; N151-Y155 PolarHBondContact O-N 2.88Å; N151-F411 HydrophobicContact CB-CE1 4.22Å; N151-F411 HydrophobicContact CB-CZ 4.32Å
152	E	96.1	Very high	95.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59.2	-40.4	172	-63.6	-178.8	161.4	0	0	111.6	L137 D141 M148 M149 Y155 S156 A229 Y230 V231	L137-E152 HydrophobicContact CD1-CB 4.14Å; L137-E152 HydrophobicContact CD1-CG 4.17Å; D141-E152 VanDerWaalsContact CG-OE1 3.24Å; D141-E152 WeakPolarHBondContact OD1-CG 3.28Å; D141-E152 VanDerWaalsContact OD2-OE1 3.04Å; M148-E152 PolarHBondContact O-N 3.15Å; M148-E152 VanDerWaalsContact O-N 3.12Å; M149-E152 PolarHBondContact O-N 2.95Å; M149-E152 VanDerWaalsContact SD-OE2 3.37Å; E152-Y155 PolarHBondContact O-N 2.94Å; E152-S156 VanDerWaalsContact O-CB 3.3Å; E152-S156 WeakPolarHBondContact O-CB 3.31Å; E152-S156 PolarHBondContact O-N 2.89Å; E152-S156 PolarHBondContact O-OG 3.32Å; E152-A229 WeakPolarHBondContact OE1-CA 3.39Å; E152-A229 PolarHBondContact OE1-N 2.92Å; E152-Y230 PolarHBondContact OE1-N 2.75Å; E152-Y230 PolarHBondContact OE2-N 2.75Å; E152-V231 HydrophobicContact CB-CB 3.77Å; E152-V231 HydrophobicContact CB-CG1 4.38Å; E152-V231 WeakPolarHBondContact OE2-CA 3.26Å; E152-V231 VanDerWaalsContact OE2-CB 3.31Å; E152-V231 WeakPolarHBondContact OE2-CB 3.12Å; E152-V231 PolarHBondContact OE2-N 3.18Å
153	Q	96.8	Very high	95.2	Very high	2 Å²	2	14 Å²	14	1%	0.009	6%	0.062	C	C	.	.	H	α-helix	trans	-63.6	-46.3	177.5	-175	178.8	16.1	0	0	111	M149 C150 N151 Y155 S156 L157 V231 D313	M149-Q153 WeakPolarHBondContact O-CB 3.44Å; M149-Q153 PolarHBondContact O-N 2.66Å; C150-Q153 PolarHBondContact O-N 2.82Å; N151-Q153 VanDerWaalsContact C-N 3.27Å; N151-Q153 PolarHBondContact O-N 3.27Å; Q153-Y155 VanDerWaalsContact C-N 3.32Å; Q153-Y155 PolarHBondContact O-N 3.38Å; Q153-S156 WeakPolarHBondContact CA-OG 3.29Å; Q153-S156 PolarHBondContact O-N 3Å; Q153-S156 PolarHBondContact O-OG 3.5Å; Q153-L157 HydrophobicContact CG-CD1 4.02Å; Q153-L157 HydrophobicContact CG-CG 4.47Å; Q153-L157 WeakPolarHBondContact O-CB 3.34Å; Q153-L157 VanDerWaalsContact O-CG 3.26Å; Q153-L157 WeakPolarHBondContact O-CG 3.29Å; Q153-L157 PolarHBondContact O-N 2.82Å; Q153-V231 HydrophobicContact CB-CG1 4.4Å; Q153-D313 PolarHBondContact NE2-OD2 3.4Å
154	C	96.4	Very high	95.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62	-40.9	176.8	-171.6	0	0	0	0	112.3	C150 N151 A158 V404 F411 V413	C150-C154 PolarHBondContact O-N 2.78Å; N151-C154 PolarHBondContact O-N 2.79Å; C154-A158 WeakPolarHBondContact O-CB 3.34Å; C154-A158 PolarHBondContact O-N 2.55Å; C154-A158 VanDerWaalsContact O-N 3.1Å; C154-V404 HydrophobicContact CB-CB 3.96Å; C154-V404 HydrophobicContact CB-CG2 3.72Å; C154-F411 HydrophobicContact CB-CD1 3.53Å; C154-F411 HydrophobicContact CB-CE1 3.84Å; C154-F411 PolarHBondContact SG-O 2.87Å; C154-F411 VanDerWaalsContact SG-O 3.38Å; C154-V413 HydrophobicContact CB-CG2 4.45Å
155	Y	97	Very high	95.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.9	-41.5	176.7	176.8	-110.8	0	0	0	112.5	Y133 L137 F140 N151 E152 Q153 A158 V159 P233 L415	Y133-Y155 WeakPolarHBondContact CA-OH 3.29Å; Y133-Y155 WeakPolarHBondContact O-CE1 3.28Å; Y133-Y155 PolarHBondContact O-OH 3.4Å; L137-Y155 HydrophobicContact CB-CD1 4.34Å; L137-Y155 HydrophobicContact CB-CE1 4.06Å; L137-Y155 HydrophobicContact CD1-CD1 3.57Å; L137-Y155 HydrophobicContact CD1-CE1 4.1Å; F140-Y155 HydrophobicContact CD1-CG 4.44Å; F140-Y155 AromaticContact CD2-CD1 3.94Å; F140-Y155 HydrophobicContact CD2-CD1 3.94Å; F140-Y155 AromaticContact CD2-CD2 3.78Å; F140-Y155 HydrophobicContact CD2-CD2 3.78Å; F140-Y155 HydrophobicContact CD2-CE1 4.4Å; F140-Y155 HydrophobicContact CD2-CE2 4.27Å; F140-Y155 AromaticContact CD2-CG 3.56Å; F140-Y155 HydrophobicContact CD2-CG 3.56Å; F140-Y155 AromaticContact CE1-CD2 3.97Å; F140-Y155 HydrophobicContact CE1-CD2 3.97Å; F140-Y155 HydrophobicContact CE1-CG 4.3Å; F140-Y155 AromaticContact CE2-CD1 3.99Å; F140-Y155 HydrophobicContact CE2-CD1 3.99Å; F140-Y155 AromaticContact CE2-CD2 3.09Å; F140-Y155 HydrophobicContact CE2-CD2 3.09Å; F140-Y155 HydrophobicContact CE2-CE1 4.21Å; F140-Y155 AromaticContact CE2-CE2 3.37Å; F140-Y155 HydrophobicContact CE2-CE2 3.37Å; F140-Y155 AromaticContact CE2-CG 3.4Å; F140-Y155 HydrophobicContact CE2-CG 3.4Å; F140-Y155 VanDerWaalsContact CE2-CG 3.4Å; F140-Y155 AromaticContact CE2-CZ 3.9Å; F140-Y155 HydrophobicContact CG-CD2 4.46Å; F140-Y155 HydrophobicContact CG-CG 4.09Å; F140-Y155 AromaticContact CZ-CD2 3.18Å; F140-Y155 HydrophobicContact CZ-CD2 3.18Å; F140-Y155 AromaticContact CZ-CE2 3.7Å; F140-Y155 HydrophobicContact CZ-CE2 3.7Å; F140-Y155 AromaticContact CZ-CG 3.79Å; F140-Y155 HydrophobicContact CZ-CG 3.79Å; N151-Y155 PolarHBondContact O-N 2.88Å; E152-Y155 PolarHBondContact O-N 2.94Å; Q153-Y155 VanDerWaalsContact C-N 3.32Å; Q153-Y155 PolarHBondContact O-N 3.38Å; Y155-A158 WeakPolarHBondContact O-CB 3.45Å; Y155-A158 PolarHBondContact O-N 3.45Å; Y155-V159 HydrophobicContact CD2-CG2 4.3Å; Y155-V159 HydrophobicContact CE1-CG2 4.21Å; Y155-V159 HydrophobicContact CE2-CG2 3.88Å; Y155-V159 WeakPolarHBondContact O-CG2 3.34Å; Y155-V159 PolarHBondContact O-N 3Å; Y155-V159 VanDerWaalsContact O-N 3.08Å; Y155-P233 HydrophobicContact CE1-CG 4.29Å; Y155-L415 HydrophobicContact CD2-CD1 4.1Å; Y155-L415 HydrophobicContact CE2-CD1 3.91Å; Y155-L415 HydrophobicContact CE2-CD2 4.27Å
156	S	96.6	Very high	95.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.2	-41.7	178.6	61.3	0	0	0	0	111.9	E152 Q153 A158 V159 E160 V231	E152-S156 VanDerWaalsContact O-CB 3.3Å; E152-S156 WeakPolarHBondContact O-CB 3.31Å; E152-S156 PolarHBondContact O-N 2.89Å; E152-S156 PolarHBondContact O-OG 3.32Å; Q153-S156 WeakPolarHBondContact CA-OG 3.29Å; Q153-S156 PolarHBondContact O-N 3Å; Q153-S156 PolarHBondContact O-OG 3.5Å; S156-A158 VanDerWaalsContact C-N 3.33Å; S156-A158 PolarHBondContact O-N 3.41Å; S156-V159 PolarHBondContact O-N 3.28Å; S156-E160 VanDerWaalsContact O-CB 3.29Å; S156-E160 WeakPolarHBondContact O-CB 3.45Å; S156-E160 WeakPolarHBondContact O-CG 3.37Å; S156-E160 PolarHBondContact O-N 3.31Å; S156-V231 WeakPolarHBondContact OG-CG1 3.49Å
157	L	97.1	Very high	95.6	Very high	28 Å²	28	25.6 Å²	25.6	15%	0.147	13%	0.126	C	C	.	.	H	α-helix	trans	-62.7	-37.8	173.1	-70	171.8	0	0	0	112.3	Q153 K161 Y312 V404	Q153-L157 HydrophobicContact CG-CD1 4.02Å; Q153-L157 HydrophobicContact CG-CG 4.47Å; Q153-L157 WeakPolarHBondContact O-CB 3.34Å; Q153-L157 VanDerWaalsContact O-CG 3.26Å; Q153-L157 WeakPolarHBondContact O-CG 3.29Å; Q153-L157 PolarHBondContact O-N 2.82Å; L157-K161 VanDerWaalsContact O-CB 3.26Å; L157-K161 WeakPolarHBondContact O-CB 3.44Å; L157-K161 PolarHBondContact O-N 3.32Å; L157-Y312 HydrophobicContact CD1-CD2 3.75Å; L157-Y312 HydrophobicContact CD1-CG 4.07Å; L157-V404 HydrophobicContact CD1-CG2 3.7Å
158	A	96.8	Very high	95.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-45.3	176.1	0	0	0	0	0	112	C154 Y155 S156 L162 T402 V413 L415	C154-A158 WeakPolarHBondContact O-CB 3.34Å; C154-A158 PolarHBondContact O-N 2.55Å; C154-A158 VanDerWaalsContact O-N 3.1Å; Y155-A158 WeakPolarHBondContact O-CB 3.45Å; Y155-A158 PolarHBondContact O-N 3.45Å; S156-A158 VanDerWaalsContact C-N 3.33Å; S156-A158 PolarHBondContact O-N 3.41Å; A158-L162 PolarHBondContact O-N 3.28Å; A158-T402 VanDerWaalsContact CA-OG1 3.22Å; A158-T402 WeakPolarHBondContact CA-OG1 3.2Å; A158-T402 HydrophobicContact CB-CG2 4.45Å; A158-T402 WeakPolarHBondContact CB-OG1 3.39Å; A158-V413 HydrophobicContact CB-CB 4.36Å; A158-V413 HydrophobicContact CB-CG1 4.15Å; A158-L415 HydrophobicContact CB-CD1 3.54Å; A158-L415 HydrophobicContact CB-CG 4.36Å
159	V	96.8	Very high	95.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-73.2	-41.1	179.5	177.9	0	0	0	0	111.2	Y133 Y155 S156 K161 L162 L163 P233 Y393 V395 L415	Y133-V159 HydrophobicContact CD1-CG2 3.93Å; Y155-V159 HydrophobicContact CD2-CG2 4.3Å; Y155-V159 HydrophobicContact CE1-CG2 4.21Å; Y155-V159 HydrophobicContact CE2-CG2 3.88Å; Y155-V159 WeakPolarHBondContact O-CG2 3.34Å; Y155-V159 PolarHBondContact O-N 3Å; Y155-V159 VanDerWaalsContact O-N 3.08Å; S156-V159 PolarHBondContact O-N 3.28Å; V159-K161 VanDerWaalsContact C-N 3.3Å; V159-K161 PolarHBondContact O-N 2.78Å; V159-L162 PolarHBondContact O-N 3.49Å; V159-L162 VanDerWaalsContact O-N 3.17Å; V159-L163 HydrophobicContact CG1-CD1 3.78Å; V159-L163 HydrophobicContact CG1-CG 4.32Å; V159-L163 WeakPolarHBondContact O-CB 3.24Å; V159-L163 WeakPolarHBondContact O-CG 3.45Å; V159-L163 PolarHBondContact O-N 3.17Å; V159-P233 HydrophobicContact CB-CB 3.91Å; V159-P233 HydrophobicContact CB-CG 3.95Å; V159-P233 HydrophobicContact CG1-CB 3.66Å; V159-P233 HydrophobicContact CG1-CG 3.99Å; V159-P233 HydrophobicContact CG2-CG 4.21Å; V159-Y393 HydrophobicContact CG1-CE2 3.94Å; V159-V395 HydrophobicContact CG1-CG2 4.45Å; V159-L415 HydrophobicContact CG2-CD1 3.75Å
160	E	96.1	Very high	95.7	Very high	11 Å²	11	31.4 Å²	31.4	5%	0.051	16%	0.159	C	C	.	.	H	α-helix	trans	-60.6	-39.6	175.8	-78	169	-174.5	0	0	111.9	S156 L163 N164 I165 R175 G234 G235	S156-E160 VanDerWaalsContact O-CB 3.29Å; S156-E160 WeakPolarHBondContact O-CB 3.45Å; S156-E160 WeakPolarHBondContact O-CG 3.37Å; S156-E160 PolarHBondContact O-N 3.31Å; E160-L163 CarbonylContact O-C 3.56Å; E160-L163 PolarHBondContact O-N 3.47Å; E160-N164 PolarHBondContact O-N 2.92Å; E160-I165 PolarHBondContact O-N 3.23Å; E160-I165 VanDerWaalsContact O-N 3.16Å; E160-R175 IonicContact OE1-CZ 3.15Å; E160-R175 IonicContact OE1-NH1 2.64Å; E160-R175 PolarHBondContact OE1-NH1 3.3Å; E160-R175 IonicContact OE1-NH2 3.21Å; E160-R175 PolarHBondContact OE1-NH2 3.21Å; E160-R175 IonicContact OE2-CZ 3.24Å; E160-R175 IonicContact OE2-NH1 2.86Å; E160-R175 PolarHBondContact OE2-NH1 3.45Å; E160-R175 IonicContact OE2-NH2 2.78Å; E160-G234 WeakPolarHBondContact OE1-CA 3.41Å; E160-G234 PolarHBondContact OE1-N 2.86Å; E160-G235 PolarHBondContact OE1-N 2.92Å
161	K	95.9	Very high	95.7	Very high	118 Å²	118	31.3 Å²	31.3	51%	0.513	16%	0.159	S	C	.	.	H	α-helix	trans	-65.9	-35.8	175	-169.7	176.2	-177	176.1	0	112.7	L157 V159 N164 T400 T402	L157-K161 VanDerWaalsContact O-CB 3.26Å; L157-K161 WeakPolarHBondContact O-CB 3.44Å; L157-K161 PolarHBondContact O-N 3.32Å; V159-K161 VanDerWaalsContact C-N 3.3Å; V159-K161 PolarHBondContact O-N 2.78Å; K161-N164 PolarHBondContact O-OD1 2.95Å; K161-T400 HydrophobicContact CD-CG2 4.26Å; K161-T400 HydrophobicContact CG-CG2 4.19Å; K161-T402 HydrophobicContact CB-CG2 4.25Å; K161-T402 HydrophobicContact CD-CG2 3.41Å; K161-T402 VanDerWaalsContact CD-CG2 3.41Å; K161-T402 HydrophobicContact CG-CG2 4.48Å
162	L	95.5	Very high	95.7	Very high	13 Å²	13	31.8 Å²	31.8	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-72.9	-34.8	173.6	-76.4	171.4	0	0	0	112.5	A158 V159 N164 V395 T400 L415	A158-L162 PolarHBondContact O-N 3.28Å; V159-L162 PolarHBondContact O-N 3.49Å; V159-L162 VanDerWaalsContact O-N 3.17Å; L162-N164 VanDerWaalsContact C-N 3.31Å; L162-V395 HydrophobicContact CB-CG1 3.57Å; L162-V395 HydrophobicContact CD1-CG1 4.07Å; L162-V395 HydrophobicContact CG-CG1 4.39Å; L162-T400 HydrophobicContact CD2-CG2 3.37Å; L162-T400 HydrophobicContact CG-CG2 3.64Å; L162-T400 WeakPolarHBondContact CG-OG1 3.4Å; L162-L415 HydrophobicContact CD1-CB 3.95Å
163	L	95.3	Very high	95.7	Very high	25 Å²	25	32.2 Å²	32.2	13%	0.131	16%	0.163	C	C	.	.	H	α-helix	trans	-78.4	-13.7	177.9	-73.4	172.5	0	0	0	113.4	V159 E160 I165 V367 Y393 V395	V159-L163 HydrophobicContact CG1-CD1 3.78Å; V159-L163 HydrophobicContact CG1-CG 4.32Å; V159-L163 WeakPolarHBondContact O-CB 3.24Å; V159-L163 WeakPolarHBondContact O-CG 3.45Å; V159-L163 PolarHBondContact O-N 3.17Å; E160-L163 CarbonylContact O-C 3.56Å; E160-L163 PolarHBondContact O-N 3.47Å; L163-I165 VanDerWaalsContact C-N 3.32Å; L163-I165 HydrophobicContact CB-CB 4.47Å; L163-I165 HydrophobicContact CB-CD1 3.92Å; L163-I165 HydrophobicContact CB-CG1 4.06Å; L163-I165 HydrophobicContact CD1-CD1 4.42Å; L163-V367 HydrophobicContact CD1-CG1 3.89Å; L163-V367 HydrophobicContact CD1-CG2 4.34Å; L163-Y393 HydrophobicContact CD1-CD2 4.2Å; L163-Y393 HydrophobicContact CD1-CE2 4.07Å; L163-V395 HydrophobicContact CD2-CB 4.41Å; L163-V395 HydrophobicContact CD2-CG1 4.45Å; L163-V395 HydrophobicContact CD2-CG2 4.02Å; L163-V395 HydrophobicContact CG-CG2 4.3Å
164	N	95.1	Very high	95.7	Very high	144 Å²	144	32.1 Å²	32.1	77%	0.77	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	43.7	-171.9	-62.7	-48.3	0	0	0	112.9	E160 K161 L162	E160-N164 PolarHBondContact O-N 2.92Å; K161-N164 PolarHBondContact O-OD1 2.95Å; L162-N164 VanDerWaalsContact C-N 3.31Å
165	I	94.1	Very high	95.7	Very high	37 Å²	37	32.2 Å²	32.2	19%	0.19	16%	0.163	C	C	.	.			trans	-117.6	144.8	179.8	-64.1	173.4	0	0	0	109.5	E160 L163 V362 V367	E160-I165 PolarHBondContact O-N 3.23Å; E160-I165 VanDerWaalsContact O-N 3.16Å; L163-I165 VanDerWaalsContact C-N 3.32Å; L163-I165 HydrophobicContact CB-CB 4.47Å; L163-I165 HydrophobicContact CB-CD1 3.92Å; L163-I165 HydrophobicContact CB-CG1 4.06Å; L163-I165 HydrophobicContact CD1-CD1 4.42Å; I165-V362 HydrophobicContact CG2-CB 4.12Å; I165-V362 HydrophobicContact CG2-CG1 3.58Å; I165-V362 HydrophobicContact CG2-CG2 3.53Å; I165-V367 HydrophobicContact CD1-CB 4.19Å; I165-V367 HydrophobicContact CD1-CG1 4.29Å; I165-V367 HydrophobicContact CD1-CG2 3.55Å
166	Q	93.1	Very high	95.7	Very high	151 Å²	151	32.2 Å²	32.2	71%	0.706	16%	0.163	S	C	*	.			trans	-108.6	128.9	173	-168.3	175.1	17.6	0	0	110.5	V362	Q166-V362 WeakPolarHBondContact O-CG2 3.46Å
167	A	93.1	Very high	95.7	Very high	4 Å²	4	32.3 Å²	32.3	3%	0.033	16%	0.163	C	C	.	.			trans	-63.6	148.7	173.5	0	0	0	0	0	111.6	Q172	A167-Q172 HydrophobicContact CB-CG 4.17Å; A167-Q172 PolarHBondContact O-NE2 3.43Å
168	P	95.6	Very high	95.6	Very high	20 Å²	20	31 Å²	31	13%	0.13	16%	0.156	C	C	.	.			trans	-65.1	155.9	178.7	29.1	-36.7	0	0	0	111.7	R170 A171 Q172 E359	P168-R170 VanDerWaalsContact C-N 3.33Å; P168-R170 PolarHBondContact O-N 3.41Å; P168-A171 HydrophobicContact CG-CB 3.72Å; P168-A171 WeakPolarHBondContact O-CB 3.29Å; P168-A171 PolarHBondContact O-N 3.12Å; P168-Q172 PolarHBondContact O-N 3.43Å; P168-Q172 VanDerWaalsContact O-N 3.1Å; P168-E359 WeakPolarHBondContact CB-O 3.38Å; P168-E359 WeakPolarHBondContact CG-O 3.34Å
169	P	95.1	Very high	95.6	Very high	71 Å²	71	31 Å²	31	46%	0.461	16%	0.157	S	C	.	.	H	α-helix	trans	-60.2	-40.9	-171.9	22.6	-33.5	0	0	0	112.5	A171 Q172 W173 P356	P169-A171 VanDerWaalsContact C-N 3.33Å; P169-A171 PolarHBondContact O-N 3.29Å; P169-Q172 WeakPolarHBondContact O-CB 3.49Å; P169-Q172 PolarHBondContact O-N 3.03Å; P169-W173 PolarHBondContact O-N 3.43Å; P169-P356 HydrophobicContact CB-CG 4.43Å
170	R	95.4	Very high	95.6	Very high	33 Å²	33	31 Å²	31	13%	0.125	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-41.7	176.9	-176.5	179.3	177.4	76.6	0.9	112	P168 Q172 W173 I174 D239 P356 G358	P168-R170 VanDerWaalsContact C-N 3.33Å; P168-R170 PolarHBondContact O-N 3.41Å; R170-Q172 PolarHBondContact O-N 2.69Å; R170-W173 PolarHBondContact O-N 3.39Å; R170-I174 HydrophobicContact CG-CD1 3.99Å; R170-I174 VanDerWaalsContact O-CG1 3.31Å; R170-I174 WeakPolarHBondContact O-CG1 3.46Å; R170-I174 PolarHBondContact O-N 2.73Å; R170-D239 IonicContact CZ-OD1 2.69Å; R170-D239 IonicContact CZ-OD2 3Å; R170-D239 IonicContact NE-OD1 3.48Å; R170-D239 PolarHBondContact NE-OD1 3.46Å; R170-D239 VanDerWaalsContact NE-OD1 3.17Å; R170-D239 IonicContact NE-OD2 3.63Å; R170-D239 PolarHBondContact NE-OD2 3.11Å; R170-D239 IonicContact NH2-OD1 3.17Å; R170-D239 PolarHBondContact NH2-OD1 2.82Å; R170-D239 IonicContact NH2-OD2 3.23Å; R170-D239 PolarHBondContact NH2-OD2 3.01Å; R170-P356 HydrophobicContact CB-CG 4.39Å; R170-P356 WeakPolarHBondContact CG-O 3.47Å; R170-P356 PolarHBondContact NH1-O 3.01Å; R170-G358 WeakPolarHBondContact CD-O 3.1Å
171	A	95.8	Very high	95.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.3	-38.5	177.1	0	0	0	0	0	112.5	P168 P169 I174 R175 V236 I360	P168-A171 HydrophobicContact CG-CB 3.72Å; P168-A171 WeakPolarHBondContact O-CB 3.29Å; P168-A171 PolarHBondContact O-N 3.12Å; P169-A171 VanDerWaalsContact C-N 3.33Å; P169-A171 PolarHBondContact O-N 3.29Å; A171-I174 PolarHBondContact O-N 3.39Å; A171-R175 WeakPolarHBondContact O-CB 3.47Å; A171-R175 VanDerWaalsContact O-CG 3.29Å; A171-R175 WeakPolarHBondContact O-CG 3.12Å; A171-R175 PolarHBondContact O-N 2.94Å; A171-V236 HydrophobicContact CB-CG2 4.26Å; A171-I360 VanDerWaalsContact CB-O 3.23Å; A171-I360 WeakPolarHBondContact CB-O 3.39Å
172	Q	95.7	Very high	95.7	Very high	10 Å²	10	24.9 Å²	24.9	5%	0.047	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-43.8	175.3	-67.2	173.1	-11.6	0	0	111.4	A167 P168 P169 R170 R175 V176 D313 K314	A167-Q172 HydrophobicContact CB-CG 4.17Å; A167-Q172 PolarHBondContact O-NE2 3.43Å; P168-Q172 PolarHBondContact O-N 3.43Å; P168-Q172 VanDerWaalsContact O-N 3.1Å; P169-Q172 WeakPolarHBondContact O-CB 3.49Å; P169-Q172 PolarHBondContact O-N 3.03Å; R170-Q172 PolarHBondContact O-N 2.69Å; Q172-R175 WeakPolarHBondContact O-CB 3.21Å; Q172-R175 PolarHBondContact O-N 2.91Å; Q172-V176 WeakPolarHBondContact O-CG2 3.39Å; Q172-V176 PolarHBondContact O-N 3.1Å; Q172-D313 HydrophobicContact CB-CB 4.08Å; Q172-D313 HydrophobicContact CG-CB 4.3Å; Q172-K314 HydrophobicContact CB-CG 3.77Å
173	W	96.6	Very high	95.8	Very high	9 Å²	9	24.4 Å²	24.4	3%	0.034	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-41.4	175.4	-79.2	106.3	0	0	0	112.9	P169 R170 R175 V176 L177 K314 E317 V318 A351 K354 P356	P169-W173 PolarHBondContact O-N 3.43Å; R170-W173 PolarHBondContact O-N 3.39Å; W173-R175 VanDerWaalsContact C-N 3.34Å; W173-R175 PolarHBondContact O-N 2.61Å; W173-V176 PolarHBondContact O-N 3.47Å; W173-L177 WeakPolarHBondContact O-CB 3.42Å; W173-L177 PolarHBondContact O-N 3.38Å; W173-K314 HydrophobicContact CD2-CB 4.39Å; W173-K314 HydrophobicContact CZ2-CB 4.37Å; W173-E317 HydrophobicContact CH2-CB 4.06Å; W173-E317 HydrophobicContact CZ2-CB 4.03Å; W173-E317 VanDerWaalsContact CZ2-OE2 3.32Å; W173-E317 WeakPolarHBondContact CZ2-OE2 3.46Å; W173-V318 HydrophobicContact CH2-CG1 3.86Å; W173-V318 HydrophobicContact CZ3-CG1 3.63Å; W173-A351 HydrophobicContact CE3-CB 4.01Å; W173-A351 HydrophobicContact CZ3-CB 4.17Å; W173-K354 HydrophobicContact CH2-CB 3.9Å; W173-K354 HydrophobicContact CH2-CD 3.84Å; W173-K354 HydrophobicContact CZ2-CB 4.06Å; W173-K354 HydrophobicContact CZ2-CD 4.36Å; W173-K354 HydrophobicContact CZ3-CB 4.27Å; W173-P356 HydrophobicContact CG-CG 4.39Å
174	I	96.4	Very high	95.9	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-42.6	174.8	-68.4	167.9	0	0	0	110.7	R170 A171 L177 Y178 Y230 V236 L240 I360	R170-I174 HydrophobicContact CG-CD1 3.99Å; R170-I174 VanDerWaalsContact O-CG1 3.31Å; R170-I174 WeakPolarHBondContact O-CG1 3.46Å; R170-I174 PolarHBondContact O-N 2.73Å; A171-I174 PolarHBondContact O-N 3.39Å; I174-L177 PolarHBondContact O-N 2.96Å; I174-Y178 HydrophobicContact CG2-CD2 3.93Å; I174-Y178 HydrophobicContact CG2-CE2 4.36Å; I174-Y178 PolarHBondContact O-N 3.36Å; I174-Y230 HydrophobicContact CG2-CE1 3.91Å; I174-V236 HydrophobicContact CG2-CG1 4.34Å; I174-V236 HydrophobicContact CG2-CG2 4.27Å; I174-L240 HydrophobicContact CD1-CG 4.19Å; I174-L240 HydrophobicContact CG1-CD1 4.23Å; I174-L240 HydrophobicContact CG1-CG 4.3Å; I174-L240 HydrophobicContact CG2-CD2 4.24Å; I174-I360 HydrophobicContact CD1-CG2 4.32Å
175	R	96.4	Very high	95.9	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-61.5	-43.2	175.4	-75.2	172.6	178.2	-172.4	-6.4	112.1	E160 A171 Q172 W173 G179 V231 R232 G235 V236 D313	E160-R175 IonicContact OE1-CZ 3.15Å; E160-R175 IonicContact OE1-NH1 2.64Å; E160-R175 PolarHBondContact OE1-NH1 3.3Å; E160-R175 IonicContact OE1-NH2 3.21Å; E160-R175 PolarHBondContact OE1-NH2 3.21Å; E160-R175 IonicContact OE2-CZ 3.24Å; E160-R175 IonicContact OE2-NH1 2.86Å; E160-R175 PolarHBondContact OE2-NH1 3.45Å; E160-R175 IonicContact OE2-NH2 2.78Å; A171-R175 WeakPolarHBondContact O-CB 3.47Å; A171-R175 VanDerWaalsContact O-CG 3.29Å; A171-R175 WeakPolarHBondContact O-CG 3.12Å; A171-R175 PolarHBondContact O-N 2.94Å; Q172-R175 WeakPolarHBondContact O-CB 3.21Å; Q172-R175 PolarHBondContact O-N 2.91Å; W173-R175 VanDerWaalsContact C-N 3.34Å; W173-R175 PolarHBondContact O-N 2.61Å; R175-G179 WeakPolarHBondContact O-CA 2.93Å; R175-G179 PolarHBondContact O-N 3.34Å; R175-V231 HydrophobicContact CG-CG1 4.08Å; R175-V231 HydrophobicContact CG-CG2 4.17Å; R175-R232 PolarHBondContact NH2-O 3.34Å; R175-G235 PolarHBondContact NE-O 3.2Å; R175-G235 PolarHBondContact NH2-O 3.33Å; R175-V236 HydrophobicContact CG-CG2 3.86Å; R175-D313 IonicContact NH1-OD1 3.75Å
176	V	96.5	Very high	96.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-63	-45.9	176.4	170.8	0	0	0	0	110.6	Q172 W173 G179 E180 D313 K314 Y315 I347	Q172-V176 WeakPolarHBondContact O-CG2 3.39Å; Q172-V176 PolarHBondContact O-N 3.1Å; W173-V176 PolarHBondContact O-N 3.47Å; V176-G179 PolarHBondContact O-N 2.85Å; V176-E180 PolarHBondContact O-N 3.05Å; V176-D313 HydrophobicContact CG2-CB 4.09Å; V176-K314 HydrophobicContact CG2-CB 4.41Å; V176-Y315 HydrophobicContact CG1-CD1 4.31Å; V176-Y315 HydrophobicContact CG1-CE1 3.88Å; V176-Y315 HydrophobicContact CG2-CD2 4.16Å; V176-Y315 HydrophobicContact CG2-CE2 3.91Å; V176-I347 HydrophobicContact CG1-CG2 3.99Å
177	L	96.6	Very high	96.2	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.041	C	C	.	.	H	α-helix	trans	-59.7	-49.6	178.2	-179.9	147.8	0	0	0	111.9	W173 I174 G179 E180 L181 I248 A351 L352 M355	W173-L177 WeakPolarHBondContact O-CB 3.42Å; W173-L177 PolarHBondContact O-N 3.38Å; I174-L177 PolarHBondContact O-N 2.96Å; L177-G179 VanDerWaalsContact C-N 3.35Å; L177-E180 PolarHBondContact O-N 2.89Å; L177-L181 HydrophobicContact CD2-CD1 3.72Å; L177-L181 PolarHBondContact O-N 3.08Å; L177-I248 HydrophobicContact CD2-CD1 4.17Å; L177-A351 HydrophobicContact CB-CB 4.36Å; L177-L352 HydrophobicContact CD1-CD2 3.72Å; L177-L352 HydrophobicContact CD1-CG 4.17Å; L177-M355 HydrophobicContact CD1-CE 3.46Å; L177-M355 VanDerWaalsContact CD1-CE 3.46Å
178	Y	96.4	Very high	96.4	Very high	1 Å²	1	7.2 Å²	7.2	0%	0.004	4%	0.04	C	C	.	.	H	α-helix	trans	-71.9	-28.6	178	-88	-78.3	0	0	0	113.2	M149 I174 L181 T182 F217 Y218 V221 Y230 L240 L244	M149-Y178 HydrophobicContact CE-CD1 4.22Å; I174-Y178 HydrophobicContact CG2-CD2 3.93Å; I174-Y178 HydrophobicContact CG2-CE2 4.36Å; I174-Y178 PolarHBondContact O-N 3.36Å; Y178-L181 HydrophobicContact CD1-CD1 4.11Å; Y178-L181 HydrophobicContact CE1-CD1 4.06Å; Y178-T182 VanDerWaalsContact O-CB 3.3Å; Y178-T182 WeakPolarHBondContact O-CB 3.47Å; Y178-T182 PolarHBondContact O-N 3.28Å; Y178-T182 PolarHBondContact O-OG1 3.08Å; Y178-F217 PolarHBondContact OH-O 3.29Å; Y178-Y218 HydrophobicContact CD1-CD1 4.28Å; Y178-Y218 AromaticContact CD1-CE1 3.78Å; Y178-Y218 HydrophobicContact CD1-CE1 3.78Å; Y178-Y218 AromaticContact CE1-CD1 3.94Å; Y178-Y218 HydrophobicContact CE1-CD1 3.94Å; Y178-Y218 AromaticContact CE1-CE1 3.86Å; Y178-Y218 HydrophobicContact CE1-CE1 3.86Å; Y178-V221 HydrophobicContact CE2-CG1 4.4Å; Y178-V221 HydrophobicContact CE2-CG2 4.3Å; Y178-V221 WeakPolarHBondContact OH-CG2 2.97Å; Y178-Y230 HydrophobicContact CD2-CE1 4.27Å; Y178-Y230 HydrophobicContact CE2-CE1 4.41Å; Y178-L240 HydrophobicContact CE2-CD2 3.66Å; Y178-L244 WeakPolarHBondContact OH-CD2 2.91Å
179	G	96.1	Very high	96.4	Very high	1 Å²	1	8 Å²	8	1%	0.01	4%	0.042	C	C	.	.	H	α-helix	trans	-61.8	-43.5	172.1	0	0	0	0	0	111.6	R175 V176 L177 T182 R183	R175-G179 WeakPolarHBondContact O-CA 2.93Å; R175-G179 PolarHBondContact O-N 3.34Å; V176-G179 PolarHBondContact O-N 2.85Å; L177-G179 VanDerWaalsContact C-N 3.35Å; G179-T182 WeakPolarHBondContact O-CB 3.5Å; G179-T182 PolarHBondContact O-N 2.98Å; G179-R183 PolarHBondContact O-N 2.91Å
180	E	97.1	Very high	96.3	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-77	-33.6	178.1	-66.6	-59	146.4	0	0	113	V176 L177 T182 R183 I184 R307 Y315 S344 I347 I348	V176-E180 PolarHBondContact O-N 3.05Å; L177-E180 PolarHBondContact O-N 2.89Å; E180-T182 VanDerWaalsContact C-N 3.3Å; E180-T182 PolarHBondContact O-N 2.99Å; E180-R183 WeakPolarHBondContact O-CB 3.16Å; E180-R183 PolarHBondContact O-N 3.1Å; E180-R183 VanDerWaalsContact O-N 3.16Å; E180-R183 IonicContact OE1-NE 2.88Å; E180-R183 PolarHBondContact OE1-NE 3.08Å; E180-R183 IonicContact OE1-NH2 2.66Å; E180-R183 WeakPolarHBondContact OE2-CD 3.44Å; E180-R183 IonicContact OE2-NE 3.06Å; E180-R183 PolarHBondContact OE2-NE 3.02Å; E180-I184 WeakPolarHBondContact O-CG1 3.44Å; E180-I184 PolarHBondContact O-N 3.31Å; E180-R307 IonicContact OE1-CZ 3.27Å; E180-R307 IonicContact OE1-NH1 3.8Å; E180-R307 PolarHBondContact OE1-NH1 3.11Å; E180-R307 IonicContact OE2-NH1 3.41Å; E180-R307 PolarHBondContact OE2-NH1 3.14Å; E180-Y315 HydrophobicContact CG-CE1 4.32Å; E180-Y315 WeakPolarHBondContact OE1-CE1 3.27Å; E180-Y315 PolarHBondContact OE1-OH 3.04Å; E180-S344 WeakPolarHBondContact OE2-CA 3.4Å; E180-S344 VanDerWaalsContact OE2-CB 3.24Å; E180-S344 WeakPolarHBondContact OE2-CB 3.42Å; E180-S344 PolarHBondContact OE2-OG 3.39Å; E180-I347 HydrophobicContact CG-CB 4.01Å; E180-I347 HydrophobicContact CG-CD1 4.03Å; E180-I347 HydrophobicContact CG-CG2 3.73Å; E180-I348 HydrophobicContact CB-CD1 4.29Å; E180-I348 HydrophobicContact CB-CG1 3.93Å
181	L	96.5	Very high	96.3	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-59.7	-42.6	166.8	-74.9	173.3	0	0	0	111.4	L177 Y178 R183 I184 L185 M214 Y218 I248 W251 I348	L177-L181 HydrophobicContact CD2-CD1 3.72Å; L177-L181 PolarHBondContact O-N 3.08Å; Y178-L181 HydrophobicContact CD1-CD1 4.11Å; Y178-L181 HydrophobicContact CE1-CD1 4.06Å; L181-R183 VanDerWaalsContact C-N 3.28Å; L181-R183 PolarHBondContact O-N 3.45Å; L181-I184 PolarHBondContact O-N 3.08Å; L181-L185 WeakPolarHBondContact O-CG 3.41Å; L181-L185 PolarHBondContact O-N 2.58Å; L181-M214 HydrophobicContact CD2-SD 4.32Å; L181-Y218 HydrophobicContact CB-CE1 4.42Å; L181-I248 HydrophobicContact CD1-CD1 4.37Å; L181-W251 HydrophobicContact CD2-CE3 4.36Å; L181-W251 HydrophobicContact CD2-CH2 4.14Å; L181-W251 HydrophobicContact CD2-CZ3 3.69Å; L181-I348 HydrophobicContact CD2-CD1 3.8Å; L181-I348 HydrophobicContact CG-CD1 4.11Å
182	T	97.2	Very high	96.3	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-63.1	-36.3	175.1	-54.3	0	0	0	0	111.5	M149 C150 Y178 G179 E180 L185 N186 Y218	M149-T182 WeakPolarHBondContact CB-OG1 3.34Å; C150-T182 HydrophobicContact CB-CG2 4.49Å; Y178-T182 VanDerWaalsContact O-CB 3.3Å; Y178-T182 WeakPolarHBondContact O-CB 3.47Å; Y178-T182 PolarHBondContact O-N 3.28Å; Y178-T182 PolarHBondContact O-OG1 3.08Å; G179-T182 WeakPolarHBondContact O-CB 3.5Å; G179-T182 PolarHBondContact O-N 2.98Å; E180-T182 VanDerWaalsContact C-N 3.3Å; E180-T182 PolarHBondContact O-N 2.99Å; T182-L185 WeakPolarHBondContact O-CB 3.39Å; T182-L185 PolarHBondContact O-N 3.33Å; T182-N186 WeakPolarHBondContact O-CB 3.31Å; T182-N186 PolarHBondContact O-N 2.71Å; T182-Y218 WeakPolarHBondContact CA-OH 3.35Å; T182-Y218 WeakPolarHBondContact CB-OH 3.43Å; T182-Y218 PolarHBondContact N-OH 3.21Å; T182-Y218 PolarHBondContact OG1-OH 2.92Å
183	R	97.4	Very high	96.2	Very high	2 Å²	2	3.9 Å²	3.9	1%	0.008	2%	0.02	C	C	.	.	H	α-helix	trans	-63.8	-45.5	175.9	-171.4	176.9	-52.1	-88.7	-7.2	112	G179 E180 L181 N186 H187 R307 E340 S344 E405 P407	G179-R183 PolarHBondContact O-N 2.91Å; E180-R183 WeakPolarHBondContact O-CB 3.16Å; E180-R183 PolarHBondContact O-N 3.1Å; E180-R183 VanDerWaalsContact O-N 3.16Å; E180-R183 IonicContact OE1-NE 2.88Å; E180-R183 PolarHBondContact OE1-NE 3.08Å; E180-R183 IonicContact OE1-NH2 2.66Å; E180-R183 WeakPolarHBondContact OE2-CD 3.44Å; E180-R183 IonicContact OE2-NE 3.06Å; E180-R183 PolarHBondContact OE2-NE 3.02Å; L181-R183 VanDerWaalsContact C-N 3.28Å; L181-R183 PolarHBondContact O-N 3.45Å; R183-N186 PolarHBondContact O-N 3.24Å; R183-H187 VanDerWaalsContact CG-NE2 3.28Å; R183-H187 WeakPolarHBondContact CG-NE2 3.45Å; R183-H187 PolarHBondContact O-CD2 2.92Å; R183-H187 PolarHBondContact O-N 2.83Å; R183-R307 VanDerWaalsContact CZ-NH1 3.34Å; R183-E340 IonicContact NH1-OE2 3.78Å; R183-S344 WeakPolarHBondContact CD-OG 3.37Å; R183-E405 PolarHBondContact NH2-O 3.4Å; R183-P407 HydrophobicContact CB-CG 4.02Å; R183-P407 HydrophobicContact CG-CB 4.03Å; R183-P407 HydrophobicContact CG-CG 4.05Å
184	I	97.1	Very high	96.2	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-61.4	-47	174.3	-64.7	173.8	0	0	0	110.4	E180 L181 N186 H187 I188 M214 W251 F255 L345 I348	E180-I184 WeakPolarHBondContact O-CG1 3.44Å; E180-I184 PolarHBondContact O-N 3.31Å; L181-I184 PolarHBondContact O-N 3.08Å; I184-N186 VanDerWaalsContact C-N 3.25Å; I184-N186 PolarHBondContact O-N 2.78Å; I184-H187 PolarHBondContact O-N 2.73Å; I184-I188 HydrophobicContact CG2-CD1 3.83Å; I184-I188 HydrophobicContact CG2-CG1 4.2Å; I184-I188 WeakPolarHBondContact O-CB 3.38Å; I184-I188 VanDerWaalsContact O-CG1 3.27Å; I184-I188 WeakPolarHBondContact O-CG1 3.4Å; I184-I188 PolarHBondContact O-N 2.97Å; I184-M214 HydrophobicContact CB-SD 4.28Å; I184-M214 HydrophobicContact CG2-CE 3.81Å; I184-M214 HydrophobicContact CG2-SD 3.96Å; I184-W251 HydrophobicContact CD1-CH2 3.82Å; I184-W251 HydrophobicContact CD1-CZ3 4.34Å; I184-W251 HydrophobicContact CG2-CH2 4.15Å; I184-W251 HydrophobicContact CG2-CZ2 4.44Å; I184-F255 HydrophobicContact CD1-CD1 4.47Å; I184-F255 HydrophobicContact CD1-CE1 4.17Å; I184-F255 HydrophobicContact CG1-CE1 4.48Å; I184-F255 HydrophobicContact CG2-CD1 4.34Å; I184-F255 HydrophobicContact CG2-CE1 3.38Å; I184-F255 HydrophobicContact CG2-CE2 4.38Å; I184-F255 HydrophobicContact CG2-CZ 3.43Å; I184-F255 VanDerWaalsContact CG2-CZ 3.43Å; I184-L345 HydrophobicContact CD1-CD2 4.12Å; I184-L345 HydrophobicContact CD1-CG 4.18Å; I184-I348 HydrophobicContact CD1-CD1 3.57Å
185	L	96.6	Very high	96.1	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-53.5	-41.6	176.3	-80.2	171.7	0	0	0	113	L181 T182 M189 R211 M214 F215 Y218	L181-L185 WeakPolarHBondContact O-CG 3.41Å; L181-L185 PolarHBondContact O-N 2.58Å; T182-L185 WeakPolarHBondContact O-CB 3.39Å; T182-L185 PolarHBondContact O-N 3.33Å; L185-M189 PolarHBondContact O-N 2.84Å; L185-R211 HydrophobicContact CD2-CB 4.42Å; L185-R211 HydrophobicContact CD2-CG 3.6Å; L185-M214 HydrophobicContact CD1-CB 4.41Å; L185-M214 HydrophobicContact CD2-CB 3.7Å; L185-M214 HydrophobicContact CD2-CE 3.51Å; L185-M214 HydrophobicContact CD2-CG 4.46Å; L185-M214 HydrophobicContact CD2-SD 4Å; L185-M214 HydrophobicContact CG-CB 4.13Å; L185-M214 HydrophobicContact CG-CE 3.83Å; L185-M214 HydrophobicContact CG-SD 3.81Å; L185-F215 HydrophobicContact CD2-CE1 4.37Å; L185-Y218 HydrophobicContact CD1-CD1 4.48Å; L185-Y218 HydrophobicContact CD1-CE1 3.74Å; L185-Y218 HydrophobicContact CD1-CE2 4.09Å; L185-Y218 WeakPolarHBondContact CD1-OH 3.49Å
186	N	96.8	Very high	96	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-76.1	-44.4	-179.1	-158.1	-3.9	0	0	0	112.1	V146 T182 R183 I184 I188 M189 A190 P407 D459	V146-N186 HydrophobicContact CG1-CB 4.06Å; V146-N186 WeakPolarHBondContact CG1-OD1 3.06Å; T182-N186 WeakPolarHBondContact O-CB 3.31Å; T182-N186 PolarHBondContact O-N 2.71Å; R183-N186 PolarHBondContact O-N 3.24Å; I184-N186 VanDerWaalsContact C-N 3.25Å; I184-N186 PolarHBondContact O-N 2.78Å; N186-I188 VanDerWaalsContact C-N 3.32Å; N186-I188 PolarHBondContact O-N 3.15Å; N186-M189 WeakPolarHBondContact O-CB 3.42Å; N186-M189 PolarHBondContact O-N 2.72Å; N186-M189 VanDerWaalsContact O-N 3.14Å; N186-A190 WeakPolarHBondContact O-CB 3.27Å; N186-A190 PolarHBondContact O-N 2.97Å; N186-P407 HydrophobicContact CB-CB 3.65Å; N186-P407 HydrophobicContact CB-CG 3.81Å; N186-D459 PolarHBondContact OD1-OD2 3.32Å
187	H	96.9	Very high	95.8	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-64.9	-35.3	176.9	-68.2	-36	0	0	0	113	R183 I184 A190 I191 E340 M341 P407	R183-H187 VanDerWaalsContact CG-NE2 3.28Å; R183-H187 WeakPolarHBondContact CG-NE2 3.45Å; R183-H187 PolarHBondContact O-CD2 2.92Å; R183-H187 PolarHBondContact O-N 2.83Å; I184-H187 PolarHBondContact O-N 2.73Å; H187-A190 PolarHBondContact O-N 3.41Å; H187-I191 WeakPolarHBondContact O-CB 3.22Å; H187-I191 WeakPolarHBondContact O-CG1 3.35Å; H187-I191 PolarHBondContact O-N 2.97Å; H187-E340 IonicContact CE1-OE2 3.58Å; H187-E340 PolarHBondContact CE1-OE2 2.66Å; H187-E340 IonicContact NE2-OE2 2.73Å; H187-E340 PolarHBondContact NE2-OE2 3.38Å; H187-E340 VanDerWaalsContact NE2-OE2 3.11Å; H187-M341 HydrophobicContact CB-CG 3.57Å; H187-M341 HydrophobicContact CB-SD 3.89Å; H187-P407 PolarHBondContact CE1-O 2.87Å
188	I	96.1	Very high	95.6	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-57.3	-51.6	170.4	-73.4	177.4	0	0	0	109.9	I184 N186 T192 M207 R211 M214 F255 M341	I184-I188 HydrophobicContact CG2-CD1 3.83Å; I184-I188 HydrophobicContact CG2-CG1 4.2Å; I184-I188 WeakPolarHBondContact O-CB 3.38Å; I184-I188 VanDerWaalsContact O-CG1 3.27Å; I184-I188 WeakPolarHBondContact O-CG1 3.4Å; I184-I188 PolarHBondContact O-N 2.97Å; N186-I188 VanDerWaalsContact C-N 3.32Å; N186-I188 PolarHBondContact O-N 3.15Å; I188-T192 HydrophobicContact CG2-CG2 4.39Å; I188-T192 VanDerWaalsContact O-CB 3.31Å; I188-T192 WeakPolarHBondContact O-CB 3.3Å; I188-T192 VanDerWaalsContact O-CG2 3.26Å; I188-T192 WeakPolarHBondContact O-CG2 3.34Å; I188-T192 PolarHBondContact O-N 3.04Å; I188-T192 PolarHBondContact O-OG1 3.38Å; I188-M207 HydrophobicContact CD1-CE 4.45Å; I188-M207 HydrophobicContact CG1-CE 4.06Å; I188-M207 HydrophobicContact CG2-CB 3.62Å; I188-R211 HydrophobicContact CG2-CB 4.47Å; I188-M214 HydrophobicContact CD1-CE 3.46Å; I188-M214 VanDerWaalsContact CD1-CE 3.46Å; I188-F255 HydrophobicContact CD1-CE2 3.78Å; I188-F255 HydrophobicContact CD1-CZ 3.71Å; I188-F255 HydrophobicContact CG1-CZ 4.18Å; I188-M341 HydrophobicContact CG1-SD 4.06Å
189	M	95.1	Very high	95.4	Very high	35 Å²	35	11.8 Å²	11.8	17%	0.172	8%	0.075	C	C	.	.	H	α-helix	trans	-57.2	-54.2	177.9	-178.6	64.8	85.7	0	0	110.2	V146 L185 N186 I191 T192 T193 F208 R211	V146-M189 HydrophobicContact CG1-CB 3.82Å; V146-M189 HydrophobicContact CG1-CG 4.08Å; V146-M189 HydrophobicContact CG2-CG 4.36Å; L185-M189 PolarHBondContact O-N 2.84Å; N186-M189 WeakPolarHBondContact O-CB 3.42Å; N186-M189 PolarHBondContact O-N 2.72Å; N186-M189 VanDerWaalsContact O-N 3.14Å; M189-I191 PolarHBondContact O-N 3.39Å; M189-T192 PolarHBondContact O-N 3.34Å; M189-T192 PolarHBondContact O-OG1 3.13Å; M189-T193 HydrophobicContact CG-CG2 4.14Å; M189-T193 WeakPolarHBondContact O-CB 3.38Å; M189-T193 WeakPolarHBondContact O-CG2 3.34Å; M189-T193 PolarHBondContact O-N 3.01Å; M189-T193 PolarHBondContact O-OG1 3.32Å; M189-T193 HydrophobicContact SD-CG2 3.39Å; M189-T193 WeakPolarHBondContact SD-CG2 3.49Å; M189-F208 HydrophobicContact CE-CZ 3.84Å; M189-F208 HydrophobicContact SD-CE1 4.19Å; M189-F208 HydrophobicContact SD-CZ 3.73Å; M189-R211 VanDerWaalsContact CE-CZ 3.48Å
190	A	94.9	Very high	95.3	Very high	3 Å²	3	13 Å²	13	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-55.8	-47.5	-177	0	0	0	0	0	113.2	N186 H187 T193 H194 D459	N186-A190 WeakPolarHBondContact O-CB 3.27Å; N186-A190 PolarHBondContact O-N 2.97Å; H187-A190 PolarHBondContact O-N 3.41Å; A190-T193 PolarHBondContact O-OG1 3.31Å; A190-H194 WeakPolarHBondContact O-CB 3.48Å; A190-H194 PolarHBondContact O-N 2.79Å; A190-D459 HydrophobicContact CB-CB 3.91Å
191	I	95.4	Very high	95.1	Very high	7 Å²	7	19 Å²	19	4%	0.036	11%	0.114	C	C	.	.	H	α-helix	trans	-69.4	-45	-178.5	-70	166.3	0	0	0	110.6	H187 M189 A195 L266 Y334 R337 V338 M341	H187-I191 WeakPolarHBondContact O-CB 3.22Å; H187-I191 WeakPolarHBondContact O-CG1 3.35Å; H187-I191 PolarHBondContact O-N 2.97Å; M189-I191 PolarHBondContact O-N 3.39Å; I191-A195 VanDerWaalsContact O-CB 3.27Å; I191-A195 WeakPolarHBondContact O-CB 3.36Å; I191-A195 PolarHBondContact O-N 3.39Å; I191-L266 HydrophobicContact CG2-CD1 4.25Å; I191-Y334 HydrophobicContact CG1-CD2 4.23Å; I191-Y334 HydrophobicContact CG1-CE2 4.35Å; I191-Y334 HydrophobicContact CG2-CD2 4.22Å; I191-Y334 HydrophobicContact CG2-CE2 3.73Å; I191-R337 HydrophobicContact CD1-CB 3.92Å; I191-R337 HydrophobicContact CG1-CB 4.17Å; I191-V338 HydrophobicContact CD1-CG2 3.8Å; I191-M341 HydrophobicContact CD1-CE 3.51Å; I191-M341 HydrophobicContact CD1-SD 4.28Å
192	T	95.3	Very high	95	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-73.8	-37.3	-174.1	55.3	0	0	0	0	113.1	I188 M189 A195 L196 M207	I188-T192 HydrophobicContact CG2-CG2 4.39Å; I188-T192 VanDerWaalsContact O-CB 3.31Å; I188-T192 WeakPolarHBondContact O-CB 3.3Å; I188-T192 VanDerWaalsContact O-CG2 3.26Å; I188-T192 WeakPolarHBondContact O-CG2 3.34Å; I188-T192 PolarHBondContact O-N 3.04Å; I188-T192 PolarHBondContact O-OG1 3.38Å; M189-T192 PolarHBondContact O-N 3.34Å; M189-T192 PolarHBondContact O-OG1 3.13Å; T192-A195 PolarHBondContact O-N 2.68Å; T192-L196 VanDerWaalsContact O-CB 3.31Å; T192-L196 WeakPolarHBondContact O-CB 3.42Å; T192-L196 PolarHBondContact O-N 2.83Å; T192-M207 HydrophobicContact CG2-CB 3.78Å; T192-M207 HydrophobicContact CG2-CG 4.12Å
193	T	93.9	Very high	94.8	Very high	18 Å²	18	22.5 Å²	22.5	11%	0.11	14%	0.135	C	C	.	.	H	α-helix	trans	-70	-40.2	174.7	57.1	0	0	0	0	111.5	M189 A190 A195 L196 D197 F204	M189-T193 HydrophobicContact CG-CG2 4.14Å; M189-T193 WeakPolarHBondContact O-CB 3.38Å; M189-T193 WeakPolarHBondContact O-CG2 3.34Å; M189-T193 PolarHBondContact O-N 3.01Å; M189-T193 PolarHBondContact O-OG1 3.32Å; M189-T193 HydrophobicContact SD-CG2 3.39Å; M189-T193 WeakPolarHBondContact SD-CG2 3.49Å; A190-T193 PolarHBondContact O-OG1 3.31Å; T193-A195 VanDerWaalsContact C-N 3.32Å; T193-A195 PolarHBondContact O-N 2.84Å; T193-L196 PolarHBondContact O-N 3.23Å; T193-D197 PolarHBondContact O-N 2.9Å; T193-F204 HydrophobicContact CG2-CE2 4.38Å
194	H	94.9	Very high	94.7	Very high	5 Å²	5	24.2 Å²	24.2	2%	0.023	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-41.4	172.4	177.1	-126.5	0	0	0	111.8	A190 D197 I198 W272 A453 T457	A190-H194 WeakPolarHBondContact O-CB 3.48Å; A190-H194 PolarHBondContact O-N 2.79Å; H194-D197 PolarHBondContact O-N 3.34Å; H194-I198 WeakPolarHBondContact NE2-CD1 3.12Å; H194-I198 WeakPolarHBondContact O-CG1 3.31Å; H194-I198 PolarHBondContact O-N 3.4Å; H194-W272 AromaticContact CE1-CH2 3.46Å; H194-W272 VanDerWaalsContact CE1-CH2 3.46Å; H194-W272 WeakPolarHBondContact CE1-CH2 3.45Å; H194-W272 AromaticContact CE1-CZ2 3.65Å; H194-W272 AromaticContact ND1-CH2 3.3Å; H194-W272 VanDerWaalsContact ND1-CH2 3.3Å; H194-W272 WeakPolarHBondContact ND1-CH2 3.46Å; H194-W272 AromaticContact ND1-CZ2 3.57Å; H194-A453 PolarHBondContact NE2-O 2.99Å; H194-T457 WeakPolarHBondContact NE2-CG2 3.5Å
195	A	95.1	Very high	94.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-43.8	174.1	0	0	0	0	0	111.8	I191 T192 T193 D197 I198 G199 A200 P203 L266 W272	I191-A195 VanDerWaalsContact O-CB 3.27Å; I191-A195 WeakPolarHBondContact O-CB 3.36Å; I191-A195 PolarHBondContact O-N 3.39Å; T192-A195 PolarHBondContact O-N 2.68Å; T193-A195 VanDerWaalsContact C-N 3.32Å; T193-A195 PolarHBondContact O-N 2.84Å; A195-D197 PolarHBondContact O-N 3.41Å; A195-I198 PolarHBondContact O-N 3.11Å; A195-G199 PolarHBondContact O-N 3.44Å; A195-A200 CarbonylContact C-O 3.58Å; A195-A200 HydrophobicContact CB-CB 4.18Å; A195-A200 PolarHBondContact O-N 3.3Å; A195-P203 HydrophobicContact CB-CG 4Å; A195-L266 HydrophobicContact CB-CD1 4.25Å; A195-L266 HydrophobicContact CB-CD2 4.44Å; A195-W272 HydrophobicContact CB-CH2 4.15Å; A195-W272 HydrophobicContact CB-CZ3 4.23Å
196	L	95.1	Very high	94.6	Very high	60 Å²	60	35.9 Å²	35.9	31%	0.314	19%	0.191	S	C	.	.	H	α-helix	trans	-62.8	-41.3	179.1	-177	142.2	0	0	0	112.2	T192 T193 I198 G199 A200 F204	T192-L196 VanDerWaalsContact O-CB 3.31Å; T192-L196 WeakPolarHBondContact O-CB 3.42Å; T192-L196 PolarHBondContact O-N 2.83Å; T193-L196 PolarHBondContact O-N 3.23Å; L196-I198 PolarHBondContact O-N 3.3Å; L196-G199 WeakPolarHBondContact O-CA 3.43Å; L196-G199 PolarHBondContact O-N 3.23Å; L196-G199 VanDerWaalsContact O-N 3.1Å; L196-A200 PolarHBondContact N-O 2.76Å; L196-F204 HydrophobicContact CD1-CB 4.29Å; L196-F204 HydrophobicContact CD1-CD1 4.19Å; L196-F204 HydrophobicContact CD1-CD2 4Å; L196-F204 HydrophobicContact CD1-CE2 4.36Å; L196-F204 HydrophobicContact CD1-CG 3.91Å
197	D	92.2	Very high	94.6	Very high	28 Å²	28	36.1 Å²	36.1	15%	0.15	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-37.8	177.6	-76.4	-9	0	0	0	113.7	H96 T193 H194 A195 G199 V452	H96-D197 IonicContact CD2-OD1 2.76Å; H96-D197 IonicContact CD2-OD2 3.08Å; H96-D197 PolarHBondContact CD2-OD2 3.49Å; H96-D197 IonicContact CE1-OD1 2.73Å; H96-D197 PolarHBondContact CE1-OD1 3.43Å; H96-D197 IonicContact CE1-OD2 3.88Å; H96-D197 IonicContact NE2-OD1 3.61Å; H96-D197 PolarHBondContact NE2-OD1 3.34Å; H96-D197 IonicContact NE2-OD2 3.19Å; H96-D197 PolarHBondContact NE2-OD2 3.44Å; T193-D197 PolarHBondContact O-N 2.9Å; H194-D197 PolarHBondContact O-N 3.34Å; A195-D197 PolarHBondContact O-N 3.41Å; D197-G199 VanDerWaalsContact C-N 3.26Å; D197-V452 HydrophobicContact CB-CG1 3.75Å
198	I	92.4	Very high	94.5	Very high	37 Å²	37	38.8 Å²	38.8	19%	0.19	20%	0.203	C	C	.	.	H	α-helix	trans	-73.6	-25	175.6	-68.5	171	0	0	0	110.5	H194 A195 L196 W272 R275 T276 A453	H194-I198 WeakPolarHBondContact NE2-CD1 3.12Å; H194-I198 WeakPolarHBondContact O-CG1 3.31Å; H194-I198 PolarHBondContact O-N 3.4Å; A195-I198 PolarHBondContact O-N 3.11Å; L196-I198 PolarHBondContact O-N 3.3Å; I198-W272 HydrophobicContact CB-CZ3 3.99Å; I198-W272 HydrophobicContact CD1-CE3 4.14Å; I198-W272 HydrophobicContact CD1-CH2 3.72Å; I198-W272 HydrophobicContact CD1-CZ3 3.4Å; I198-W272 HydrophobicContact CG1-CZ3 4.24Å; I198-W272 HydrophobicContact CG2-CE3 4.29Å; I198-W272 HydrophobicContact CG2-CZ3 4.12Å; I198-R275 HydrophobicContact CG2-CB 4.01Å; I198-R275 HydrophobicContact CG2-CG 4.12Å; I198-T276 HydrophobicContact CD1-CG2 4.06Å; I198-A453 HydrophobicContact CD1-CB 4.12Å; I198-A453 HydrophobicContact CG1-CB 4.37Å
199	G	92.1	Very high	94.5	Very high	50 Å²	50	42.9 Å²	42.9	52%	0.515	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	126	0.8	171.9	0	0	0	0	0	115.5	A195 L196 D197 M201	A195-G199 PolarHBondContact O-N 3.44Å; L196-G199 WeakPolarHBondContact O-CA 3.43Å; L196-G199 PolarHBondContact O-N 3.23Å; L196-G199 VanDerWaalsContact O-N 3.1Å; D197-G199 VanDerWaalsContact C-N 3.26Å; G199-M201 PolarHBondContact O-N 2.88Å
200	A	92.8	Very high	94.5	Very high	25 Å²	25	41.4 Å²	41.4	21%	0.207	22%	0.215	C	C	.	.			trans	-85.4	99.6	177.4	0	0	0	0	0	111	A195 L196 P203 M265 L266	A195-A200 CarbonylContact C-O 3.58Å; A195-A200 HydrophobicContact CB-CB 4.18Å; A195-A200 PolarHBondContact O-N 3.3Å; L196-A200 PolarHBondContact N-O 2.76Å; A200-P203 HydrophobicContact CB-CG 4.48Å; A200-P203 WeakPolarHBondContact O-CD 3.32Å; A200-M265 HydrophobicContact CB-CE 4.4Å; A200-L266 HydrophobicContact CB-CD2 4.22Å
201	M	93.1	Very high	94.6	Very high	127 Å²	127	42.3 Å²	42.3	63%	0.626	22%	0.218	S	C	*	.			trans	-85.7	-29.4	-173.7	-64.2	-177.3	-72.8	0	0	114.9	G199 P203 F204 F205	G199-M201 PolarHBondContact O-N 2.88Å; M201-P203 VanDerWaalsContact C-CD 3.42Å; M201-F204 WeakPolarHBondContact O-CB 3.28Å; M201-F205 VanDerWaalsContact O-CD2 3.29Å; M201-F205 WeakPolarHBondContact O-CD2 3.3Å
202	T	94.1	Very high	94.7	Very high	73 Å²	73	46.2 Å²	46.2	45%	0.448	24%	0.236	S	C	.	.	H	α-helix	trans	-64.4	-42.2	-174.4	50.6	0	0	0	0	115.9	F204 F205 W206	T202-F204 PolarHBondContact O-N 3.29Å; T202-F205 PolarHBondContact O-N 3.05Å; T202-W206 PolarHBondContact O-N 3.34Å
203	P	94.6	Very high	94.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.8	-24.1	-174.3	31.8	-33.8	0	0	0	111.4	A195 A200 M201 W206 M207 V262 M265 L266	A195-P203 HydrophobicContact CB-CG 4Å; A200-P203 HydrophobicContact CB-CG 4.48Å; A200-P203 WeakPolarHBondContact O-CD 3.32Å; M201-P203 VanDerWaalsContact C-CD 3.42Å; P203-W206 PolarHBondContact O-N 3.12Å; P203-M207 PolarHBondContact O-N 3.32Å; P203-M207 VanDerWaalsContact O-N 3.09Å; P203-V262 HydrophobicContact CB-CG1 4.41Å; P203-M265 HydrophobicContact CB-CE 3.74Å; P203-M265 VanDerWaalsContact CD-CE 3.4Å; P203-M265 HydrophobicContact CG-CE 3.4Å; P203-M265 VanDerWaalsContact CG-CE 3.4Å; P203-L266 HydrophobicContact CG-CD1 4.44Å
204	F	94.8	Very high	94.8	Very high	39 Å²	39	48.6 Å²	48.6	17%	0.171	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-50	174.1	179.6	-93.3	0	0	0	111.7	T193 L196 M201 T202 F208	T193-F204 HydrophobicContact CG2-CE2 4.38Å; L196-F204 HydrophobicContact CD1-CB 4.29Å; L196-F204 HydrophobicContact CD1-CD1 4.19Å; L196-F204 HydrophobicContact CD1-CD2 4Å; L196-F204 HydrophobicContact CD1-CE2 4.36Å; L196-F204 HydrophobicContact CD1-CG 3.91Å; M201-F204 WeakPolarHBondContact O-CB 3.28Å; T202-F204 PolarHBondContact O-N 3.29Å; F204-F208 HydrophobicContact CD2-CD1 4.23Å; F204-F208 AromaticContact CD2-CE1 3.82Å; F204-F208 HydrophobicContact CD2-CE1 3.82Å; F204-F208 AromaticContact CD2-CZ 3.98Å; F204-F208 HydrophobicContact CD2-CZ 3.98Å; F204-F208 AromaticContact CE1-CD2 3.97Å; F204-F208 HydrophobicContact CE1-CD2 3.97Å; F204-F208 AromaticContact CE1-CE2 3.96Å; F204-F208 HydrophobicContact CE1-CE2 3.96Å; F204-F208 HydrophobicContact CE1-CG 4.38Å; F204-F208 HydrophobicContact CE1-CZ 4.36Å; F204-F208 HydrophobicContact CE2-CD1 4.16Å; F204-F208 HydrophobicContact CE2-CD2 4.22Å; F204-F208 AromaticContact CE2-CE1 3.5Å; F204-F208 HydrophobicContact CE2-CE1 3.5Å; F204-F208 AromaticContact CE2-CE2 3.57Å; F204-F208 HydrophobicContact CE2-CE2 3.57Å; F204-F208 HydrophobicContact CE2-CG 4.49Å; F204-F208 AromaticContact CE2-CZ 3.16Å; F204-F208 HydrophobicContact CE2-CZ 3.16Å; F204-F208 HydrophobicContact CZ-CD1 4.42Å; F204-F208 AromaticContact CZ-CD2 3.72Å; F204-F208 HydrophobicContact CZ-CD2 3.72Å; F204-F208 HydrophobicContact CZ-CE1 4.02Å; F204-F208 AromaticContact CZ-CE2 3.22Å; F204-F208 HydrophobicContact CZ-CE2 3.22Å; F204-F208 HydrophobicContact CZ-CG 4.3Å; F204-F208 AromaticContact CZ-CZ 3.4Å; F204-F208 HydrophobicContact CZ-CZ 3.4Å; F204-F208 VanDerWaalsContact CZ-CZ 3.4Å; F204-F208 VanDerWaalsContact O-CB 3.26Å; F204-F208 WeakPolarHBondContact O-CB 3.31Å; F204-F208 VanDerWaalsContact O-CD1 3.31Å; F204-F208 WeakPolarHBondContact O-CD1 3.46Å; F204-F208 WeakPolarHBondContact O-CG 3.22Å; F204-F208 PolarHBondContact O-N 3.42Å
205	F	96.1	Very high	94.8	Very high	136 Å²	136	48.8 Å²	48.8	60%	0.596	25%	0.246	S	C	*	.	H	α-helix	trans	-69.4	-36.9	-179.2	-64.3	-68.8	0	0	0	112.8	M201 T202 E209	M201-F205 VanDerWaalsContact O-CD2 3.29Å; M201-F205 WeakPolarHBondContact O-CD2 3.3Å; T202-F205 PolarHBondContact O-N 3.05Å; F205-E209 PolarHBondContact O-N 3.16Å
206	W	95.1	Very high	94.9	Very high	109 Å²	109	53.8 Å²	53.8	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-65	-46.8	179.1	-62.8	-12.7	0	0	0	112.3	T202 P203 E209	T202-W206 PolarHBondContact O-N 3.34Å; P203-W206 PolarHBondContact O-N 3.12Å; W206-E209 WeakPolarHBondContact O-CB 3.45Å; W206-E209 PolarHBondContact O-N 2.92Å
207	M	96	Very high	95	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.02	26%	0.257	C	S	.	.	H	α-helix	trans	-80.8	-20.6	-177.7	-63.1	-65.4	-104.5	0	0	112.7	I188 T192 P203 E209 E210 R211 F255 R258 I259 V262	I188-M207 HydrophobicContact CD1-CE 4.45Å; I188-M207 HydrophobicContact CG1-CE 4.06Å; I188-M207 HydrophobicContact CG2-CB 3.62Å; T192-M207 HydrophobicContact CG2-CB 3.78Å; T192-M207 HydrophobicContact CG2-CG 4.12Å; P203-M207 PolarHBondContact O-N 3.32Å; P203-M207 VanDerWaalsContact O-N 3.09Å; M207-E209 VanDerWaalsContact C-N 3.28Å; M207-E210 PolarHBondContact O-N 3.46Å; M207-R211 WeakPolarHBondContact O-CB 3.33Å; M207-R211 PolarHBondContact O-N 3Å; M207-F255 HydrophobicContact CE-CE2 3.97Å; M207-F255 HydrophobicContact CE-CZ 4.01Å; M207-F255 HydrophobicContact SD-CE2 4.32Å; M207-R258 HydrophobicContact SD-CB 4.34Å; M207-I259 HydrophobicContact CE-CG1 4.47Å; M207-V262 HydrophobicContact CE-CG2 4.1Å; M207-V262 HydrophobicContact CG-CG2 3.61Å; M207-V262 HydrophobicContact SD-CG2 3.71Å
208	F	96.1	Very high	95.2	Very high	56 Å²	56	50.1 Å²	50.1	25%	0.246	25%	0.249	C	C	.	.	H	α-helix	trans	-70.4	-26	172.5	-89.8	40	0	0	0	112.6	M189 F204 R211 E212	M189-F208 HydrophobicContact CE-CZ 3.84Å; M189-F208 HydrophobicContact SD-CE1 4.19Å; M189-F208 HydrophobicContact SD-CZ 3.73Å; F204-F208 HydrophobicContact CD2-CD1 4.23Å; F204-F208 AromaticContact CD2-CE1 3.82Å; F204-F208 HydrophobicContact CD2-CE1 3.82Å; F204-F208 AromaticContact CD2-CZ 3.98Å; F204-F208 HydrophobicContact CD2-CZ 3.98Å; F204-F208 AromaticContact CE1-CD2 3.97Å; F204-F208 HydrophobicContact CE1-CD2 3.97Å; F204-F208 AromaticContact CE1-CE2 3.96Å; F204-F208 HydrophobicContact CE1-CE2 3.96Å; F204-F208 HydrophobicContact CE1-CG 4.38Å; F204-F208 HydrophobicContact CE1-CZ 4.36Å; F204-F208 HydrophobicContact CE2-CD1 4.16Å; F204-F208 HydrophobicContact CE2-CD2 4.22Å; F204-F208 AromaticContact CE2-CE1 3.5Å; F204-F208 HydrophobicContact CE2-CE1 3.5Å; F204-F208 AromaticContact CE2-CE2 3.57Å; F204-F208 HydrophobicContact CE2-CE2 3.57Å; F204-F208 HydrophobicContact CE2-CG 4.49Å; F204-F208 AromaticContact CE2-CZ 3.16Å; F204-F208 HydrophobicContact CE2-CZ 3.16Å; F204-F208 HydrophobicContact CZ-CD1 4.42Å; F204-F208 AromaticContact CZ-CD2 3.72Å; F204-F208 HydrophobicContact CZ-CD2 3.72Å; F204-F208 HydrophobicContact CZ-CE1 4.02Å; F204-F208 AromaticContact CZ-CE2 3.22Å; F204-F208 HydrophobicContact CZ-CE2 3.22Å; F204-F208 HydrophobicContact CZ-CG 4.3Å; F204-F208 AromaticContact CZ-CZ 3.4Å; F204-F208 HydrophobicContact CZ-CZ 3.4Å; F204-F208 VanDerWaalsContact CZ-CZ 3.4Å; F204-F208 VanDerWaalsContact O-CB 3.26Å; F204-F208 WeakPolarHBondContact O-CB 3.31Å; F204-F208 VanDerWaalsContact O-CD1 3.31Å; F204-F208 WeakPolarHBondContact O-CD1 3.46Å; F204-F208 WeakPolarHBondContact O-CG 3.22Å; F204-F208 PolarHBondContact O-N 3.42Å; F208-R211 PolarHBondContact O-N 2.88Å; F208-E212 PolarHBondContact O-N 2.63Å
209	E	96.3	Very high	95.3	Very high	88 Å²	88	52.8 Å²	52.8	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-46.3	167.7	-166.8	-155.7	149.2	0	0	110.9	F205 W206 M207 R211 E212 K213 R258	F205-E209 PolarHBondContact O-N 3.16Å; W206-E209 WeakPolarHBondContact O-CB 3.45Å; W206-E209 PolarHBondContact O-N 2.92Å; M207-E209 VanDerWaalsContact C-N 3.28Å; E209-R211 VanDerWaalsContact C-N 3.34Å; E209-E212 WeakPolarHBondContact O-CB 3.3Å; E209-E212 PolarHBondContact O-N 2.64Å; E209-K213 PolarHBondContact O-N 3.32Å; E209-K213 WeakPolarHBondContact OE1-CE 3.44Å; E209-K213 IonicContact OE1-NZ 3.94Å; E209-K213 PolarHBondContact OE1-NZ 2.88Å; E209-R258 IonicContact OE2-CZ 3.75Å; E209-R258 IonicContact OE2-NH1 2.71Å; E209-R258 PolarHBondContact OE2-NH1 2.92Å; E209-R258 IonicContact OE2-NH2 2.73Å
210	E	95.3	Very high	95.5	Very high	4 Å²	4	55 Å²	55	2%	0.019	25%	0.254	C	S	.	.	H	α-helix	trans	-67.8	-35.1	176.8	-63.1	-55.4	137.3	0	0	112.2	M207 E212 K213 M214 W251 F255 R258	M207-E210 PolarHBondContact O-N 3.46Å; E210-E212 VanDerWaalsContact C-N 3.3Å; E210-E212 PolarHBondContact O-N 3.38Å; E210-K213 PolarHBondContact O-N 3.35Å; E210-K213 IonicContact OE1-NZ 2.61Å; E210-K213 PolarHBondContact OE1-NZ 2.91Å; E210-K213 IonicContact OE2-NZ 3.58Å; E210-M214 PolarHBondContact O-N 3.23Å; E210-M214 VanDerWaalsContact O-N 3.14Å; E210-W251 PolarHBondContact OE2-NE1 3.01Å; E210-F255 HydrophobicContact CB-CD2 4.08Å; E210-F255 HydrophobicContact CB-CE2 4Å; E210-F255 HydrophobicContact CG-CD2 4.02Å; E210-F255 HydrophobicContact CG-CE2 4.23Å; E210-R258 HydrophobicContact CG-CB 4.35Å; E210-R258 HydrophobicContact CG-CG 4.06Å; E210-R258 IonicContact OE1-CZ 3.1Å; E210-R258 IonicContact OE1-NH1 2.72Å
211	R	95.6	Very high	95.6	Very high	22 Å²	22	54.1 Å²	54.1	8%	0.083	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-37.8	172.5	-172	156.3	-172.2	-89.1	-2.7	112.4	L185 I188 M189 M207 F208 E209 M214 F215	L185-R211 HydrophobicContact CD2-CB 4.42Å; L185-R211 HydrophobicContact CD2-CG 3.6Å; I188-R211 HydrophobicContact CG2-CB 4.47Å; M189-R211 VanDerWaalsContact CE-CZ 3.48Å; M207-R211 WeakPolarHBondContact O-CB 3.33Å; M207-R211 PolarHBondContact O-N 3Å; F208-R211 PolarHBondContact O-N 2.88Å; E209-R211 VanDerWaalsContact C-N 3.34Å; R211-M214 PolarHBondContact O-N 3.47Å; R211-F215 HydrophobicContact CG-CD2 4.45Å; R211-F215 HydrophobicContact CG-CE2 4.04Å; R211-F215 HydrophobicContact CG-CZ 4.33Å; R211-F215 VanDerWaalsContact CZ-CZ 3.42Å; R211-F215 PolarHBondContact O-N 2.94Å
212	E	96.9	Very high	95.6	Very high	89 Å²	89	49.7 Å²	49.7	42%	0.416	23%	0.227	S	C	.	.	H	α-helix	trans	-66.1	-43.5	176.8	-170.1	68.3	179.7	0	0	111.9	F208 E209 E210 M214 F215 E216 R225	F208-E212 PolarHBondContact O-N 2.63Å; E209-E212 WeakPolarHBondContact O-CB 3.3Å; E209-E212 PolarHBondContact O-N 2.64Å; E210-E212 VanDerWaalsContact C-N 3.3Å; E210-E212 PolarHBondContact O-N 3.38Å; E212-M214 VanDerWaalsContact C-N 3.28Å; E212-M214 PolarHBondContact O-N 3.38Å; E212-F215 WeakPolarHBondContact O-CB 3.5Å; E212-F215 PolarHBondContact O-N 2.93Å; E212-E216 PolarHBondContact O-N 3.12Å; E212-R225 IonicContact OE1-CZ 2.78Å; E212-R225 IonicContact OE1-NH1 3.71Å; E212-R225 PolarHBondContact OE1-NH1 3.19Å; E212-R225 IonicContact OE1-NH2 3.65Å; E212-R225 PolarHBondContact OE1-NH2 3.07Å; E212-R225 IonicContact OE2-CZ 3.37Å; E212-R225 IonicContact OE2-NH2 2.75Å; E212-R225 PolarHBondContact OE2-NH2 3.06Å
213	K	96.1	Very high	95.6	Very high	68 Å²	68	49.2 Å²	49.2	30%	0.296	24%	0.237	S	C	.	.	H	α-helix	trans	-58.6	-40.9	174.7	-65.3	171.3	-168.9	163	0	111.5	E209 E210 F215 E216 F217	E209-K213 PolarHBondContact O-N 3.32Å; E209-K213 WeakPolarHBondContact OE1-CE 3.44Å; E209-K213 IonicContact OE1-NZ 3.94Å; E209-K213 PolarHBondContact OE1-NZ 2.88Å; E210-K213 PolarHBondContact O-N 3.35Å; E210-K213 IonicContact OE1-NZ 2.61Å; E210-K213 PolarHBondContact OE1-NZ 2.91Å; E210-K213 IonicContact OE2-NZ 3.58Å; K213-F215 PolarHBondContact O-N 3.05Å; K213-E216 VanDerWaalsContact O-CB 3.29Å; K213-E216 WeakPolarHBondContact O-CB 3.36Å; K213-E216 PolarHBondContact O-N 3Å; K213-F217 PolarHBondContact O-N 3.44Å
214	M	95.4	Very high	95.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-34.1	174.4	-73.5	-170.5	-76.6	0	0	113.1	L181 I184 L185 I188 E210 R211 E212 E216 F217 Y218 W251	L181-M214 HydrophobicContact CD2-SD 4.32Å; I184-M214 HydrophobicContact CB-SD 4.28Å; I184-M214 HydrophobicContact CG2-CE 3.81Å; I184-M214 HydrophobicContact CG2-SD 3.96Å; L185-M214 HydrophobicContact CD1-CB 4.41Å; L185-M214 HydrophobicContact CD2-CB 3.7Å; L185-M214 HydrophobicContact CD2-CE 3.51Å; L185-M214 HydrophobicContact CD2-CG 4.46Å; L185-M214 HydrophobicContact CD2-SD 4Å; L185-M214 HydrophobicContact CG-CB 4.13Å; L185-M214 HydrophobicContact CG-CE 3.83Å; L185-M214 HydrophobicContact CG-SD 3.81Å; I188-M214 HydrophobicContact CD1-CE 3.46Å; I188-M214 VanDerWaalsContact CD1-CE 3.46Å; E210-M214 PolarHBondContact O-N 3.23Å; E210-M214 VanDerWaalsContact O-N 3.14Å; R211-M214 PolarHBondContact O-N 3.47Å; E212-M214 VanDerWaalsContact C-N 3.28Å; E212-M214 PolarHBondContact O-N 3.38Å; M214-E216 VanDerWaalsContact C-N 3.27Å; M214-E216 PolarHBondContact O-N 3Å; M214-F217 HydrophobicContact CG-CD2 4.45Å; M214-F217 WeakPolarHBondContact O-CB 3.43Å; M214-F217 PolarHBondContact O-N 2.85Å; M214-F217 VanDerWaalsContact O-N 3.15Å; M214-Y218 VanDerWaalsContact O-CD1 3.24Å; M214-Y218 WeakPolarHBondContact O-CD1 3.42Å; M214-Y218 PolarHBondContact O-N 2.74Å; M214-W251 HydrophobicContact CE-CZ2 4.02Å; M214-W251 HydrophobicContact CG-CH2 4.13Å; M214-W251 HydrophobicContact CG-CZ2 3.7Å; M214-W251 HydrophobicContact SD-CH2 3.62Å; M214-W251 HydrophobicContact SD-CZ2 3.52Å; M214-W251 VanDerWaalsContact SD-CZ2 3.52Å
215	F	96.6	Very high	95.6	Very high	10 Å²	10	54 Å²	54	4%	0.044	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-29.7	172.6	-73.5	-35.6	0	0	0	113.1	M148 L185 R211 E212 K213 F217 Y218 E219 R225 M226	M148-F215 HydrophobicContact CE-CE1 4.16Å; L185-F215 HydrophobicContact CD2-CE1 4.37Å; R211-F215 HydrophobicContact CG-CD2 4.45Å; R211-F215 HydrophobicContact CG-CE2 4.04Å; R211-F215 HydrophobicContact CG-CZ 4.33Å; R211-F215 VanDerWaalsContact CZ-CZ 3.42Å; R211-F215 PolarHBondContact O-N 2.94Å; E212-F215 WeakPolarHBondContact O-CB 3.5Å; E212-F215 PolarHBondContact O-N 2.93Å; K213-F215 PolarHBondContact O-N 3.05Å; F215-F217 VanDerWaalsContact C-N 3.32Å; F215-Y218 PolarHBondContact O-N 3.18Å; F215-E219 WeakPolarHBondContact O-CB 3.46Å; F215-E219 PolarHBondContact O-N 3.14Å; F215-R225 HydrophobicContact CB-CB 4.43Å; F215-R225 WeakPolarHBondContact CD1-O 3.48Å; F215-M226 HydrophobicContact CD1-CG 4.32Å; F215-M226 HydrophobicContact CE1-CG 3.67Å; F215-M226 HydrophobicContact CZ-CG 3.74Å; F215-M226 HydrophobicContact CZ-SD 4.04Å
216	E	96.9	Very high	95.4	Very high	104 Å²	104	51.5 Å²	51.5	49%	0.486	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-40	170.3	-166.3	-175	158.8	0	0	111.2	E212 K213 M214 Y218 E219 R220	E212-E216 PolarHBondContact O-N 3.12Å; K213-E216 VanDerWaalsContact O-CB 3.29Å; K213-E216 WeakPolarHBondContact O-CB 3.36Å; K213-E216 PolarHBondContact O-N 3Å; M214-E216 VanDerWaalsContact C-N 3.27Å; M214-E216 PolarHBondContact O-N 3Å; E216-Y218 VanDerWaalsContact C-N 3.28Å; E216-Y218 PolarHBondContact O-N 3.46Å; E216-E219 PolarHBondContact O-N 3.39Å; E216-R220 WeakPolarHBondContact O-CB 3.43Å; E216-R220 WeakPolarHBondContact O-CG 3.3Å; E216-R220 PolarHBondContact O-N 3.37Å
217	F	96.6	Very high	95.4	Very high	12 Å²	12	49.7 Å²	49.7	5%	0.053	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-33.5	174.4	-56.9	-31.9	0	0	0	112.8	Y178 K213 M214 F215 V221 L244 D247 I248 W251	Y178-F217 PolarHBondContact OH-O 3.29Å; K213-F217 PolarHBondContact O-N 3.44Å; M214-F217 HydrophobicContact CG-CD2 4.45Å; M214-F217 WeakPolarHBondContact O-CB 3.43Å; M214-F217 PolarHBondContact O-N 2.85Å; M214-F217 VanDerWaalsContact O-N 3.15Å; F215-F217 VanDerWaalsContact C-N 3.32Å; F217-V221 PolarHBondContact O-N 3.37Å; F217-L244 HydrophobicContact CB-CD1 4.41Å; F217-L244 HydrophobicContact CD1-CD1 3.73Å; F217-L244 HydrophobicContact CE1-CD1 4.42Å; F217-L244 HydrophobicContact CG-CD1 4.37Å; F217-D247 HydrophobicContact CE1-CB 3.96Å; F217-I248 HydrophobicContact CD1-CG1 4.31Å; F217-I248 HydrophobicContact CD2-CG1 3.98Å; F217-I248 HydrophobicContact CE1-CG1 4.3Å; F217-I248 HydrophobicContact CE2-CG1 3.98Å; F217-I248 HydrophobicContact CG-CG1 4.15Å; F217-I248 HydrophobicContact CZ-CG1 4.14Å; F217-W251 HydrophobicContact CE2-CB 4Å; F217-W251 HydrophobicContact CE2-CD2 4.12Å; F217-W251 HydrophobicContact CE2-CE3 4.37Å; F217-W251 AromaticContact CE2-CG 3.93Å; F217-W251 HydrophobicContact CE2-CG 3.93Å; F217-W251 HydrophobicContact CZ-CB 3.82Å; F217-W251 HydrophobicContact CZ-CG 4.18Å
218	Y	95.6	Very high	95.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71.8	-41.8	176.8	-81.4	45.2	0	0	0	110.5	M148 M149 Y178 L181 T182 L185 M214 F215 E216 V221 S222 A224	M148-Y218 HydrophobicContact CE-CD2 3.7Å; M148-Y218 HydrophobicContact CE-CE2 3.48Å; M148-Y218 VanDerWaalsContact CE-CE2 3.48Å; M149-Y218 HydrophobicContact CE-CD2 4.04Å; M149-Y218 HydrophobicContact CE-CE2 4.03Å; M149-Y218 HydrophobicContact CG-CE2 3.83Å; Y178-Y218 HydrophobicContact CD1-CD1 4.28Å; Y178-Y218 AromaticContact CD1-CE1 3.78Å; Y178-Y218 HydrophobicContact CD1-CE1 3.78Å; Y178-Y218 AromaticContact CE1-CD1 3.94Å; Y178-Y218 HydrophobicContact CE1-CD1 3.94Å; Y178-Y218 AromaticContact CE1-CE1 3.86Å; Y178-Y218 HydrophobicContact CE1-CE1 3.86Å; L181-Y218 HydrophobicContact CB-CE1 4.42Å; T182-Y218 WeakPolarHBondContact CA-OH 3.35Å; T182-Y218 WeakPolarHBondContact CB-OH 3.43Å; T182-Y218 PolarHBondContact N-OH 3.21Å; T182-Y218 PolarHBondContact OG1-OH 2.92Å; L185-Y218 HydrophobicContact CD1-CD1 4.48Å; L185-Y218 HydrophobicContact CD1-CE1 3.74Å; L185-Y218 HydrophobicContact CD1-CE2 4.09Å; L185-Y218 WeakPolarHBondContact CD1-OH 3.49Å; M214-Y218 VanDerWaalsContact O-CD1 3.24Å; M214-Y218 WeakPolarHBondContact O-CD1 3.42Å; M214-Y218 PolarHBondContact O-N 2.74Å; F215-Y218 PolarHBondContact O-N 3.18Å; E216-Y218 VanDerWaalsContact C-N 3.28Å; E216-Y218 PolarHBondContact O-N 3.46Å; Y218-V221 PolarHBondContact O-N 3.05Å; Y218-S222 WeakPolarHBondContact O-CB 3.4Å; Y218-S222 PolarHBondContact O-N 3.23Å; Y218-S222 PolarHBondContact O-OG 3.11Å; Y218-A224 CarbonylContact C-O 3.6Å; Y218-A224 VanDerWaalsContact C-O 3.26Å
219	E	96.1	Very high	95.2	Very high	93 Å²	93	48.5 Å²	48.5	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-43.7	176.4	-173.4	175.3	169.5	0	0	111.5	F215 E216 V221 G223 A224 R225	F215-E219 WeakPolarHBondContact O-CB 3.46Å; F215-E219 PolarHBondContact O-N 3.14Å; E216-E219 PolarHBondContact O-N 3.39Å; E219-V221 VanDerWaalsContact C-N 3.26Å; E219-V221 PolarHBondContact O-N 3.46Å; E219-G223 WeakPolarHBondContact O-CA 3.49Å; E219-G223 PolarHBondContact O-N 3.44Å; E219-A224 WeakPolarHBondContact CA-O 3.24Å; E219-A224 PolarHBondContact N-O 3.22Å; E219-R225 HydrophobicContact CB-CG 4.02Å; E219-R225 HydrophobicContact CG-CG 4.29Å; E219-R225 WeakPolarHBondContact OE2-CD 3.41Å; E219-R225 VanDerWaalsContact OE2-CG 3.22Å; E219-R225 WeakPolarHBondContact OE2-CG 3.49Å
220	R	95.7	Very high	95.2	Very high	97 Å²	97	44.4 Å²	44.4	37%	0.366	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-31	179.2	-75.6	178.4	66	177	-9.4	113.3	E216 P241 L244 D247	E216-R220 WeakPolarHBondContact O-CB 3.43Å; E216-R220 WeakPolarHBondContact O-CG 3.3Å; E216-R220 PolarHBondContact O-N 3.37Å; R220-P241 HydrophobicContact CB-CG 4.4Å; R220-L244 HydrophobicContact CB-CD1 4.41Å; R220-D247 IonicContact CZ-OD2 2.91Å; R220-D247 IonicContact NH1-OD2 2.82Å; R220-D247 PolarHBondContact NH1-OD2 3.42Å; R220-D247 IonicContact NH2-OD2 2.89Å; R220-D247 PolarHBondContact NH2-OD2 2.63Å
221	V	95.3	Very high	95.3	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.03	23%	0.23	C	C	.	.	H	α-helix	trans	-90.2	-36.8	-178.4	167.7	0	0	0	0	113.9	Y178 F217 Y218 E219 Y230 L240 P241 L244	Y178-V221 HydrophobicContact CE2-CG1 4.4Å; Y178-V221 HydrophobicContact CE2-CG2 4.3Å; Y178-V221 WeakPolarHBondContact OH-CG2 2.97Å; F217-V221 PolarHBondContact O-N 3.37Å; Y218-V221 PolarHBondContact O-N 3.05Å; E219-V221 VanDerWaalsContact C-N 3.26Å; E219-V221 PolarHBondContact O-N 3.46Å; V221-Y230 HydrophobicContact CG1-CD1 4.01Å; V221-Y230 HydrophobicContact CG1-CD2 3.67Å; V221-Y230 HydrophobicContact CG1-CE1 3.51Å; V221-Y230 HydrophobicContact CG1-CE2 3.15Å; V221-Y230 HydrophobicContact CG1-CG 4.08Å; V221-Y230 WeakPolarHBondContact CG1-OH 3.46Å; V221-L240 HydrophobicContact CG2-CD2 3.97Å; V221-P241 HydrophobicContact CG2-CG 4.46Å; V221-L244 HydrophobicContact CG2-CD2 3.2Å
222	S	93.3	Very high	95.3	Very high	35 Å²	35	45.7 Å²	45.7	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-112.5	-20.2	-173.8	70.6	0	0	0	0	114.3	Y218 A224	Y218-S222 WeakPolarHBondContact O-CB 3.4Å; Y218-S222 PolarHBondContact O-N 3.23Å; Y218-S222 PolarHBondContact O-OG 3.11Å; S222-A224 VanDerWaalsContact C-N 3.27Å; S222-A224 PolarHBondContact OG-N 3.15Å; S222-A224 VanDerWaalsContact OG-N 3.12Å; S222-A224 PolarHBondContact OG-O 3.35Å
223	G	93.9	Very high	95.2	Very high	63 Å²	63	41.9 Å²	41.9	65%	0.649	22%	0.218	S	C	*	.	S	Bend	trans	83.2	-3.9	-167.8	0	0	0	0	0	114	E219	E219-G223 WeakPolarHBondContact O-CA 3.49Å; E219-G223 PolarHBondContact O-N 3.44Å
224	A	94.5	Very high	95	Very high	33 Å²	33	38.8 Å²	38.8	27%	0.273	21%	0.205	S	C	.	.			trans	-121.4	142.7	177.4	0	0	0	0	0	111	Y218 E219 S222 H227	Y218-A224 CarbonylContact C-O 3.6Å; Y218-A224 VanDerWaalsContact C-O 3.26Å; E219-A224 WeakPolarHBondContact CA-O 3.24Å; E219-A224 PolarHBondContact N-O 3.22Å; S222-A224 VanDerWaalsContact C-N 3.27Å; S222-A224 PolarHBondContact OG-N 3.15Å; S222-A224 VanDerWaalsContact OG-N 3.12Å; S222-A224 PolarHBondContact OG-O 3.35Å; A224-H227 VanDerWaalsContact CB-O 3.22Å; A224-H227 WeakPolarHBondContact CB-O 3.44Å
225	R	93.6	Very high	94.9	Very high	107 Å²	107	38.8 Å²	38.8	40%	0.404	21%	0.205	S	C	.	.	S	Bend	trans	-75.1	-32.7	-178.2	-71.3	-179.8	51.1	165.3	-6	114.1	E212 F215 E219	E212-R225 IonicContact OE1-CZ 2.78Å; E212-R225 IonicContact OE1-NH1 3.71Å; E212-R225 PolarHBondContact OE1-NH1 3.19Å; E212-R225 IonicContact OE1-NH2 3.65Å; E212-R225 PolarHBondContact OE1-NH2 3.07Å; E212-R225 IonicContact OE2-CZ 3.37Å; E212-R225 IonicContact OE2-NH2 2.75Å; E212-R225 PolarHBondContact OE2-NH2 3.06Å; F215-R225 HydrophobicContact CB-CB 4.43Å; F215-R225 WeakPolarHBondContact CD1-O 3.48Å; E219-R225 HydrophobicContact CB-CG 4.02Å; E219-R225 HydrophobicContact CG-CG 4.29Å; E219-R225 WeakPolarHBondContact OE2-CD 3.41Å; E219-R225 VanDerWaalsContact OE2-CG 3.22Å; E219-R225 WeakPolarHBondContact OE2-CG 3.49Å
226	M	91.8	Very high	94.8	Very high	82 Å²	82	38.3 Å²	38.3	40%	0.404	20%	0.203	S	C	.	.	S	Bend	trans	-122.1	-71.6	-179.7	-68.7	-171.1	-68	0	0	112.5	M148 F215 A228	M148-M226 HydrophobicContact CE-CB 4.15Å; M148-M226 HydrophobicContact CE-CG 4.47Å; M148-M226 VanDerWaalsContact CE-O 3.25Å; M148-M226 WeakPolarHBondContact CE-O 3.44Å; M148-M226 WeakPolarHBondContact CG-O 3.41Å; F215-M226 HydrophobicContact CD1-CG 4.32Å; F215-M226 HydrophobicContact CE1-CG 3.67Å; F215-M226 HydrophobicContact CZ-CG 3.74Å; F215-M226 HydrophobicContact CZ-SD 4.04Å; M226-A228 PolarHBondContact O-N 2.85Å; M226-A228 VanDerWaalsContact O-N 3.1Å
227	H	96.3	Very high	94.7	Very high	72 Å²	72	35.5 Å²	35.5	33%	0.333	19%	0.19	S	C	.	.			trans	-79.9	96.3	-176.6	-56.1	-54.1	0	0	0	110.4	D141 A224	D141-H227 HydrophobicContact CB-CB 4.29Å; D141-H227 PolarHBondContact O-CE1 3.5Å; D141-H227 VanDerWaalsContact O-CE1 3.3Å; D141-H227 PolarHBondContact O-ND1 3.2Å; A224-H227 VanDerWaalsContact CB-O 3.22Å; A224-H227 WeakPolarHBondContact CB-O 3.44Å
228	A	92.8	Very high	94.5	Very high	12 Å²	12	40 Å²	40	10%	0.099	21%	0.211	C	C	.	.			trans	-88.8	-29.4	-166.9	0	0	0	0	0	114.5	M149 M226 Y230	M149-A228 HydrophobicContact CE-CB 3.34Å; M149-A228 HydrophobicContact SD-CB 4.02Å; M226-A228 PolarHBondContact O-N 2.85Å; M226-A228 VanDerWaalsContact O-N 3.1Å; A228-Y230 PolarHBondContact O-N 2.76Å
229	A	95.4	Very high	94.5	Very high	22 Å²	22	42.9 Å²	42.9	18%	0.182	23%	0.227	C	C	.	.			trans	47.9	38.4	-170.9	0	0	0	0	0	112.8	D141 E152 R232	D141-A229 PolarHBondContact OD2-N 3.28Å; E152-A229 WeakPolarHBondContact OE1-CA 3.39Å; E152-A229 PolarHBondContact OE1-N 2.92Å; A229-R232 PolarHBondContact O-NE 3.37Å; A229-R232 PolarHBondContact O-NH2 3.22Å
230	Y	96.3	Very high	94.4	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.012	21%	0.21	C	C	.	.			trans	-97	-49.6	-164	179.9	-115.4	0	0	0	112.5	M149 E152 I174 Y178 V221 A228 R232 V236 H237 Q238	M149-Y230 HydrophobicContact CE-CD1 3.9Å; M149-Y230 HydrophobicContact CE-CG 4.14Å; M149-Y230 HydrophobicContact SD-CD1 4.17Å; E152-Y230 PolarHBondContact OE1-N 2.75Å; E152-Y230 PolarHBondContact OE2-N 2.75Å; I174-Y230 HydrophobicContact CG2-CE1 3.91Å; Y178-Y230 HydrophobicContact CD2-CE1 4.27Å; Y178-Y230 HydrophobicContact CE2-CE1 4.41Å; V221-Y230 HydrophobicContact CG1-CD1 4.01Å; V221-Y230 HydrophobicContact CG1-CD2 3.67Å; V221-Y230 HydrophobicContact CG1-CE1 3.51Å; V221-Y230 HydrophobicContact CG1-CE2 3.15Å; V221-Y230 HydrophobicContact CG1-CG 4.08Å; V221-Y230 WeakPolarHBondContact CG1-OH 3.46Å; A228-Y230 PolarHBondContact O-N 2.76Å; Y230-R232 PolarHBondContact O-N 2.87Å; Y230-V236 HydrophobicContact CD1-CG1 3.79Å; Y230-V236 HydrophobicContact CD2-CG1 4Å; Y230-V236 HydrophobicContact CE1-CB 4.49Å; Y230-V236 HydrophobicContact CE1-CG1 3.2Å; Y230-V236 HydrophobicContact CE2-CG1 3.41Å; Y230-V236 VanDerWaalsContact CE2-CG1 3.41Å; Y230-V236 HydrophobicContact CG-CG1 4.16Å; Y230-V236 WeakPolarHBondContact OH-CG1 3.28Å; Y230-H237 HydrophobicContact CD2-CB 4.36Å; Y230-H237 WeakPolarHBondContact O-CB 3.29Å; Y230-H237 PolarHBondContact O-N 2.76Å; Y230-Q238 HydrophobicContact CE2-CB 4.36Å; Y230-Q238 WeakPolarHBondContact CE2-O 3.48Å; Y230-Q238 VanDerWaalsContact CZ-O 3.25Å; Y230-Q238 PolarHBondContact OH-O 2.67Å
231	V	96.6	Very high	94.4	Very high	2 Å²	2	37 Å²	37	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	120	171.7	-179.9	0	0	0	0	107.9	M149 E152 Q153 S156 R175	M149-V231 HydrophobicContact SD-CG2 4.17Å; E152-V231 HydrophobicContact CB-CB 3.77Å; E152-V231 HydrophobicContact CB-CG1 4.38Å; E152-V231 WeakPolarHBondContact OE2-CA 3.26Å; E152-V231 VanDerWaalsContact OE2-CB 3.31Å; E152-V231 WeakPolarHBondContact OE2-CB 3.12Å; E152-V231 PolarHBondContact OE2-N 3.18Å; Q153-V231 HydrophobicContact CB-CG1 4.4Å; S156-V231 WeakPolarHBondContact OG-CG1 3.49Å; R175-V231 HydrophobicContact CG-CG1 4.08Å; R175-V231 HydrophobicContact CG-CG2 4.17Å
232	R	95.6	Very high	94.3	Very high	50 Å²	50	44.9 Å²	44.9	19%	0.189	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	156	-177.1	-60.2	-165.1	178.2	-174.4	4.4	110.2	L137 R175 A229 Y230 G234 G235 H237	L137-R232 HydrophobicContact CD2-CB 4.45Å; L137-R232 HydrophobicContact CD2-CG 3.76Å; R175-R232 PolarHBondContact NH2-O 3.34Å; A229-R232 PolarHBondContact O-NE 3.37Å; A229-R232 PolarHBondContact O-NH2 3.22Å; Y230-R232 PolarHBondContact O-N 2.87Å; R232-G234 PolarHBondContact O-N 3.15Å; R232-G235 PolarHBondContact N-O 3.11Å; R232-G235 CarbonylContact O-C 3.6Å; R232-G235 PolarHBondContact O-N 3.2Å; R232-G235 VanDerWaalsContact O-N 3.15Å; R232-H237 HydrophobicContact CG-CB 4.3Å; R232-H237 PolarHBondContact NH1-ND1 3.23Å
233	P	95.7	Very high	94.3	Very high	9 Å²	9	45 Å²	45	6%	0.058	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	123.5	166.8	-23.7	34.9	0	0	0	110	Y155 V159 Y393	Y155-P233 HydrophobicContact CE1-CG 4.29Å; V159-P233 HydrophobicContact CB-CB 3.91Å; V159-P233 HydrophobicContact CB-CG 3.95Å; V159-P233 HydrophobicContact CG1-CB 3.66Å; V159-P233 HydrophobicContact CG1-CG 3.99Å; V159-P233 HydrophobicContact CG2-CG 4.21Å; P233-Y393 WeakPolarHBondContact CB-OH 3.39Å; P233-Y393 WeakPolarHBondContact CG-OH 3.41Å
234	G	90.8	Very high	94.4	Very high	3 Å²	3	42 Å²	42	3%	0.031	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	18.5	-174.5	0	0	0	0	0	115.3	E160 R232 K361 V362	E160-G234 WeakPolarHBondContact OE1-CA 3.41Å; E160-G234 PolarHBondContact OE1-N 2.86Å; R232-G234 PolarHBondContact O-N 3.15Å; G234-K361 WeakPolarHBondContact O-CA 3.28Å; G234-V362 WeakPolarHBondContact O-CG2 3.43Å; G234-V362 PolarHBondContact O-N 2.9Å
235	G	93.5	Very high	94.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	118.3	-126.6	176.3	0	0	0	0	0	113.7	E160 R175 R232	E160-G235 PolarHBondContact OE1-N 2.92Å; R175-G235 PolarHBondContact NE-O 3.2Å; R175-G235 PolarHBondContact NH2-O 3.33Å; R232-G235 PolarHBondContact N-O 3.11Å; R232-G235 CarbonylContact O-C 3.6Å; R232-G235 PolarHBondContact O-N 3.2Å; R232-G235 VanDerWaalsContact O-N 3.15Å
236	V	95.3	Very high	94.5	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149	-175	170.1	0	0	0	0	110.1	A171 I174 R175 Y230 Q238 I360 K361	A171-V236 HydrophobicContact CB-CG2 4.26Å; I174-V236 HydrophobicContact CG2-CG1 4.34Å; I174-V236 HydrophobicContact CG2-CG2 4.27Å; R175-V236 HydrophobicContact CG-CG2 3.86Å; Y230-V236 HydrophobicContact CD1-CG1 3.79Å; Y230-V236 HydrophobicContact CD2-CG1 4Å; Y230-V236 HydrophobicContact CE1-CB 4.49Å; Y230-V236 HydrophobicContact CE1-CG1 3.2Å; Y230-V236 HydrophobicContact CE2-CG1 3.41Å; Y230-V236 VanDerWaalsContact CE2-CG1 3.41Å; Y230-V236 HydrophobicContact CG-CG1 4.16Å; Y230-V236 WeakPolarHBondContact OH-CG1 3.28Å; V236-Q238 WeakPolarHBondContact CG1-O 3.26Å; V236-I360 HydrophobicContact CB-CG2 3.5Å; V236-I360 VanDerWaalsContact CB-CG2 3.5Å; V236-I360 HydrophobicContact CG1-CG2 3.84Å; V236-I360 PolarHBondContact N-O 2.75Å; V236-K361 WeakPolarHBondContact O-CE 3.17Å; V236-K361 VanDerWaalsContact O-CG 3.27Å; V236-K361 WeakPolarHBondContact O-CG 3.33Å
237	H	93.3	Very high	94.8	Very high	44 Å²	44	42 Å²	42	20%	0.204	23%	0.228	C	C	.	.	S	Bend	trans	-69.4	-45.4	-169.4	-177.4	50.7	0	0	0	114.4	Y230 R232 K361	Y230-H237 HydrophobicContact CD2-CB 4.36Å; Y230-H237 WeakPolarHBondContact O-CB 3.29Å; Y230-H237 PolarHBondContact O-N 2.76Å; R232-H237 HydrophobicContact CG-CB 4.3Å; R232-H237 PolarHBondContact NH1-ND1 3.23Å; H237-K361 WeakPolarHBondContact O-CE 3.26Å; H237-K361 PolarHBondContact O-NZ 2.86Å; H237-K361 VanDerWaalsContact O-NZ 3.1Å
238	Q	93.2	Very high	94.7	Very high	108 Å²	108	38.5 Å²	38.5	51%	0.505	21%	0.212	S	C	.	.	S	Bend	trans	-137.8	153.6	-178.4	-71.8	179.2	25.4	0	0	109.4	Y230 V236	Y230-Q238 HydrophobicContact CE2-CB 4.36Å; Y230-Q238 WeakPolarHBondContact CE2-O 3.48Å; Y230-Q238 VanDerWaalsContact CZ-O 3.25Å; Y230-Q238 PolarHBondContact OH-O 2.67Å; V236-Q238 WeakPolarHBondContact CG1-O 3.26Å
239	D	94.9	Very high	94.9	Very high	60 Å²	60	42.7 Å²	42.7	32%	0.321	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-72.4	167.4	174.2	-151.2	-9.2	0	0	0	111.2	R170 I360	R170-D239 IonicContact CZ-OD1 2.69Å; R170-D239 IonicContact CZ-OD2 3Å; R170-D239 IonicContact NE-OD1 3.48Å; R170-D239 PolarHBondContact NE-OD1 3.46Å; R170-D239 VanDerWaalsContact NE-OD1 3.17Å; R170-D239 IonicContact NE-OD2 3.63Å; R170-D239 PolarHBondContact NE-OD2 3.11Å; R170-D239 IonicContact NH2-OD1 3.17Å; R170-D239 PolarHBondContact NH2-OD1 2.82Å; R170-D239 IonicContact NH2-OD2 3.23Å; R170-D239 PolarHBondContact NH2-OD2 3.01Å; D239-I360 HydrophobicContact CB-CD1 3.47Å; D239-I360 VanDerWaalsContact CB-CD1 3.47Å; D239-I360 HydrophobicContact CB-CG1 3.77Å
240	L	94.1	Very high	94.9	Very high	17 Å²	17	47.4 Å²	47.4	9%	0.089	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-62.7	137	169.7	-53.9	177	0	0	0	110.1	I174 Y178 V221 L244 M245 M355	I174-L240 HydrophobicContact CD1-CG 4.19Å; I174-L240 HydrophobicContact CG1-CD1 4.23Å; I174-L240 HydrophobicContact CG1-CG 4.3Å; I174-L240 HydrophobicContact CG2-CD2 4.24Å; Y178-L240 HydrophobicContact CE2-CD2 3.66Å; V221-L240 HydrophobicContact CG2-CD2 3.97Å; L240-L244 HydrophobicContact CB-CD2 4.49Å; L240-L244 HydrophobicContact CD2-CD2 4.17Å; L240-M245 HydrophobicContact CD1-CG 4.23Å; L240-M355 HydrophobicContact CD1-CE 4.38Å; L240-M355 HydrophobicContact CD1-SD 3.83Å
241	P	95.3	Very high	94.9	Very high	48 Å²	48	47.9 Å²	47.9	31%	0.312	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-66.8	151.5	170	28.8	-32.7	0	0	0	110.5	R220 V221 L244	R220-P241 HydrophobicContact CB-CG 4.4Å; V221-P241 HydrophobicContact CG2-CG 4.46Å; P241-L244 HydrophobicContact CG-CB 4.12Å; P241-L244 HydrophobicContact CG-CD2 4.08Å; P241-L244 WeakPolarHBondContact O-CB 3.4Å; P241-L244 PolarHBondContact O-N 2.91Å
242	L	94.6	Very high	94.7	Very high	172 Å²	172	48 Å²	48	90%	0.901	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	138.5	178.4	-61.5	175.1	0	0	0	110.9	L244	L242-L244 VanDerWaalsContact C-N 3.33Å; L242-L244 PolarHBondContact O-N 2.8Å
243	G	93.8	Very high	94.6	Very high	37 Å²	37	51.2 Å²	51.2	38%	0.381	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-12.6	179.8	0	0	0	0	0	115.6	M245 D246 D247	G243-M245 VanDerWaalsContact C-N 3.31Å; G243-M245 PolarHBondContact O-N 3.18Å; G243-D246 PolarHBondContact O-N 2.91Å; G243-D247 PolarHBondContact O-N 3.05Å
244	L	95.4	Very high	94.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-32.7	-176.8	-177.4	66.6	0	0	0	113.8	Y178 F217 R220 V221 L240 P241 L242 D246 D247 I248	Y178-L244 WeakPolarHBondContact OH-CD2 2.91Å; F217-L244 HydrophobicContact CB-CD1 4.41Å; F217-L244 HydrophobicContact CD1-CD1 3.73Å; F217-L244 HydrophobicContact CE1-CD1 4.42Å; F217-L244 HydrophobicContact CG-CD1 4.37Å; R220-L244 HydrophobicContact CB-CD1 4.41Å; V221-L244 HydrophobicContact CG2-CD2 3.2Å; L240-L244 HydrophobicContact CB-CD2 4.49Å; L240-L244 HydrophobicContact CD2-CD2 4.17Å; P241-L244 HydrophobicContact CG-CB 4.12Å; P241-L244 HydrophobicContact CG-CD2 4.08Å; P241-L244 WeakPolarHBondContact O-CB 3.4Å; P241-L244 PolarHBondContact O-N 2.91Å; L242-L244 VanDerWaalsContact C-N 3.33Å; L242-L244 PolarHBondContact O-N 2.8Å; L244-D246 VanDerWaalsContact C-N 3.29Å; L244-D246 PolarHBondContact O-N 3.44Å; L244-D247 PolarHBondContact O-N 2.84Å; L244-I248 HydrophobicContact CD1-CD1 4.42Å; L244-I248 HydrophobicContact CD1-CG1 4.46Å; L244-I248 HydrophobicContact CD2-CD1 4.38Å; L244-I248 HydrophobicContact CG-CD1 3.92Å; L244-I248 HydrophobicContact CG-CG1 4.37Å; L244-I248 VanDerWaalsContact O-CG1 3.31Å; L244-I248 WeakPolarHBondContact O-CG1 3.17Å; L244-I248 PolarHBondContact O-N 3.24Å
245	M	94.9	Very high	94.7	Very high	59 Å²	59	55.8 Å²	55.8	29%	0.291	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-36.4	179.6	-68.1	177.6	64.9	0	0	112.1	L240 G243 Y249 L352 M355	L240-M245 HydrophobicContact CD1-CG 4.23Å; G243-M245 VanDerWaalsContact C-N 3.31Å; G243-M245 PolarHBondContact O-N 3.18Å; M245-Y249 WeakPolarHBondContact O-CB 3.31Å; M245-Y249 PolarHBondContact O-N 3.47Å; M245-L352 HydrophobicContact CB-CD2 3.99Å; M245-L352 HydrophobicContact CE-CD2 4.06Å; M245-L352 HydrophobicContact CG-CD2 4.12Å; M245-M355 HydrophobicContact CE-CB 3.9Å; M245-M355 HydrophobicContact CE-CE 3.65Å; M245-M355 HydrophobicContact CE-CG 4.33Å; M245-M355 HydrophobicContact CE-SD 3.52Å; M245-M355 VanDerWaalsContact CE-SD 3.52Å; M245-M355 HydrophobicContact CG-CE 4.46Å; M245-M355 HydrophobicContact CG-SD 4.39Å; M245-M355 HydrophobicContact SD-CE 4.21Å; M245-M355 HydrophobicContact SD-SD 3.58Å
246	D	95.8	Very high	94.7	Very high	109 Å²	109	58.1 Å²	58.1	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-68.5	-42.2	178.2	-60.1	-36.4	0	0	0	110.3	G243 L244 I248 Y249 E250	G243-D246 PolarHBondContact O-N 2.91Å; L244-D246 VanDerWaalsContact C-N 3.29Å; L244-D246 PolarHBondContact O-N 3.44Å; D246-I248 PolarHBondContact O-N 3.46Å; D246-Y249 WeakPolarHBondContact O-CB 3.39Å; D246-Y249 PolarHBondContact O-N 3.39Å; D246-Y249 VanDerWaalsContact O-N 3.14Å; D246-E250 PolarHBondContact O-N 3.43Å
247	D	96.3	Very high	94.7	Very high	53 Å²	53	63.1 Å²	63.1	28%	0.283	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-42.1	177.5	-58.4	-37.7	0	0	0	111.9	F217 R220 G243 L244 Y249 E250 W251	F217-D247 HydrophobicContact CE1-CB 3.96Å; R220-D247 IonicContact CZ-OD2 2.91Å; R220-D247 IonicContact NH1-OD2 2.82Å; R220-D247 PolarHBondContact NH1-OD2 3.42Å; R220-D247 IonicContact NH2-OD2 2.89Å; R220-D247 PolarHBondContact NH2-OD2 2.63Å; G243-D247 PolarHBondContact O-N 3.05Å; L244-D247 PolarHBondContact O-N 2.84Å; D247-Y249 VanDerWaalsContact C-N 3.28Å; D247-Y249 PolarHBondContact O-N 3.08Å; D247-E250 PolarHBondContact O-N 3.05Å; D247-W251 WeakPolarHBondContact O-CB 3.26Å; D247-W251 PolarHBondContact O-N 3.02Å
248	I	95.9	Very high	94.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-36.5	175.5	-65.4	169	0	0	0	110.5	L177 L181 F217 L244 D246 G252 I348 L352	L177-I248 HydrophobicContact CD2-CD1 4.17Å; L181-I248 HydrophobicContact CD1-CD1 4.37Å; F217-I248 HydrophobicContact CD1-CG1 4.31Å; F217-I248 HydrophobicContact CD2-CG1 3.98Å; F217-I248 HydrophobicContact CE1-CG1 4.3Å; F217-I248 HydrophobicContact CE2-CG1 3.98Å; F217-I248 HydrophobicContact CG-CG1 4.15Å; F217-I248 HydrophobicContact CZ-CG1 4.14Å; L244-I248 HydrophobicContact CD1-CD1 4.42Å; L244-I248 HydrophobicContact CD1-CG1 4.46Å; L244-I248 HydrophobicContact CD2-CD1 4.38Å; L244-I248 HydrophobicContact CG-CD1 3.92Å; L244-I248 HydrophobicContact CG-CG1 4.37Å; L244-I248 VanDerWaalsContact O-CG1 3.31Å; L244-I248 WeakPolarHBondContact O-CG1 3.17Å; L244-I248 PolarHBondContact O-N 3.24Å; D246-I248 PolarHBondContact O-N 3.46Å; I248-G252 PolarHBondContact O-N 3Å; I248-I348 HydrophobicContact CG2-CG2 3.89Å; I248-L352 HydrophobicContact CG2-CD1 4.13Å
249	Y	96.5	Very high	94.8	Very high	99 Å²	99	58.9 Å²	58.9	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-67.7	-43.9	177.1	177.3	-113	0	0	0	112.4	M245 D246 D247 G252 K253 L349 L352	M245-Y249 WeakPolarHBondContact O-CB 3.31Å; M245-Y249 PolarHBondContact O-N 3.47Å; D246-Y249 WeakPolarHBondContact O-CB 3.39Å; D246-Y249 PolarHBondContact O-N 3.39Å; D246-Y249 VanDerWaalsContact O-N 3.14Å; D247-Y249 VanDerWaalsContact C-N 3.28Å; D247-Y249 PolarHBondContact O-N 3.08Å; Y249-G252 PolarHBondContact O-N 3.23Å; Y249-K253 HydrophobicContact CE1-CD 4.34Å; Y249-K253 PolarHBondContact O-N 3.15Å; Y249-K253 VanDerWaalsContact O-N 3.17Å; Y249-K253 WeakPolarHBondContact OH-CE 3.26Å; Y249-K253 PolarHBondContact OH-NZ 3.36Å; Y249-L349 HydrophobicContact CD2-CD2 3.78Å; Y249-L349 HydrophobicContact CE2-CD2 3.97Å; Y249-L352 HydrophobicContact CD2-CD1 4.49Å
250	E	95.4	Very high	94.8	Very high	122 Å²	122	59.2 Å²	59.2	57%	0.57	31%	0.309	S	S	*	.	H	α-helix	trans	-62.1	-43.6	174.5	-71.9	-170	173.8	0	0	111.8	D246 D247 K253 N254	D246-E250 PolarHBondContact O-N 3.43Å; D247-E250 PolarHBondContact O-N 3.05Å; E250-K253 PolarHBondContact O-N 3Å; E250-N254 PolarHBondContact O-N 2.86Å; E250-N254 PolarHBondContact O-ND2 3.5Å
251	W	96.1	Very high	94.8	Very high	13 Å²	13	61.8 Å²	61.8	5%	0.049	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-47.8	173.6	172.6	77.9	0	0	0	111.8	L181 I184 E210 M214 F217 D247 K253 N254 F255 L345 I348	L181-W251 HydrophobicContact CD2-CE3 4.36Å; L181-W251 HydrophobicContact CD2-CH2 4.14Å; L181-W251 HydrophobicContact CD2-CZ3 3.69Å; I184-W251 HydrophobicContact CD1-CH2 3.82Å; I184-W251 HydrophobicContact CD1-CZ3 4.34Å; I184-W251 HydrophobicContact CG2-CH2 4.15Å; I184-W251 HydrophobicContact CG2-CZ2 4.44Å; E210-W251 PolarHBondContact OE2-NE1 3.01Å; M214-W251 HydrophobicContact CE-CZ2 4.02Å; M214-W251 HydrophobicContact CG-CH2 4.13Å; M214-W251 HydrophobicContact CG-CZ2 3.7Å; M214-W251 HydrophobicContact SD-CH2 3.62Å; M214-W251 HydrophobicContact SD-CZ2 3.52Å; M214-W251 VanDerWaalsContact SD-CZ2 3.52Å; F217-W251 HydrophobicContact CE2-CB 4Å; F217-W251 HydrophobicContact CE2-CD2 4.12Å; F217-W251 HydrophobicContact CE2-CE3 4.37Å; F217-W251 AromaticContact CE2-CG 3.93Å; F217-W251 HydrophobicContact CE2-CG 3.93Å; F217-W251 HydrophobicContact CZ-CB 3.82Å; F217-W251 HydrophobicContact CZ-CG 4.18Å; D247-W251 WeakPolarHBondContact O-CB 3.26Å; D247-W251 PolarHBondContact O-N 3.02Å; W251-K253 PolarHBondContact O-N 3.05Å; W251-N254 PolarHBondContact O-N 2.77Å; W251-F255 HydrophobicContact CD2-CB 4.34Å; W251-F255 AromaticContact CE2-CG 3.95Å; W251-F255 HydrophobicContact CH2-CB 4.34Å; W251-F255 AromaticContact CH2-CD1 3.79Å; W251-F255 HydrophobicContact CH2-CD1 3.79Å; W251-F255 HydrophobicContact CH2-CD2 4.49Å; W251-F255 HydrophobicContact CH2-CE1 4.27Å; W251-F255 AromaticContact CH2-CG 3.95Å; W251-F255 HydrophobicContact CH2-CG 3.95Å; W251-F255 HydrophobicContact CZ2-CB 3.91Å; W251-F255 AromaticContact CZ2-CD1 3.77Å; W251-F255 HydrophobicContact CZ2-CD1 3.77Å; W251-F255 AromaticContact CZ2-CD2 3.65Å; W251-F255 HydrophobicContact CZ2-CD2 3.65Å; W251-F255 HydrophobicContact CZ2-CE1 4.25Å; W251-F255 HydrophobicContact CZ2-CE2 4.14Å; W251-F255 AromaticContact CZ2-CG 3.48Å; W251-F255 HydrophobicContact CZ2-CG 3.48Å; W251-F255 VanDerWaalsContact CZ2-CG 3.48Å; W251-F255 HydrophobicContact CZ2-CZ 4.44Å; W251-F255 WeakPolarHBondContact O-CB 3.14Å; W251-F255 PolarHBondContact O-N 3.38Å; W251-L345 HydrophobicContact CH2-CD2 4.42Å; W251-L345 HydrophobicContact CZ3-CD2 4.15Å; W251-I348 HydrophobicContact CZ3-CD1 4.37Å
252	G	93.1	Very high	94.8	Very high	5 Å²	5	59.7 Å²	59.7	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-32.9	-178.9	0	0	0	0	0	113.6	I248 Y249	I248-G252 PolarHBondContact O-N 3Å; Y249-G252 PolarHBondContact O-N 3.23Å
253	K	91.9	Very high	94.8	Very high	116 Å²	116	53.7 Å²	53.7	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-65.4	-46.5	173.1	-73.4	177.1	178.6	171.9	0	112.5	Y249 E250 W251	Y249-K253 HydrophobicContact CE1-CD 4.34Å; Y249-K253 PolarHBondContact O-N 3.15Å; Y249-K253 VanDerWaalsContact O-N 3.17Å; Y249-K253 WeakPolarHBondContact OH-CE 3.26Å; Y249-K253 PolarHBondContact OH-NZ 3.36Å; E250-K253 PolarHBondContact O-N 3Å; W251-K253 PolarHBondContact O-N 3.05Å
254	N	93.6	Very high	94.8	Very high	108 Å²	108	59.4 Å²	59.4	58%	0.578	29%	0.291	S	S	*	.	H	α-helix	trans	-75.4	-31.7	-176	-64.8	-26.8	0	0	0	111.8	E250 W251 S256 L257 R258	E250-N254 PolarHBondContact O-N 2.86Å; E250-N254 PolarHBondContact O-ND2 3.5Å; W251-N254 PolarHBondContact O-N 2.77Å; N254-S256 VanDerWaalsContact C-N 3.3Å; N254-S256 PolarHBondContact O-N 3.38Å; N254-L257 WeakPolarHBondContact O-CB 3.42Å; N254-L257 PolarHBondContact O-N 2.78Å; N254-R258 PolarHBondContact O-N 2.99Å
255	F	94.9	Very high	94.7	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-31.7	-176	-172.4	-117	0	0	0	113	I184 I188 M207 E210 W251 L257 R258 I259 L345	I184-F255 HydrophobicContact CD1-CD1 4.47Å; I184-F255 HydrophobicContact CD1-CE1 4.17Å; I184-F255 HydrophobicContact CG1-CE1 4.48Å; I184-F255 HydrophobicContact CG2-CD1 4.34Å; I184-F255 HydrophobicContact CG2-CE1 3.38Å; I184-F255 HydrophobicContact CG2-CE2 4.38Å; I184-F255 HydrophobicContact CG2-CZ 3.43Å; I184-F255 VanDerWaalsContact CG2-CZ 3.43Å; I188-F255 HydrophobicContact CD1-CE2 3.78Å; I188-F255 HydrophobicContact CD1-CZ 3.71Å; I188-F255 HydrophobicContact CG1-CZ 4.18Å; M207-F255 HydrophobicContact CE-CE2 3.97Å; M207-F255 HydrophobicContact CE-CZ 4.01Å; M207-F255 HydrophobicContact SD-CE2 4.32Å; E210-F255 HydrophobicContact CB-CD2 4.08Å; E210-F255 HydrophobicContact CB-CE2 4Å; E210-F255 HydrophobicContact CG-CD2 4.02Å; E210-F255 HydrophobicContact CG-CE2 4.23Å; W251-F255 HydrophobicContact CD2-CB 4.34Å; W251-F255 AromaticContact CE2-CG 3.95Å; W251-F255 HydrophobicContact CH2-CB 4.34Å; W251-F255 AromaticContact CH2-CD1 3.79Å; W251-F255 HydrophobicContact CH2-CD1 3.79Å; W251-F255 HydrophobicContact CH2-CD2 4.49Å; W251-F255 HydrophobicContact CH2-CE1 4.27Å; W251-F255 AromaticContact CH2-CG 3.95Å; W251-F255 HydrophobicContact CH2-CG 3.95Å; W251-F255 HydrophobicContact CZ2-CB 3.91Å; W251-F255 AromaticContact CZ2-CD1 3.77Å; W251-F255 HydrophobicContact CZ2-CD1 3.77Å; W251-F255 AromaticContact CZ2-CD2 3.65Å; W251-F255 HydrophobicContact CZ2-CD2 3.65Å; W251-F255 HydrophobicContact CZ2-CE1 4.25Å; W251-F255 HydrophobicContact CZ2-CE2 4.14Å; W251-F255 AromaticContact CZ2-CG 3.48Å; W251-F255 HydrophobicContact CZ2-CG 3.48Å; W251-F255 VanDerWaalsContact CZ2-CG 3.48Å; W251-F255 HydrophobicContact CZ2-CZ 4.44Å; W251-F255 WeakPolarHBondContact O-CB 3.14Å; W251-F255 PolarHBondContact O-N 3.38Å; F255-L257 VanDerWaalsContact C-N 3.29Å; F255-L257 PolarHBondContact O-N 3.27Å; F255-R258 HydrophobicContact CD2-CB 4.4Å; F255-R258 PolarHBondContact O-N 2.81Å; F255-R258 VanDerWaalsContact O-N 3.11Å; F255-I259 HydrophobicContact CD1-CD1 3.89Å; F255-I259 HydrophobicContact CD1-CG1 4.2Å; F255-I259 HydrophobicContact CE1-CD1 3.55Å; F255-I259 HydrophobicContact CE1-CG1 3.78Å; F255-I259 HydrophobicContact CE2-CG1 4.49Å; F255-I259 HydrophobicContact CZ-CD1 4.19Å; F255-I259 HydrophobicContact CZ-CG1 3.91Å; F255-I259 PolarHBondContact O-N 3.32Å; F255-L345 HydrophobicContact CB-CD2 4.42Å; F255-L345 HydrophobicContact CD1-CD1 3.7Å; F255-L345 HydrophobicContact CD1-CD2 3.74Å; F255-L345 HydrophobicContact CD1-CG 3.82Å; F255-L345 HydrophobicContact CE1-CD1 4.4Å; F255-L345 HydrophobicContact CE1-CG 4.4Å
256	S	93.9	Very high	94.7	Very high	50 Å²	50	59 Å²	59	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-57.1	-43.2	175.2	-170.3	0	0	0	0	112	N254 R258 I259 D260	N254-S256 VanDerWaalsContact C-N 3.3Å; N254-S256 PolarHBondContact O-N 3.38Å; S256-R258 VanDerWaalsContact C-N 3.32Å; S256-R258 PolarHBondContact O-N 2.75Å; S256-I259 PolarHBondContact O-N 3.03Å; S256-D260 PolarHBondContact O-N 2.79Å
257	L	95.6	Very high	94.7	Very high	106 Å²	106	54.1 Å²	54.1	56%	0.555	26%	0.263	S	S	*	.	H	α-helix	trans	-62.7	-40.3	177.7	-170.2	101.8	0	0	0	111.2	N254 F255 I259 D260 E261	N254-L257 WeakPolarHBondContact O-CB 3.42Å; N254-L257 PolarHBondContact O-N 2.78Å; F255-L257 VanDerWaalsContact C-N 3.29Å; F255-L257 PolarHBondContact O-N 3.27Å; L257-I259 VanDerWaalsContact C-N 3.34Å; L257-I259 PolarHBondContact O-N 3.11Å; L257-D260 PolarHBondContact O-N 2.73Å; L257-E261 WeakPolarHBondContact CD2-OE1 3.15Å; L257-E261 WeakPolarHBondContact O-CG 3.49Å; L257-E261 PolarHBondContact O-N 3.05Å
258	R	94.2	Very high	94.6	Very high	60 Å²	60	57.4 Å²	57.4	23%	0.226	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-35.1	178.8	-66	-63.9	-179	111.7	-1.3	112.6	M207 E209 E210 N254 F255 S256 D260 E261 V262	M207-R258 HydrophobicContact SD-CB 4.34Å; E209-R258 IonicContact OE2-CZ 3.75Å; E209-R258 IonicContact OE2-NH1 2.71Å; E209-R258 PolarHBondContact OE2-NH1 2.92Å; E209-R258 IonicContact OE2-NH2 2.73Å; E210-R258 HydrophobicContact CG-CB 4.35Å; E210-R258 HydrophobicContact CG-CG 4.06Å; E210-R258 IonicContact OE1-CZ 3.1Å; E210-R258 IonicContact OE1-NH1 2.72Å; N254-R258 PolarHBondContact O-N 2.99Å; F255-R258 HydrophobicContact CD2-CB 4.4Å; F255-R258 PolarHBondContact O-N 2.81Å; F255-R258 VanDerWaalsContact O-N 3.11Å; S256-R258 VanDerWaalsContact C-N 3.32Å; S256-R258 PolarHBondContact O-N 2.75Å; R258-D260 VanDerWaalsContact C-N 3.35Å; R258-E261 WeakPolarHBondContact CD-OE2 3.32Å; R258-E261 IonicContact NE-OE2 3.83Å; R258-V262 WeakPolarHBondContact O-CG2 3.32Å; R258-V262 PolarHBondContact O-N 3.17Å
259	I	94.4	Very high	94.6	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-45.5	172.2	-63	171.3	0	0	0	110	M207 F255 S256 L257 E261 V262 E263 V338 M341 R342 L345	M207-I259 HydrophobicContact CE-CG1 4.47Å; F255-I259 HydrophobicContact CD1-CD1 3.89Å; F255-I259 HydrophobicContact CD1-CG1 4.2Å; F255-I259 HydrophobicContact CE1-CD1 3.55Å; F255-I259 HydrophobicContact CE1-CG1 3.78Å; F255-I259 HydrophobicContact CE2-CG1 4.49Å; F255-I259 HydrophobicContact CZ-CD1 4.19Å; F255-I259 HydrophobicContact CZ-CG1 3.91Å; F255-I259 PolarHBondContact O-N 3.32Å; S256-I259 PolarHBondContact O-N 3.03Å; L257-I259 VanDerWaalsContact C-N 3.34Å; L257-I259 PolarHBondContact O-N 3.11Å; I259-E261 PolarHBondContact O-N 3.15Å; I259-V262 PolarHBondContact O-N 3.44Å; I259-E263 WeakPolarHBondContact O-CB 3.23Å; I259-E263 PolarHBondContact O-N 3.34Å; I259-V338 HydrophobicContact CG2-CG1 4.04Å; I259-M341 HydrophobicContact CD1-CB 4.04Å; I259-M341 HydrophobicContact CG2-CE 4.46Å; I259-R342 HydrophobicContact CD1-CG 4.36Å; I259-R342 HydrophobicContact CG2-CG 4.44Å; I259-L345 HydrophobicContact CD1-CD1 3.72Å
260	D	95.9	Very high	94.6	Very high	68 Å²	68	64.7 Å²	64.7	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-40.2	-178	-63.1	-23.1	0	0	0	111.7	S256 L257 R258 V262 E263 E264 R342	S256-D260 PolarHBondContact O-N 2.79Å; L257-D260 PolarHBondContact O-N 2.73Å; R258-D260 VanDerWaalsContact C-N 3.35Å; D260-V262 VanDerWaalsContact C-N 3.34Å; D260-V262 PolarHBondContact O-N 3.45Å; D260-E263 PolarHBondContact O-N 3.22Å; D260-E264 WeakPolarHBondContact O-CB 3.47Å; D260-E264 PolarHBondContact O-N 2.86Å; D260-R342 IonicContact OD1-CZ 3.42Å; D260-R342 IonicContact OD1-NE 2.66Å; D260-R342 IonicContact OD1-NH2 3.28Å; D260-R342 PolarHBondContact OD1-NH2 2.93Å
261	E	94.3	Very high	94.7	Very high	71 Å²	71	63.9 Å²	63.9	33%	0.332	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-40.2	174.3	-71.9	173.7	-178.1	0	0	112.5	L257 R258 I259 M265	L257-E261 WeakPolarHBondContact CD2-OE1 3.15Å; L257-E261 WeakPolarHBondContact O-CG 3.49Å; L257-E261 PolarHBondContact O-N 3.05Å; R258-E261 WeakPolarHBondContact CD-OE2 3.32Å; R258-E261 IonicContact NE-OE2 3.83Å; I259-E261 PolarHBondContact O-N 3.15Å; E261-M265 PolarHBondContact O-N 2.9Å
262	V	93.9	Very high	94.7	Very high	4 Å²	4	63.5 Å²	63.5	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-69.9	-40.1	176.6	172.2	0	0	0	0	111.1	P203 M207 R258 I259 D260 M265 L266	P203-V262 HydrophobicContact CB-CG1 4.41Å; M207-V262 HydrophobicContact CE-CG2 4.1Å; M207-V262 HydrophobicContact CG-CG2 3.61Å; M207-V262 HydrophobicContact SD-CG2 3.71Å; R258-V262 WeakPolarHBondContact O-CG2 3.32Å; R258-V262 PolarHBondContact O-N 3.17Å; I259-V262 PolarHBondContact O-N 3.44Å; D260-V262 VanDerWaalsContact C-N 3.34Å; D260-V262 PolarHBondContact O-N 3.45Å; V262-M265 PolarHBondContact O-N 3.46Å; V262-L266 HydrophobicContact CG1-CD1 3.99Å; V262-L266 PolarHBondContact O-N 3.31Å
263	E	94.9	Very high	94.8	Very high	46 Å²	46	66.7 Å²	66.7	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-64.5	-42.6	177.1	-159.7	-175.7	161.9	0	0	111.3	I259 D260 M265 L266 T267 R342	I259-E263 WeakPolarHBondContact O-CB 3.23Å; I259-E263 PolarHBondContact O-N 3.34Å; D260-E263 PolarHBondContact O-N 3.22Å; E263-M265 PolarHBondContact O-N 2.98Å; E263-L266 PolarHBondContact O-N 3.06Å; E263-T267 HydrophobicContact CG-CG2 4.14Å; E263-T267 WeakPolarHBondContact CG-OG1 3.44Å; E263-T267 WeakPolarHBondContact O-CB 3.41Å; E263-T267 PolarHBondContact O-N 3.43Å; E263-T267 PolarHBondContact O-OG1 3.09Å; E263-R342 IonicContact OE2-CZ 2.9Å; E263-R342 IonicContact OE2-NH1 2.99Å; E263-R342 PolarHBondContact OE2-NH1 3.36Å; E263-R342 IonicContact OE2-NH2 3.76Å; E263-R342 PolarHBondContact OE2-NH2 3.02Å
264	E	94.4	Very high	95	Very high	157 Å²	157	67.1 Å²	67.1	73%	0.734	33%	0.329	S	S	*	.	H	α-helix	trans	-58.3	-39.5	176.7	-173.2	173.2	-171.7	0	0	111.5	D260	D260-E264 WeakPolarHBondContact O-CB 3.47Å; D260-E264 PolarHBondContact O-N 2.86Å
265	M	92.5	Very high	95	Very high	48 Å²	48	65.1 Å²	65.1	24%	0.236	31%	0.313	C	S	.	.	H	α-helix	trans	-74.8	-41.3	179.8	-163.8	-78.4	-76.4	0	0	113.4	A200 P203 E261 V262 E263 N269	A200-M265 HydrophobicContact CB-CE 4.4Å; P203-M265 HydrophobicContact CB-CE 3.74Å; P203-M265 VanDerWaalsContact CD-CE 3.4Å; P203-M265 HydrophobicContact CG-CE 3.4Å; P203-M265 VanDerWaalsContact CG-CE 3.4Å; E261-M265 PolarHBondContact O-N 2.9Å; V262-M265 PolarHBondContact O-N 3.46Å; E263-M265 PolarHBondContact O-N 2.98Å; M265-N269 WeakPolarHBondContact O-CB 3.22Å
266	L	94.8	Very high	95.1	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-97.6	-50.3	-172	-69.9	176.4	0	0	0	113.6	I191 A195 A200 P203 V262 E263 N268 N269 W272 Y334	I191-L266 HydrophobicContact CG2-CD1 4.25Å; A195-L266 HydrophobicContact CB-CD1 4.25Å; A195-L266 HydrophobicContact CB-CD2 4.44Å; A200-L266 HydrophobicContact CB-CD2 4.22Å; P203-L266 HydrophobicContact CG-CD1 4.44Å; V262-L266 HydrophobicContact CG1-CD1 3.99Å; V262-L266 PolarHBondContact O-N 3.31Å; E263-L266 PolarHBondContact O-N 3.06Å; L266-N268 PolarHBondContact O-N 3.15Å; L266-N269 WeakPolarHBondContact O-CB 3.39Å; L266-N269 PolarHBondContact O-N 3.27Å; L266-N269 VanDerWaalsContact O-N 3.16Å; L266-W272 HydrophobicContact CD2-CD2 4.15Å; L266-W272 HydrophobicContact CD2-CE3 4.07Å; L266-W272 HydrophobicContact CD2-CZ3 4.41Å; L266-W272 WeakPolarHBondContact O-CB 3.41Å; L266-W272 VanDerWaalsContact O-CD1 3.24Å; L266-Y334 WeakPolarHBondContact CB-OH 3.46Å; L266-Y334 HydrophobicContact CD1-CE2 4.2Å
267	T	95.8	Very high	95.1	Very high	8 Å²	8	65.3 Å²	65.3	5%	0.049	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-42	-163.4	-64.5	0	0	0	0	113.3	E263 K273 Y331 Y334 L335	E263-T267 HydrophobicContact CG-CG2 4.14Å; E263-T267 WeakPolarHBondContact CG-OG1 3.44Å; E263-T267 WeakPolarHBondContact O-CB 3.41Å; E263-T267 PolarHBondContact O-N 3.43Å; E263-T267 PolarHBondContact O-OG1 3.09Å; T267-K273 WeakPolarHBondContact O-CE 3.2Å; T267-Y331 WeakPolarHBondContact CG2-OH 3.46Å; T267-Y331 PolarHBondContact O-OH 2.71Å; T267-Y334 WeakPolarHBondContact OG1-CE1 3.45Å; T267-Y334 PolarHBondContact OG1-OH 3.2Å; T267-Y334 VanDerWaalsContact OG1-OH 3.13Å; T267-L335 HydrophobicContact CG2-CD2 3.88Å
268	N	95.1	Very high	95.1	Very high	122 Å²	122	65.6 Å²	65.6	65%	0.652	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-2.6	-179.5	-74	-35.3	0	0	0	113.8	L266 R270	L266-N268 PolarHBondContact O-N 3.15Å; N268-R270 PolarHBondContact O-N 3.32Å
269	N	96.4	Very high	95.1	Very high	56 Å²	56	63.2 Å²	63.2	30%	0.299	31%	0.306	S	S	.	.			trans	-69.6	126.9	-179.1	-175.3	-10.6	0	0	0	111.1	M265 L266 I271 W272 K273	M265-N269 WeakPolarHBondContact O-CB 3.22Å; L266-N269 WeakPolarHBondContact O-CB 3.39Å; L266-N269 PolarHBondContact O-N 3.27Å; L266-N269 VanDerWaalsContact O-N 3.16Å; N269-I271 PolarHBondContact O-N 3.48Å; N269-I271 PolarHBondContact OD1-N 3.13Å; N269-W272 HydrophobicContact CB-CB 4.03Å; N269-W272 PolarHBondContact O-N 3.33Å; N269-K273 PolarHBondContact O-N 2.81Å
270	R	96.6	Very high	95.1	Very high	195 Å²	195	63.1 Å²	63.1	74%	0.736	31%	0.306	S	S	*	.	H	α-helix	trans	-58.1	-37.9	178.2	86.5	174.7	83	170.5	3.7	112.2	N268 N274	N268-R270 PolarHBondContact O-N 3.32Å; R270-N274 WeakPolarHBondContact O-CB 3.32Å; R270-N274 PolarHBondContact O-N 2.98Å; R270-N274 PolarHBondContact O-OD1 3.08Å
271	I	95.7	Very high	95	Very high	106 Å²	106	63.6 Å²	63.6	54%	0.544	31%	0.311	S	S	.	.	H	α-helix	trans	-69.4	-44.5	-175.3	-59	174.9	0	0	0	108.5	N269 N274 R275	N269-I271 PolarHBondContact O-N 3.48Å; N269-I271 PolarHBondContact OD1-N 3.13Å; I271-N274 PolarHBondContact O-N 3.05Å; I271-R275 HydrophobicContact CG2-CG 4.48Å; I271-R275 VanDerWaalsContact O-CG 3.23Å; I271-R275 WeakPolarHBondContact O-CG 3.46Å; I271-R275 PolarHBondContact O-N 3.4Å; I271-R275 VanDerWaalsContact O-N 3.1Å
272	W	95.9	Very high	95.1	Very high	5 Å²	5	60.7 Å²	60.7	2%	0.019	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-48.6	176.3	-173	-113.1	0	0	0	111.9	H194 A195 I198 L266 N269 N274 R275 T276 Y334	H194-W272 AromaticContact CE1-CH2 3.46Å; H194-W272 VanDerWaalsContact CE1-CH2 3.46Å; H194-W272 WeakPolarHBondContact CE1-CH2 3.45Å; H194-W272 AromaticContact CE1-CZ2 3.65Å; H194-W272 AromaticContact ND1-CH2 3.3Å; H194-W272 VanDerWaalsContact ND1-CH2 3.3Å; H194-W272 WeakPolarHBondContact ND1-CH2 3.46Å; H194-W272 AromaticContact ND1-CZ2 3.57Å; A195-W272 HydrophobicContact CB-CH2 4.15Å; A195-W272 HydrophobicContact CB-CZ3 4.23Å; I198-W272 HydrophobicContact CB-CZ3 3.99Å; I198-W272 HydrophobicContact CD1-CE3 4.14Å; I198-W272 HydrophobicContact CD1-CH2 3.72Å; I198-W272 HydrophobicContact CD1-CZ3 3.4Å; I198-W272 HydrophobicContact CG1-CZ3 4.24Å; I198-W272 HydrophobicContact CG2-CE3 4.29Å; I198-W272 HydrophobicContact CG2-CZ3 4.12Å; L266-W272 HydrophobicContact CD2-CD2 4.15Å; L266-W272 HydrophobicContact CD2-CE3 4.07Å; L266-W272 HydrophobicContact CD2-CZ3 4.41Å; L266-W272 WeakPolarHBondContact O-CB 3.41Å; L266-W272 VanDerWaalsContact O-CD1 3.24Å; N269-W272 HydrophobicContact CB-CB 4.03Å; N269-W272 PolarHBondContact O-N 3.33Å; W272-N274 PolarHBondContact O-N 2.87Å; W272-R275 PolarHBondContact O-N 2.91Å; W272-R275 VanDerWaalsContact O-N 3.11Å; W272-T276 HydrophobicContact CD2-CG2 4.19Å; W272-T276 HydrophobicContact CH2-CG2 4.5Å; W272-T276 HydrophobicContact CZ2-CG2 4.13Å; W272-T276 PolarHBondContact O-N 3.32Å; W272-T276 VanDerWaalsContact O-N 3.13Å; W272-T276 PolarHBondContact O-OG1 2.83Å; W272-Y334 HydrophobicContact CZ2-CD2 4.03Å; W272-Y334 HydrophobicContact CZ2-CE2 4.34Å; W272-Y334 HydrophobicContact CZ2-CG 4.27Å; W272-Y334 AromaticContact NE1-CD1 3.59Å; W272-Y334 AromaticContact NE1-CE1 3.66Å; W272-Y334 AromaticContact NE1-CG 3.92Å
273	K	95.9	Very high	95.1	Very high	71 Å²	71	62.8 Å²	62.8	31%	0.309	31%	0.313	S	S	.	.	H	α-helix	trans	-59	-47	176.5	-70	-173.9	-176.9	-173.9	0	111.9	T267 N269 R275 T276 V277 Y331	T267-K273 WeakPolarHBondContact O-CE 3.2Å; N269-K273 PolarHBondContact O-N 2.81Å; K273-R275 PolarHBondContact O-N 3.35Å; K273-R275 VanDerWaalsContact O-N 3.16Å; K273-T276 PolarHBondContact O-N 3.12Å; K273-V277 HydrophobicContact CB-CG2 4.05Å; K273-V277 HydrophobicContact CG-CG2 4.49Å; K273-V277 VanDerWaalsContact O-CB 3.26Å; K273-V277 WeakPolarHBondContact O-CB 3.34Å; K273-V277 VanDerWaalsContact O-CG2 3.26Å; K273-V277 WeakPolarHBondContact O-CG2 3.5Å; K273-V277 PolarHBondContact O-N 3.14Å; K273-Y331 VanDerWaalsContact CE-OH 3.3Å; K273-Y331 WeakPolarHBondContact CE-OH 3.39Å; K273-Y331 HydrophobicContact CG-CE2 4Å
274	N	95.5	Very high	95	Very high	125 Å²	125	65.3 Å²	65.3	67%	0.668	32%	0.324	S	S	*	.	H	α-helix	trans	-61.3	-25.5	178.1	-72.3	-7.5	0	0	0	113.5	R270 I271 W272	R270-N274 WeakPolarHBondContact O-CB 3.32Å; R270-N274 PolarHBondContact O-N 2.98Å; R270-N274 PolarHBondContact O-OD1 3.08Å; I271-N274 PolarHBondContact O-N 3.05Å; W272-N274 PolarHBondContact O-N 2.87Å
275	R	95.3	Very high	95	Very high	67 Å²	67	64.8 Å²	64.8	25%	0.253	32%	0.322	S	S	.	.	H	α-helix	trans	-96.5	-2.3	-179.1	-63.4	-64.8	-67	141	8.8	114	I198 I271 W272 K273 I279 A449 D450	I198-R275 HydrophobicContact CG2-CB 4.01Å; I198-R275 HydrophobicContact CG2-CG 4.12Å; I271-R275 HydrophobicContact CG2-CG 4.48Å; I271-R275 VanDerWaalsContact O-CG 3.23Å; I271-R275 WeakPolarHBondContact O-CG 3.46Å; I271-R275 PolarHBondContact O-N 3.4Å; I271-R275 VanDerWaalsContact O-N 3.1Å; W272-R275 PolarHBondContact O-N 2.91Å; W272-R275 VanDerWaalsContact O-N 3.11Å; K273-R275 PolarHBondContact O-N 3.35Å; K273-R275 VanDerWaalsContact O-N 3.16Å; R275-I279 WeakPolarHBondContact O-CD1 3.43Å; R275-A449 PolarHBondContact NH2-O 2.93Å; R275-D450 IonicContact CZ-OD1 2.61Å; R275-D450 IonicContact NH1-OD1 2.86Å; R275-D450 PolarHBondContact NH1-OD1 3.1Å; R275-D450 IonicContact NH2-OD1 3.15Å
276	T	95.2	Very high	95	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-134.4	-29.1	-175.3	54.7	0	0	0	0	114.3	I198 W272 K273 C330 Y331	I198-T276 HydrophobicContact CD1-CG2 4.06Å; W272-T276 HydrophobicContact CD2-CG2 4.19Å; W272-T276 HydrophobicContact CH2-CG2 4.5Å; W272-T276 HydrophobicContact CZ2-CG2 4.13Å; W272-T276 PolarHBondContact O-N 3.32Å; W272-T276 VanDerWaalsContact O-N 3.13Å; W272-T276 PolarHBondContact O-OG1 2.83Å; K273-T276 PolarHBondContact O-N 3.12Å; T276-C330 WeakPolarHBondContact O-CB 3.45Å; T276-Y331 PolarHBondContact O-N 3.2Å; T276-Y331 WeakPolarHBondContact OG1-CD2 3.26Å
277	V	95.6	Very high	95	Very high	53 Å²	53	64.3 Å²	64.3	32%	0.321	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	135	177.4	176.9	0	0	0	0	109.5	K273 I279 Y331	K273-V277 HydrophobicContact CB-CG2 4.05Å; K273-V277 HydrophobicContact CG-CG2 4.49Å; K273-V277 VanDerWaalsContact O-CB 3.26Å; K273-V277 WeakPolarHBondContact O-CB 3.34Å; K273-V277 VanDerWaalsContact O-CG2 3.26Å; K273-V277 WeakPolarHBondContact O-CG2 3.5Å; K273-V277 PolarHBondContact O-N 3.14Å; V277-I279 PolarHBondContact O-N 3.4Å; V277-Y331 HydrophobicContact CG2-CD1 4.25Å; V277-Y331 HydrophobicContact CG2-CD2 4.43Å; V277-Y331 HydrophobicContact CG2-CG 3.96Å
278	N	94.6	Very high	94.9	Very high	112 Å²	112	69.1 Å²	69.1	60%	0.599	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	17.4	-177.4	-58	-38.7	0	0	0	115.7	D329	N278-D329 PolarHBondContact N-OD2 3.34Å; N278-D329 VanDerWaalsContact N-OD2 3.1Å
279	I	95.1	Very high	95	Very high	11 Å²	11	69.3 Å²	69.3	6%	0.056	35%	0.346	C	S	.	.	S	Bend	trans	-100.2	133	174.6	-70.6	161.6	0	0	0	109.6	R275 V277 V281 C330 D450 I454	R275-I279 WeakPolarHBondContact O-CD1 3.43Å; V277-I279 PolarHBondContact O-N 3.4Å; I279-V281 PolarHBondContact O-N 3.39Å; I279-C330 PolarHBondContact O-N 3.28Å; I279-C330 VanDerWaalsContact O-N 3.17Å; I279-C330 PolarHBondContact O-SG 2.98Å; I279-D450 HydrophobicContact CD1-CB 4.43Å; I279-D450 HydrophobicContact CG1-CB 4.45Å; I279-D450 HydrophobicContact CG2-CB 3.94Å; I279-I454 HydrophobicContact CG2-CD1 4.26Å; I279-I454 HydrophobicContact CG2-CG1 3.82Å
280	G	93.1	Very high	94.9	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.35	C	S	.	.	S	Bend	trans	60.5	41.7	177.1	0	0	0	0	0	113.2	V282 R333 H446	G280-V282 PolarHBondContact O-N 3.1Å; G280-R333 PolarHBondContact O-NH2 3.05Å; G280-H446 PolarHBondContact N-NE2 3.24Å
281	V	95.3	Very high	94.8	Very high	78 Å²	78	63.5 Å²	63.5	47%	0.473	33%	0.331	S	S	.	.			trans	-61.3	128.6	-178.7	177.5	0	0	0	0	110.5	I279 D329	I279-V281 PolarHBondContact O-N 3.39Å; V281-D329 HydrophobicContact CG2-CB 4.22Å
282	V	94.9	Very high	94.8	Very high	9 Å²	9	59 Å²	59	6%	0.055	31%	0.308	C	S	.	.			trans	-118.6	122.2	178.3	179.4	0	0	0	0	109.8	G280 D286 A287 F292 M296 S300 G328 M442	G280-V282 PolarHBondContact O-N 3.1Å; V282-D286 HydrophobicContact CG1-CB 4.44Å; V282-A287 HydrophobicContact CG1-CB 3.77Å; V282-F292 HydrophobicContact CG1-CD2 4.06Å; V282-F292 HydrophobicContact CG1-CE2 3.88Å; V282-F292 HydrophobicContact CG2-CE2 4.03Å; V282-M296 HydrophobicContact CG2-CE 4.44Å; V282-S300 PolarHBondContact O-OG 3.37Å; V282-G328 PolarHBondContact N-O 2.75Å; V282-M442 HydrophobicContact CG2-CG 3.61Å; V282-M442 HydrophobicContact CG2-SD 3.61Å
283	S	94.1	Very high	94.7	Very high	49 Å²	49	58.9 Å²	58.9	34%	0.343	31%	0.307	S	S	.	.			trans	-70.6	157	174.9	79.4	0	0	0	0	111.7	E285 D286 A287	S283-E285 VanDerWaalsContact C-N 3.32Å; S283-E285 PolarHBondContact O-N 2.9Å; S283-D286 PolarHBondContact O-N 3.34Å; S283-D286 VanDerWaalsContact OG-CB 3.26Å; S283-D286 WeakPolarHBondContact OG-CB 2.94Å; S283-D286 PolarHBondContact OG-N 3.33Å; S283-D286 PolarHBondContact OG-OD2 3.38Å; S283-A287 WeakPolarHBondContact O-CB 2.89Å; S283-A287 PolarHBondContact O-N 3.25Å
284	H	92.9	Very high	94.6	Very high	99 Å²	99	55.6 Å²	55.6	46%	0.458	29%	0.293	S	S	.	.	H	α-helix	trans	-59.8	-43	-179.4	-63.8	67.1	0	0	0	111.8	L288 S300 I302	H284-L288 PolarHBondContact O-N 3.13Å; H284-S300 PolarHBondContact CD2-O 2.84Å; H284-S300 PolarHBondContact CE1-O 3.32Å; H284-S300 VanDerWaalsContact CG-O 3.31Å; H284-S300 PolarHBondContact ND1-O 3.37Å; H284-S300 PolarHBondContact NE2-O 3.27Å; H284-I302 HydrophobicContact CB-CD1 4.38Å; H284-I302 HydrophobicContact CB-CG1 4.42Å
285	E	94.4	Very high	94.6	Very high	145 Å²	145	49.7 Å²	49.7	68%	0.678	26%	0.262	S	S	*	.	H	α-helix	trans	-67	-42.1	-179.4	-63.9	179.6	-179	0	0	111.4	S283 L288 N289	S283-E285 VanDerWaalsContact C-N 3.32Å; S283-E285 PolarHBondContact O-N 2.9Å; E285-L288 PolarHBondContact O-N 3.28Å; E285-N289 WeakPolarHBondContact O-CB 3.2Å; E285-N289 VanDerWaalsContact O-CG 3.22Å; E285-N289 PolarHBondContact O-N 3.32Å; E285-N289 PolarHBondContact O-ND2 3.39Å
286	D	93.8	Very high	94.6	Very high	40 Å²	40	46.5 Å²	46.5	21%	0.214	25%	0.25	C	C	.	.	H	α-helix	trans	-67.6	-39.2	179.4	-66.6	-37.6	0	0	0	112	V282 S283 L288 N289 Y290 K441	V282-D286 HydrophobicContact CG1-CB 4.44Å; S283-D286 PolarHBondContact O-N 3.34Å; S283-D286 VanDerWaalsContact OG-CB 3.26Å; S283-D286 WeakPolarHBondContact OG-CB 2.94Å; S283-D286 PolarHBondContact OG-N 3.33Å; S283-D286 PolarHBondContact OG-OD2 3.38Å; D286-L288 PolarHBondContact O-N 3.09Å; D286-N289 PolarHBondContact O-N 3.26Å; D286-Y290 HydrophobicContact CB-CD2 4.45Å; D286-Y290 WeakPolarHBondContact O-CB 3.46Å; D286-Y290 VanDerWaalsContact O-CD2 3.27Å; D286-Y290 WeakPolarHBondContact O-CD2 3.37Å; D286-Y290 PolarHBondContact O-N 3.28Å; D286-K441 VanDerWaalsContact CG-CE 3.4Å; D286-K441 IonicContact OD1-NZ 2.72Å; D286-K441 PolarHBondContact OD1-NZ 2.73Å; D286-K441 WeakPolarHBondContact OD2-CE 3.27Å; D286-K441 IonicContact OD2-NZ 3.15Å; D286-K441 PolarHBondContact OD2-NZ 3.45Å
287	A	93.9	Very high	94.5	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.2	-39.7	177.2	0	0	0	0	0	111.5	V282 S283 F292 L297 I302	V282-A287 HydrophobicContact CG1-CB 3.77Å; S283-A287 WeakPolarHBondContact O-CB 2.89Å; S283-A287 PolarHBondContact O-N 3.25Å; A287-F292 HydrophobicContact CB-CD2 4.23Å; A287-F292 WeakPolarHBondContact O-CB 3.3Å; A287-F292 PolarHBondContact O-N 2.87Å; A287-L297 HydrophobicContact CB-CD2 3.74Å; A287-I302 HydrophobicContact CB-CD1 4.35Å
288	L	94.6	Very high	94.5	Very high	109 Å²	109	44.5 Å²	44.5	57%	0.571	24%	0.237	S	C	*	.	H	α-helix	trans	-72.5	-46.8	176	-67.2	174	0	0	0	112.3	H284 E285 D286 Y290 G291 L297 I302	H284-L288 PolarHBondContact O-N 3.13Å; E285-L288 PolarHBondContact O-N 3.28Å; D286-L288 PolarHBondContact O-N 3.09Å; L288-Y290 VanDerWaalsContact C-N 3.33Å; L288-Y290 PolarHBondContact O-N 3.23Å; L288-G291 PolarHBondContact O-N 2.94Å; L288-L297 HydrophobicContact CD2-CD2 4.27Å; L288-I302 HydrophobicContact CD1-CD1 4.23Å; L288-I302 HydrophobicContact CD2-CD1 3.99Å; L288-I302 HydrophobicContact CG-CD1 3.79Å
289	N	96.3	Very high	94.4	Very high	126 Å²	126	39.1 Å²	39.1	67%	0.674	21%	0.208	S	C	*	.	H	α-helix	trans	-64.4	-36.3	-176.8	-72.1	-28.3	0	0	0	112.8	E285 D286 G291	E285-N289 WeakPolarHBondContact O-CB 3.2Å; E285-N289 VanDerWaalsContact O-CG 3.22Å; E285-N289 PolarHBondContact O-N 3.32Å; E285-N289 PolarHBondContact O-ND2 3.39Å; D286-N289 PolarHBondContact O-N 3.26Å; N289-G291 PolarHBondContact O-N 3.04Å
290	Y	94.1	Very high	94.3	Very high	96 Å²	96	38.7 Å²	38.7	38%	0.376	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.1	176.6	-78.8	-105.7	0	0	0	112.9	D286 L288 F292 K441	D286-Y290 HydrophobicContact CB-CD2 4.45Å; D286-Y290 WeakPolarHBondContact O-CB 3.46Å; D286-Y290 VanDerWaalsContact O-CD2 3.27Å; D286-Y290 WeakPolarHBondContact O-CD2 3.37Å; D286-Y290 PolarHBondContact O-N 3.28Å; L288-Y290 VanDerWaalsContact C-N 3.33Å; L288-Y290 PolarHBondContact O-N 3.23Å; Y290-F292 VanDerWaalsContact C-N 3.32Å; Y290-F292 PolarHBondContact O-N 3.04Å; Y290-K441 HydrophobicContact CD2-CD 4.41Å; Y290-K441 HydrophobicContact CE1-CB 4.31Å; Y290-K441 HydrophobicContact CE1-CD 4.27Å; Y290-K441 HydrophobicContact CE2-CD 3.52Å; Y290-K441 VanDerWaalsContact CZ-CD 3.44Å; Y290-K441 VanDerWaalsContact OH-CD 3.28Å; Y290-K441 WeakPolarHBondContact OH-CD 3.49Å
291	G	94.6	Very high	94.3	Very high	33 Å²	33	39.6 Å²	39.6	34%	0.34	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	31.3	179.4	0	0	0	0	0	113.3	L288 N289 A434	L288-G291 PolarHBondContact O-N 2.94Å; N289-G291 PolarHBondContact O-N 3.04Å; G291-A434 WeakPolarHBondContact O-CB 3.41Å
292	F	95.3	Very high	94.2	Very high	12 Å²	12	37.4 Å²	37.4	5%	0.053	20%	0.201	C	C	.	.			trans	-64	157.6	172.5	-67.7	-12.2	0	0	0	110.6	V282 A287 Y290 M296 L297 A434 H435 M442	V282-F292 HydrophobicContact CG1-CD2 4.06Å; V282-F292 HydrophobicContact CG1-CE2 3.88Å; V282-F292 HydrophobicContact CG2-CE2 4.03Å; A287-F292 HydrophobicContact CB-CD2 4.23Å; A287-F292 WeakPolarHBondContact O-CB 3.3Å; A287-F292 PolarHBondContact O-N 2.87Å; Y290-F292 VanDerWaalsContact C-N 3.32Å; Y290-F292 PolarHBondContact O-N 3.04Å; F292-M296 HydrophobicContact CB-CB 4Å; F292-M296 HydrophobicContact CD2-CB 4.21Å; F292-M296 HydrophobicContact CD2-CE 4.06Å; F292-M296 HydrophobicContact CE2-CE 3.87Å; F292-M296 HydrophobicContact CG-CB 4.28Å; F292-M296 HydrophobicContact CZ-CE 4.43Å; F292-L297 HydrophobicContact CB-CD2 4.16Å; F292-L297 HydrophobicContact CB-CG 4.47Å; F292-L297 VanDerWaalsContact O-CD1 3.26Å; F292-L297 WeakPolarHBondContact O-CD1 3.33Å; F292-L297 WeakPolarHBondContact O-CD2 3.38Å; F292-L297 VanDerWaalsContact O-CG 3.26Å; F292-L297 WeakPolarHBondContact O-CG 3.4Å; F292-A434 WeakPolarHBondContact CE1-O 3.49Å; F292-H435 AromaticContact CD1-CD2 3.83Å; F292-M442 HydrophobicContact CE2-SD 4.24Å; F292-M442 HydrophobicContact CZ-CE 4.16Å; F292-M442 HydrophobicContact CZ-SD 4.25Å
293	S	94.7	Very high	94.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.014	23%	0.234	C	C	.	.			trans	-149.3	161.5	-178.4	63.2	0	0	0	0	111.3	E410 H435	S293-E410 PolarHBondContact OG-N 2.91Å; S293-H435 PolarHBondContact O-NE2 2.67Å; S293-H435 VanDerWaalsContact O-NE2 3.15Å
294	G	94.2	Very high	94.1	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.01	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	-135.2	176.7	0	0	0	0	0	113.5	M296 L297 R298 E405	G294-M296 PolarHBondContact O-N 3.46Å; G294-M296 VanDerWaalsContact O-N 3.17Å; G294-L297 PolarHBondContact O-N 3.4Å; G294-R298 PolarHBondContact O-N 3.18Å; G294-E405 WeakPolarHBondContact CA-OE1 3.3Å
295	V	95.3	Very high	94.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-57.2	-32.5	-177.8	-175.9	0	0	0	0	112.2	L297 R298 G299 R333 C336 R337	V295-L297 PolarHBondContact O-N 2.89Å; V295-R298 PolarHBondContact O-N 3.33Å; V295-G299 PolarHBondContact O-N 2.98Å; V295-R333 HydrophobicContact CG1-CB 3.97Å; V295-R333 HydrophobicContact CG1-CG 4.33Å; V295-C336 HydrophobicContact CG1-CB 4.08Å; V295-R337 HydrophobicContact CG1-CG 4.08Å; V295-R337 HydrophobicContact CG2-CG 4.14Å
296	M	93.8	Very high	94.2	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-39	177.1	-66	-63.7	-62.9	0	0	112.4	V282 F292 G294 S300 R333 M442 Q458	V282-M296 HydrophobicContact CG2-CE 4.44Å; F292-M296 HydrophobicContact CB-CB 4Å; F292-M296 HydrophobicContact CD2-CB 4.21Å; F292-M296 HydrophobicContact CD2-CE 4.06Å; F292-M296 HydrophobicContact CE2-CE 3.87Å; F292-M296 HydrophobicContact CG-CB 4.28Å; F292-M296 HydrophobicContact CZ-CE 4.43Å; G294-M296 PolarHBondContact O-N 3.46Å; G294-M296 VanDerWaalsContact O-N 3.17Å; M296-S300 PolarHBondContact O-OG 3.4Å; M296-R333 VanDerWaalsContact SD-CD 3.55Å; M296-M442 HydrophobicContact CE-SD 3.73Å; M296-Q458 HydrophobicContact CE-CG 4.34Å; M296-Q458 HydrophobicContact SD-CG 4.22Å
297	L	94.6	Very high	94.2	Very high	10 Å²	10	34.8 Å²	34.8	5%	0.052	18%	0.175	C	C	.	.	H	α-helix	trans	-72.9	-44.6	174.7	-71.1	-179.7	0	0	0	111.4	A287 L288 F292 G294 V295 S300 G301 I302 W304	A287-L297 HydrophobicContact CB-CD2 3.74Å; L288-L297 HydrophobicContact CD2-CD2 4.27Å; F292-L297 HydrophobicContact CB-CD2 4.16Å; F292-L297 HydrophobicContact CB-CG 4.47Å; F292-L297 VanDerWaalsContact O-CD1 3.26Å; F292-L297 WeakPolarHBondContact O-CD1 3.33Å; F292-L297 WeakPolarHBondContact O-CD2 3.38Å; F292-L297 VanDerWaalsContact O-CG 3.26Å; F292-L297 WeakPolarHBondContact O-CG 3.4Å; G294-L297 PolarHBondContact O-N 3.4Å; V295-L297 PolarHBondContact O-N 2.89Å; L297-S300 PolarHBondContact O-N 3.38Å; L297-G301 PolarHBondContact O-N 3.05Å; L297-I302 HydrophobicContact CB-CB 4.45Å; L297-I302 HydrophobicContact CD2-CD1 3.98Å; L297-I302 PolarHBondContact O-N 2.93Å; L297-W304 HydrophobicContact CD1-CB 4.49Å; L297-W304 HydrophobicContact CD1-CG 4.49Å
298	R	95.3	Very high	94.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-40.9	-178.4	-70.5	-168.8	-75.8	-88.1	6.2	111.9	G294 V295 S300 G301 W304 V322 P323 G325 E340 E405	G294-R298 PolarHBondContact O-N 3.18Å; V295-R298 PolarHBondContact O-N 3.33Å; R298-S300 VanDerWaalsContact C-N 3.25Å; R298-S300 PolarHBondContact O-N 3.37Å; R298-G301 PolarHBondContact O-N 3.3Å; R298-G301 VanDerWaalsContact O-N 3.08Å; R298-W304 PolarHBondContact NH1-O 2.85Å; R298-V322 HydrophobicContact CG-CG1 4.47Å; R298-P323 WeakPolarHBondContact CD-O 3.44Å; R298-G325 PolarHBondContact O-N 3.42Å; R298-E340 IonicContact CZ-OE1 3.93Å; R298-E340 IonicContact NE-OE1 3.32Å; R298-E340 PolarHBondContact NE-OE1 2.95Å; R298-E340 VanDerWaalsContact NH2-CD 3.3Å; R298-E340 IonicContact NH2-OE1 3.41Å; R298-E340 PolarHBondContact NH2-OE1 2.74Å; R298-E340 IonicContact NH2-OE2 3.88Å; R298-E340 PolarHBondContact NH2-OE2 3.22Å; R298-E340 VanDerWaalsContact NH2-OE2 3.15Å; R298-E405 IonicContact CZ-OE1 3.5Å; R298-E405 IonicContact NH1-OE1 2.82Å; R298-E405 PolarHBondContact NH1-OE1 3.28Å; R298-E405 IonicContact NH2-OE1 2.62Å
299	G	92.4	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.9	-34.8	176.2	0	0	0	0	0	112.6	V295 G301 G325 G328	V295-G299 PolarHBondContact O-N 2.98Å; G299-G301 VanDerWaalsContact C-N 3.26Å; G299-G301 PolarHBondContact O-N 2.96Å; G299-G325 CarbonylContact O-C 3.06Å; G299-G325 WeakPolarHBondContact O-CA 3.22Å; G299-G328 WeakPolarHBondContact O-CA 3.43Å; G299-G328 PolarHBondContact O-N 3.32Å; G299-G328 VanDerWaalsContact O-N 3.11Å
300	S	93.2	Very high	93.9	Very high	1 Å²	1	37 Å²	37	1%	0.007	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	5	175.7	-68.1	0	0	0	0	114.4	V282 H284 M296 L297 R298	V282-S300 PolarHBondContact O-OG 3.37Å; H284-S300 PolarHBondContact CD2-O 2.84Å; H284-S300 PolarHBondContact CE1-O 3.32Å; H284-S300 VanDerWaalsContact CG-O 3.31Å; H284-S300 PolarHBondContact ND1-O 3.37Å; H284-S300 PolarHBondContact NE2-O 3.27Å; M296-S300 PolarHBondContact O-OG 3.4Å; L297-S300 PolarHBondContact O-N 3.38Å; R298-S300 VanDerWaalsContact C-N 3.25Å; R298-S300 PolarHBondContact O-N 3.37Å
301	G	91.6	Very high	93.7	Very high	20 Å²	20	34.6 Å²	34.6	21%	0.206	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	95	1.2	174.8	0	0	0	0	0	116	L297 R298 G299 G325	L297-G301 PolarHBondContact O-N 3.05Å; R298-G301 PolarHBondContact O-N 3.3Å; R298-G301 VanDerWaalsContact O-N 3.08Å; G299-G301 VanDerWaalsContact C-N 3.26Å; G299-G301 PolarHBondContact O-N 2.96Å; G301-G325 VanDerWaalsContact CA-O 3.31Å; G301-G325 WeakPolarHBondContact CA-O 3.44Å
302	I	93.6	Very high	93.6	Very high	32 Å²	32	34.1 Å²	34.1	16%	0.164	17%	0.169	C	C	.	.			trans	-83.8	124.8	179.7	-61.8	167.3	0	0	0	110.2	H284 A287 L288 L297 W304	H284-I302 HydrophobicContact CB-CD1 4.38Å; H284-I302 HydrophobicContact CB-CG1 4.42Å; A287-I302 HydrophobicContact CB-CD1 4.35Å; L288-I302 HydrophobicContact CD1-CD1 4.23Å; L288-I302 HydrophobicContact CD2-CD1 3.99Å; L288-I302 HydrophobicContact CG-CD1 3.79Å; L297-I302 HydrophobicContact CB-CB 4.45Å; L297-I302 HydrophobicContact CD2-CD1 3.98Å; L297-I302 PolarHBondContact O-N 2.93Å; I302-W304 VanDerWaalsContact C-N 3.35Å; I302-W304 HydrophobicContact CG2-CB 4.05Å; I302-W304 PolarHBondContact O-N 3.47Å
303	K	94.3	Very high	93.4	Very high	172 Å²	172	34.8 Å²	34.8	75%	0.748	17%	0.173	S	C	*	.			trans	-80.3	77.8	179	-54.3	-167.3	-178.2	-179.9	0	111.2	I324	K303-I324 HydrophobicContact CB-CD1 4.45Å; K303-I324 HydrophobicContact CD-CD1 3.86Å; K303-I324 HydrophobicContact CG-CD1 3.64Å; K303-I324 HydrophobicContact CG-CG1 4.36Å
304	W	93.8	Very high	93.3	Very high	99 Å²	99	37 Å²	37	38%	0.375	18%	0.182	S	C	.	.			trans	-135.5	124.7	-178.9	-168.5	-103.3	0	0	0	112.4	L297 R298 I302 L306	L297-W304 HydrophobicContact CD1-CB 4.49Å; L297-W304 HydrophobicContact CD1-CG 4.49Å; R298-W304 PolarHBondContact NH1-O 2.85Å; I302-W304 VanDerWaalsContact C-N 3.35Å; I302-W304 HydrophobicContact CG2-CB 4.05Å; I302-W304 PolarHBondContact O-N 3.47Å; W304-L306 HydrophobicContact CZ2-CD2 4.02Å
305	D	94.8	Very high	93.2	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.037	18%	0.182	C	C	.	.			trans	-153.5	123.6	172	-175.9	-16.3	0	0	0	108	R307 K308 S309 V322 E405	D305-R307 PolarHBondContact O-N 2.81Å; D305-R307 WeakPolarHBondContact OD1-CB 3.46Å; D305-R307 PolarHBondContact OD1-N 3.43Å; D305-R307 IonicContact OD1-NE 3.67Å; D305-R307 PolarHBondContact OD1-NE 3.28Å; D305-R307 IonicContact OD2-CZ 2.78Å; D305-R307 IonicContact OD2-NE 3.2Å; D305-R307 PolarHBondContact OD2-NE 3.02Å; D305-R307 IonicContact OD2-NH2 2.91Å; D305-R307 PolarHBondContact OD2-NH2 3.39Å; D305-K308 PolarHBondContact O-N 2.82Å; D305-S309 PolarHBondContact O-N 3.13Å; D305-S309 PolarHBondContact O-OG 3.1Å; D305-S309 VanDerWaalsContact O-OG 3.09Å; D305-V322 HydrophobicContact CB-CG1 4.11Å; D305-V322 HydrophobicContact CB-CG2 4.01Å; D305-V322 WeakPolarHBondContact OD2-CG2 3.44Å; D305-E405 VanDerWaalsContact OD1-CG 3.31Å; D305-E405 WeakPolarHBondContact OD1-CG 3.48Å
306	L	94.3	Very high	93.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-28.8	-178.6	-66.1	172.1	0	0	0	112.5	W304 K308 S309 Q310 S311 A403 E405 E410	W304-L306 HydrophobicContact CZ2-CD2 4.02Å; L306-K308 PolarHBondContact O-N 3.04Å; L306-K308 VanDerWaalsContact O-N 3.17Å; L306-S309 PolarHBondContact O-N 3.06Å; L306-Q310 HydrophobicContact CD2-CB 4.34Å; L306-Q310 CarbonylContact O-C 3.42Å; L306-Q310 WeakPolarHBondContact O-CA 3.41Å; L306-Q310 PolarHBondContact O-N 2.9Å; L306-S311 PolarHBondContact O-N 2.64Å; L306-A403 HydrophobicContact CD1-CB 4.05Å; L306-E405 HydrophobicContact CB-CB 4.13Å; L306-E405 WeakPolarHBondContact CB-OE2 3.22Å; L306-E405 VanDerWaalsContact CG-OE2 3.31Å; L306-E405 WeakPolarHBondContact CG-OE2 3.49Å; L306-E405 PolarHBondContact N-OE2 3.26Å; L306-E405 VanDerWaalsContact N-OE2 3.08Å; L306-E410 HydrophobicContact CD1-CB 4.16Å; L306-E410 HydrophobicContact CD1-CG 3.77Å
307	R	93.6	Very high	93.1	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-24.8	179.1	-65.1	175.5	-66.4	172.7	3.3	113.1	E180 R183 D305 Y312 Y315 F320 E405	E180-R307 IonicContact OE1-CZ 3.27Å; E180-R307 IonicContact OE1-NH1 3.8Å; E180-R307 PolarHBondContact OE1-NH1 3.11Å; E180-R307 IonicContact OE2-NH1 3.41Å; E180-R307 PolarHBondContact OE2-NH1 3.14Å; R183-R307 VanDerWaalsContact CZ-NH1 3.34Å; D305-R307 PolarHBondContact O-N 2.81Å; D305-R307 WeakPolarHBondContact OD1-CB 3.46Å; D305-R307 PolarHBondContact OD1-N 3.43Å; D305-R307 IonicContact OD1-NE 3.67Å; D305-R307 PolarHBondContact OD1-NE 3.28Å; D305-R307 IonicContact OD2-CZ 2.78Å; D305-R307 IonicContact OD2-NE 3.2Å; D305-R307 PolarHBondContact OD2-NE 3.02Å; D305-R307 IonicContact OD2-NH2 2.91Å; D305-R307 PolarHBondContact OD2-NH2 3.39Å; R307-Y312 HydrophobicContact CG-CE1 4.19Å; R307-Y315 HydrophobicContact CB-CD1 4.28Å; R307-Y315 HydrophobicContact CB-CG 4.22Å; R307-Y315 HydrophobicContact CG-CD1 4.16Å; R307-Y315 HydrophobicContact CG-CD2 4.35Å; R307-Y315 HydrophobicContact CG-CE1 4.28Å; R307-Y315 HydrophobicContact CG-CE2 4.49Å; R307-Y315 HydrophobicContact CG-CG 4.2Å; R307-F320 HydrophobicContact CB-CZ 3.76Å; R307-E405 HydrophobicContact CG-CB 3.88Å
308	K	92.4	Very high	93.1	Very high	100 Å²	100	46.2 Å²	46.2	44%	0.435	23%	0.228	S	C	.	.	H	α-helix	trans	-101.2	-39.7	177	-68	-64.7	-164.7	-175.6	0	112.8	D305 L306 F320 V322	D305-K308 PolarHBondContact O-N 2.82Å; L306-K308 PolarHBondContact O-N 3.04Å; L306-K308 VanDerWaalsContact O-N 3.17Å; K308-F320 HydrophobicContact CD-CE1 3.99Å; K308-F320 HydrophobicContact CD-CE2 4.3Å; K308-F320 HydrophobicContact CD-CZ 3.72Å; K308-F320 VanDerWaalsContact CE-CE1 3.5Å; K308-F320 WeakPolarHBondContact CE-O 3.22Å; K308-F320 HydrophobicContact CG-CE2 4.16Å; K308-F320 HydrophobicContact CG-CZ 3.82Å; K308-F320 PolarHBondContact NZ-O 3.5Å; K308-V322 HydrophobicContact CG-CG2 4.12Å
309	S	92.8	Very high	93.1	Very high	57 Å²	57	52.2 Å²	52.2	40%	0.399	26%	0.256	S	S	.	.	H	α-helix	trans	-82.6	-38.5	-174.8	64.2	0	0	0	0	113.1	D305 L306	D305-S309 PolarHBondContact O-N 3.13Å; D305-S309 PolarHBondContact O-OG 3.1Å; D305-S309 VanDerWaalsContact O-OG 3.09Å; L306-S309 PolarHBondContact O-N 3.06Å
310	Q	92.8	Very high	93.2	Very high	125 Å²	125	52.4 Å²	52.4	58%	0.584	26%	0.257	S	S	*	.	S	Bend	trans	-135.6	67.8	-179.1	-65.4	-175.8	6.7	0	0	108.7	L306	L306-Q310 HydrophobicContact CD2-CB 4.34Å; L306-Q310 CarbonylContact O-C 3.42Å; L306-Q310 WeakPolarHBondContact O-CA 3.41Å; L306-Q310 PolarHBondContact O-N 2.9Å
311	S	91.1	Very high	93.4	Very high	46 Å²	46	57 Å²	57	32%	0.322	28%	0.282	S	S	.	.			trans	-57.1	142.7	-176.7	55.7	0	0	0	0	112.2	L306 D316	L306-S311 PolarHBondContact O-N 2.64Å; S311-D316 WeakPolarHBondContact CB-OD1 3.43Å; S311-D316 WeakPolarHBondContact CB-OD2 3.03Å; S311-D316 PolarHBondContact OG-OD1 2.69Å; S311-D316 PolarHBondContact OG-OD2 2.94Å
312	Y	93	Very high	93.6	Very high	23 Å²	23	57.9 Å²	57.9	9%	0.09	28%	0.283	C	S	.	.			trans	-129.7	161.6	174.5	52.4	-86.2	0	0	0	109	L157 R307 K314 Y315 V404 E405	L157-Y312 HydrophobicContact CD1-CD2 3.75Å; L157-Y312 HydrophobicContact CD1-CG 4.07Å; R307-Y312 HydrophobicContact CG-CE1 4.19Å; Y312-K314 PolarHBondContact O-N 3.32Å; Y312-Y315 AromaticContact CD2-CD2 3.95Å; Y312-Y315 HydrophobicContact CD2-CD2 3.95Å; Y312-Y315 AromaticContact CD2-CE2 3.91Å; Y312-Y315 HydrophobicContact CD2-CE2 3.91Å; Y312-Y315 HydrophobicContact CE1-CD2 4.49Å; Y312-Y315 AromaticContact CE2-CD2 3.72Å; Y312-Y315 HydrophobicContact CE2-CD2 3.72Å; Y312-Y315 AromaticContact CE2-CE2 3.32Å; Y312-Y315 HydrophobicContact CE2-CE2 3.32Å; Y312-Y315 HydrophobicContact CG-CD2 4.44Å; Y312-Y315 AromaticContact CZ-CD2 3.98Å; Y312-Y315 AromaticContact CZ-CE2 3.73Å; Y312-Y315 VanDerWaalsContact O-CD2 3.3Å; Y312-Y315 WeakPolarHBondContact O-CD2 2.89Å; Y312-Y315 PolarHBondContact O-N 2.99Å; Y312-V404 HydrophobicContact CD2-CG2 4.48Å; Y312-V404 HydrophobicContact CE1-CG1 4.33Å; Y312-V404 HydrophobicContact CE2-CG1 3.78Å; Y312-V404 HydrophobicContact CE2-CG2 4.23Å; Y312-V404 VanDerWaalsContact OH-CG1 3.28Å; Y312-V404 WeakPolarHBondContact OH-CG1 3.21Å; Y312-E405 PolarHBondContact OH-N 3.29Å
313	D	90.5	Very high	93.7	Very high	26 Å²	26	56.7 Å²	56.7	14%	0.139	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	-113.2	-173.3	-65.7	-45.9	0	0	0	112	Q153 Q172 R175 V176	Q153-D313 PolarHBondContact NE2-OD2 3.4Å; Q172-D313 HydrophobicContact CB-CB 4.08Å; Q172-D313 HydrophobicContact CG-CB 4.3Å; R175-D313 IonicContact NH1-OD1 3.75Å; V176-D313 HydrophobicContact CG2-CB 4.09Å
314	K	91.9	Very high	93.7	Very high	49 Å²	49	52.1 Å²	52.1	21%	0.213	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	26.1	-176.2	-69.7	-67	-174	175.3	0	113.9	Q172 W173 V176 Y312 D316 E317	Q172-K314 HydrophobicContact CB-CG 3.77Å; W173-K314 HydrophobicContact CD2-CB 4.39Å; W173-K314 HydrophobicContact CZ2-CB 4.37Å; V176-K314 HydrophobicContact CG2-CB 4.41Å; Y312-K314 PolarHBondContact O-N 3.32Å; K314-D316 PolarHBondContact O-N 3.32Å; K314-E317 HydrophobicContact CD-CG 4.43Å; K314-E317 WeakPolarHBondContact CD-OE1 3.25Å; K314-E317 IonicContact NZ-OE1 2.76Å; K314-E317 PolarHBondContact NZ-OE1 2.78Å; K314-E317 PolarHBondContact O-N 3.32Å
315	Y	92.9	Very high	93.7	Very high	3 Å²	3	48 Å²	48	1%	0.012	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-64.2	-18.9	175.1	-76.9	-73.5	0	0	0	113.9	V176 E180 R307 Y312 E317 V318	V176-Y315 HydrophobicContact CG1-CD1 4.31Å; V176-Y315 HydrophobicContact CG1-CE1 3.88Å; V176-Y315 HydrophobicContact CG2-CD2 4.16Å; V176-Y315 HydrophobicContact CG2-CE2 3.91Å; E180-Y315 HydrophobicContact CG-CE1 4.32Å; E180-Y315 WeakPolarHBondContact OE1-CE1 3.27Å; E180-Y315 PolarHBondContact OE1-OH 3.04Å; R307-Y315 HydrophobicContact CB-CD1 4.28Å; R307-Y315 HydrophobicContact CB-CG 4.22Å; R307-Y315 HydrophobicContact CG-CD1 4.16Å; R307-Y315 HydrophobicContact CG-CD2 4.35Å; R307-Y315 HydrophobicContact CG-CE1 4.28Å; R307-Y315 HydrophobicContact CG-CE2 4.49Å; R307-Y315 HydrophobicContact CG-CG 4.2Å; Y312-Y315 AromaticContact CD2-CD2 3.95Å; Y312-Y315 HydrophobicContact CD2-CD2 3.95Å; Y312-Y315 AromaticContact CD2-CE2 3.91Å; Y312-Y315 HydrophobicContact CD2-CE2 3.91Å; Y312-Y315 HydrophobicContact CE1-CD2 4.49Å; Y312-Y315 AromaticContact CE2-CD2 3.72Å; Y312-Y315 HydrophobicContact CE2-CD2 3.72Å; Y312-Y315 AromaticContact CE2-CE2 3.32Å; Y312-Y315 HydrophobicContact CE2-CE2 3.32Å; Y312-Y315 HydrophobicContact CG-CD2 4.44Å; Y312-Y315 AromaticContact CZ-CD2 3.98Å; Y312-Y315 AromaticContact CZ-CE2 3.73Å; Y312-Y315 VanDerWaalsContact O-CD2 3.3Å; Y312-Y315 WeakPolarHBondContact O-CD2 2.89Å; Y312-Y315 PolarHBondContact O-N 2.99Å; Y315-E317 VanDerWaalsContact C-N 3.32Å; Y315-E317 PolarHBondContact O-N 2.82Å; Y315-V318 HydrophobicContact CD1-CG2 4.16Å; Y315-V318 WeakPolarHBondContact O-CG2 3.33Å
316	D	93.4	Very high	93.6	Very high	113 Å²	113	51.6 Å²	51.6	60%	0.604	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-70.2	-25.9	175.8	-70.4	-33.1	0	0	0	114.1	S311 K314	S311-D316 WeakPolarHBondContact CB-OD1 3.43Å; S311-D316 WeakPolarHBondContact CB-OD2 3.03Å; S311-D316 PolarHBondContact OG-OD1 2.69Å; S311-D316 PolarHBondContact OG-OD2 2.94Å; K314-D316 PolarHBondContact O-N 3.32Å
317	E	93.1	Very high	93.4	Very high	85 Å²	85	55.9 Å²	55.9	40%	0.397	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-93.2	0.1	-175.3	-65.3	178.6	-162	0	0	112.5	W173 K314 Y315 K354	W173-E317 HydrophobicContact CH2-CB 4.06Å; W173-E317 HydrophobicContact CZ2-CB 4.03Å; W173-E317 VanDerWaalsContact CZ2-OE2 3.32Å; W173-E317 WeakPolarHBondContact CZ2-OE2 3.46Å; K314-E317 HydrophobicContact CD-CG 4.43Å; K314-E317 WeakPolarHBondContact CD-OE1 3.25Å; K314-E317 IonicContact NZ-OE1 2.76Å; K314-E317 PolarHBondContact NZ-OE1 2.78Å; K314-E317 PolarHBondContact O-N 3.32Å; Y315-E317 VanDerWaalsContact C-N 3.32Å; Y315-E317 PolarHBondContact O-N 2.82Å; E317-K354 PolarHBondContact O-NZ 3.46Å
318	V	93.8	Very high	93.4	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.024	30%	0.296	C	S	.	.	S	Bend	trans	-109.4	138.7	179.6	-64.5	0	0	0	0	112	W173 Y315 F320 I347	W173-V318 HydrophobicContact CH2-CG1 3.86Å; W173-V318 HydrophobicContact CZ3-CG1 3.63Å; Y315-V318 HydrophobicContact CD1-CG2 4.16Å; Y315-V318 WeakPolarHBondContact O-CG2 3.33Å; V318-F320 HydrophobicContact CG2-CD1 3.98Å; V318-F320 HydrophobicContact CG2-CE1 4.1Å; V318-I347 HydrophobicContact CB-CG2 4.32Å; V318-I347 HydrophobicContact CG1-CG2 4.21Å; V318-I347 HydrophobicContact CG2-CG2 4.24Å
319	E	95.2	Very high	93.5	Very high	127 Å²	127	51 Å²	51	59%	0.593	28%	0.276	S	S	*	.			trans	-99.1	111.4	-179.6	-68	178.4	-168.6	0	0	110	R346 Q350	E319-R346 PolarHBondContact O-NE 2.74Å; E319-Q350 PolarHBondContact O-NE2 3.06Å
320	F	96.3	Very high	93.6	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.018	26%	0.257	C	S	.	.			trans	-149.3	157	175.1	70.6	-82.8	0	0	0	110.2	R307 K308 V318 V322 Q343 I347	R307-F320 HydrophobicContact CB-CZ 3.76Å; K308-F320 HydrophobicContact CD-CE1 3.99Å; K308-F320 HydrophobicContact CD-CE2 4.3Å; K308-F320 HydrophobicContact CD-CZ 3.72Å; K308-F320 VanDerWaalsContact CE-CE1 3.5Å; K308-F320 WeakPolarHBondContact CE-O 3.22Å; K308-F320 HydrophobicContact CG-CE2 4.16Å; K308-F320 HydrophobicContact CG-CZ 3.82Å; K308-F320 PolarHBondContact NZ-O 3.5Å; V318-F320 HydrophobicContact CG2-CD1 3.98Å; V318-F320 HydrophobicContact CG2-CE1 4.1Å; F320-V322 HydrophobicContact CD2-CG2 4.29Å; F320-V322 HydrophobicContact CE2-CG2 3.81Å; F320-Q343 HydrophobicContact CB-CB 4.49Å; F320-I347 HydrophobicContact CB-CD1 3.94Å; F320-I347 HydrophobicContact CB-CG1 3.83Å; F320-I347 HydrophobicContact CD1-CD1 3.87Å; F320-I347 HydrophobicContact CD1-CG1 4.11Å; F320-I347 HydrophobicContact CD2-CD1 4.25Å; F320-I347 HydrophobicContact CE1-CD1 4.43Å; F320-I347 HydrophobicContact CG-CD1 3.76Å; F320-I347 HydrophobicContact CG-CG1 4.1Å
321	D	95.9	Very high	93.8	Very high	97 Å²	97	43.7 Å²	43.7	52%	0.519	23%	0.234	S	C	.	.			trans	-106.3	152.5	177.6	-53.9	-53.1	0	0	0	109.8	Q343 R346	D321-Q343 VanDerWaalsContact N-OE1 3.13Å; D321-Q343 VanDerWaalsContact O-CG 3.29Å; D321-Q343 WeakPolarHBondContact O-CG 3.5Å; D321-R346 IonicContact OD2-NH1 2.67Å; D321-R346 PolarHBondContact OD2-NH1 3.09Å
322	V	95.6	Very high	94	Very high	38 Å²	38	42.2 Å²	42.2	23%	0.23	22%	0.223	C	C	.	.			trans	-108.3	122.8	-180	178.2	0	0	0	0	108.6	R298 D305 K308 F320	R298-V322 HydrophobicContact CG-CG1 4.47Å; D305-V322 HydrophobicContact CB-CG1 4.11Å; D305-V322 HydrophobicContact CB-CG2 4.01Å; D305-V322 WeakPolarHBondContact OD2-CG2 3.44Å; K308-V322 HydrophobicContact CG-CG2 4.12Å; F320-V322 HydrophobicContact CD2-CG2 4.29Å; F320-V322 HydrophobicContact CE2-CG2 3.81Å
323	P	95.9	Very high	94.2	Very high	8 Å²	8	41.1 Å²	41.1	5%	0.052	22%	0.219	C	C	.	.			trans	-74.1	143.7	179.6	31.8	-35.1	0	0	0	111.1	R298 C336 E339 E340	R298-P323 WeakPolarHBondContact CD-O 3.44Å; P323-C336 HydrophobicContact CB-CB 4.45Å; P323-C336 HydrophobicContact CG-CB 4.23Å; P323-C336 WeakPolarHBondContact CG-O 3.46Å; P323-E339 HydrophobicContact CB-CB 3.79Å; P323-E339 WeakPolarHBondContact CB-OE2 3.44Å; P323-E339 HydrophobicContact CG-CB 4.05Å; P323-E340 HydrophobicContact CG-CG 3.71Å
324	I	95.5	Very high	94.5	Very high	76 Å²	76	40 Å²	40	39%	0.39	21%	0.213	S	C	.	.			trans	-132.4	127.6	-176.8	-58.9	153.5	0	0	0	108	K303	K303-I324 HydrophobicContact CB-CD1 4.45Å; K303-I324 HydrophobicContact CD-CD1 3.86Å; K303-I324 HydrophobicContact CG-CD1 3.64Å; K303-I324 HydrophobicContact CG-CG1 4.36Å
325	G	92.9	Very high	94.7	Very high	12 Å²	12	39.7 Å²	39.7	12%	0.124	21%	0.213	C	C	.	.			trans	-79.7	170	174.8	0	0	0	0	0	112.4	R298 G299 G301	R298-G325 PolarHBondContact O-N 3.42Å; G299-G325 CarbonylContact O-C 3.06Å; G299-G325 WeakPolarHBondContact O-CA 3.22Å; G301-G325 VanDerWaalsContact CA-O 3.31Å; G301-G325 WeakPolarHBondContact CA-O 3.44Å
326	S	92.2	Very high	94.8	Very high	82 Å²	82	39.7 Å²	39.7	57%	0.573	21%	0.214	S	C	*	.	S	Bend	trans	-114.6	-42.4	-174.7	59	0	0	0	0	112.9	D332	S326-D332 PolarHBondContact N-OD2 3.35Å; S326-D332 PolarHBondContact OG-OD2 2.94Å
327	N	91.1	Very high	95	Very high	95 Å²	95	34.9 Å²	34.9	51%	0.508	19%	0.187	S	C	.	.	S	Bend	trans	-106	-19.4	-169	-60.5	-35.7	0	0	0	112.9	D329 D332	N327-D329 WeakPolarHBondContact CB-OD1 3.4Å; N327-D332 PolarHBondContact N-OD2 3.18Å
328	G	92.3	Very high	95.2	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.			trans	79.6	13.5	-179.2	0	0	0	0	0	115.1	V282 G299 R333	V282-G328 PolarHBondContact N-O 2.75Å; G299-G328 WeakPolarHBondContact O-CA 3.43Å; G299-G328 PolarHBondContact O-N 3.32Å; G299-G328 VanDerWaalsContact O-N 3.11Å; G328-R333 PolarHBondContact O-NH2 3.38Å
329	D	94.7	Very high	95.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.188	C	C	.	.	S	Bend	trans	-88.1	171.3	179.3	52	-10.9	0	0	0	113.2	N278 V281 N327 Y331 D332 R333	N278-D329 PolarHBondContact N-OD2 3.34Å; N278-D329 VanDerWaalsContact N-OD2 3.1Å; V281-D329 HydrophobicContact CG2-CB 4.22Å; N327-D329 WeakPolarHBondContact CB-OD1 3.4Å; D329-Y331 PolarHBondContact O-N 3.15Å; D329-D332 PolarHBondContact O-N 3.26Å; D329-D332 WeakPolarHBondContact OD1-CB 3.37Å; D329-R333 WeakPolarHBondContact O-CG 3.38Å; D329-R333 PolarHBondContact O-N 3.5Å
330	C	95.5	Very high	95.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-33.2	-179.4	-70.7	0	0	0	0	112.7	T276 I279 Y334 T457	T276-C330 WeakPolarHBondContact O-CB 3.45Å; I279-C330 PolarHBondContact O-N 3.28Å; I279-C330 VanDerWaalsContact O-N 3.17Å; I279-C330 PolarHBondContact O-SG 2.98Å; C330-Y334 PolarHBondContact O-N 3.28Å; C330-Y334 VanDerWaalsContact O-N 3.09Å; C330-T457 HydrophobicContact CB-CG2 3.38Å; C330-T457 WeakPolarHBondContact SG-CG2 3.24Å
331	Y	96.8	Very high	95.4	Very high	28 Å²	28	29.1 Å²	29.1	11%	0.11	16%	0.16	C	C	.	.	H	α-helix	trans	-68.6	-46.1	178.8	-173.2	-107.1	0	0	0	112.6	T267 K273 T276 V277 D329 R333 Y334 L335	T267-Y331 WeakPolarHBondContact CG2-OH 3.46Å; T267-Y331 PolarHBondContact O-OH 2.71Å; K273-Y331 VanDerWaalsContact CE-OH 3.3Å; K273-Y331 WeakPolarHBondContact CE-OH 3.39Å; K273-Y331 HydrophobicContact CG-CE2 4Å; T276-Y331 PolarHBondContact O-N 3.2Å; T276-Y331 WeakPolarHBondContact OG1-CD2 3.26Å; V277-Y331 HydrophobicContact CG2-CD1 4.25Å; V277-Y331 HydrophobicContact CG2-CD2 4.43Å; V277-Y331 HydrophobicContact CG2-CG 3.96Å; D329-Y331 PolarHBondContact O-N 3.15Å; Y331-R333 VanDerWaalsContact C-N 3.29Å; Y331-R333 PolarHBondContact O-N 3.02Å; Y331-Y334 HydrophobicContact CD2-CD1 4.33Å; Y331-Y334 HydrophobicContact CE2-CD1 4.32Å; Y331-Y334 WeakPolarHBondContact O-CA 3.43Å; Y331-Y334 WeakPolarHBondContact O-CB 3.44Å; Y331-Y334 PolarHBondContact O-N 3.38Å; Y331-L335 HydrophobicContact CD1-CD1 3.98Å; Y331-L335 HydrophobicContact CD1-CG 4.41Å; Y331-L335 HydrophobicContact CE1-CD1 3.55Å; Y331-L335 HydrophobicContact CE1-CG 4.11Å; Y331-L335 PolarHBondContact O-N 3.06Å
332	D	95.8	Very high	95.4	Very high	15 Å²	15	28.4 Å²	28.4	8%	0.08	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-39	176.7	-79.3	3.4	0	0	0	111.3	S326 N327 D329 Y334 L335 C336	S326-D332 PolarHBondContact N-OD2 3.35Å; S326-D332 PolarHBondContact OG-OD2 2.94Å; N327-D332 PolarHBondContact N-OD2 3.18Å; D329-D332 PolarHBondContact O-N 3.26Å; D329-D332 WeakPolarHBondContact OD1-CB 3.37Å; D332-Y334 VanDerWaalsContact C-N 3.31Å; D332-Y334 PolarHBondContact O-N 3.29Å; D332-L335 PolarHBondContact O-N 3.04Å; D332-C336 PolarHBondContact O-N 3Å; D332-C336 PolarHBondContact O-SG 3.19Å
333	R	96.3	Very high	95.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.7	-35.2	174.2	-63.8	176.1	-147.4	158.6	5.7	112.9	G280 V295 M296 G328 D329 Y331 R337 T457	G280-R333 PolarHBondContact O-NH2 3.05Å; V295-R333 HydrophobicContact CG1-CB 3.97Å; V295-R333 HydrophobicContact CG1-CG 4.33Å; M296-R333 VanDerWaalsContact SD-CD 3.55Å; G328-R333 PolarHBondContact O-NH2 3.38Å; D329-R333 WeakPolarHBondContact O-CG 3.38Å; D329-R333 PolarHBondContact O-N 3.5Å; Y331-R333 VanDerWaalsContact C-N 3.29Å; Y331-R333 PolarHBondContact O-N 3.02Å; R333-R337 WeakPolarHBondContact O-CG 3.27Å; R333-R337 PolarHBondContact O-N 3.42Å; R333-T457 PolarHBondContact NH1-OG1 3.3Å
334	Y	96.8	Very high	95.5	Very high	3 Å²	3	28 Å²	28	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-47.5	174.6	160.1	-101.6	0	0	0	110.5	I191 L266 T267 W272 C330 Y331 D332 C336 R337 V338	I191-Y334 HydrophobicContact CG1-CD2 4.23Å; I191-Y334 HydrophobicContact CG1-CE2 4.35Å; I191-Y334 HydrophobicContact CG2-CD2 4.22Å; I191-Y334 HydrophobicContact CG2-CE2 3.73Å; L266-Y334 WeakPolarHBondContact CB-OH 3.46Å; L266-Y334 HydrophobicContact CD1-CE2 4.2Å; T267-Y334 WeakPolarHBondContact OG1-CE1 3.45Å; T267-Y334 PolarHBondContact OG1-OH 3.2Å; T267-Y334 VanDerWaalsContact OG1-OH 3.13Å; W272-Y334 HydrophobicContact CZ2-CD2 4.03Å; W272-Y334 HydrophobicContact CZ2-CE2 4.34Å; W272-Y334 HydrophobicContact CZ2-CG 4.27Å; W272-Y334 AromaticContact NE1-CD1 3.59Å; W272-Y334 AromaticContact NE1-CE1 3.66Å; W272-Y334 AromaticContact NE1-CG 3.92Å; C330-Y334 PolarHBondContact O-N 3.28Å; C330-Y334 VanDerWaalsContact O-N 3.09Å; Y331-Y334 HydrophobicContact CD2-CD1 4.33Å; Y331-Y334 HydrophobicContact CE2-CD1 4.32Å; Y331-Y334 WeakPolarHBondContact O-CA 3.43Å; Y331-Y334 WeakPolarHBondContact O-CB 3.44Å; Y331-Y334 PolarHBondContact O-N 3.38Å; D332-Y334 VanDerWaalsContact C-N 3.31Å; D332-Y334 PolarHBondContact O-N 3.29Å; Y334-C336 PolarHBondContact O-N 2.89Å; Y334-R337 PolarHBondContact O-N 2.64Å; Y334-R337 VanDerWaalsContact O-N 3.15Å; Y334-V338 HydrophobicContact CD2-CG2 4.27Å; Y334-V338 HydrophobicContact CE1-CG2 4.33Å; Y334-V338 HydrophobicContact CE2-CG2 3.72Å; Y334-V338 WeakPolarHBondContact O-CG2 3.49Å; Y334-V338 PolarHBondContact O-N 3.16Å; Y334-V338 VanDerWaalsContact O-N 3.08Å
335	L	96.5	Very high	95.6	Very high	42 Å²	42	24.9 Å²	24.9	22%	0.22	13%	0.129	C	C	.	.	H	α-helix	trans	-60.5	-44.2	176.2	-67.5	-180	0	0	0	112	T267 Y331 D332 R337 V338 E339	T267-L335 HydrophobicContact CG2-CD2 3.88Å; Y331-L335 HydrophobicContact CD1-CD1 3.98Å; Y331-L335 HydrophobicContact CD1-CG 4.41Å; Y331-L335 HydrophobicContact CE1-CD1 3.55Å; Y331-L335 HydrophobicContact CE1-CG 4.11Å; Y331-L335 PolarHBondContact O-N 3.06Å; D332-L335 PolarHBondContact O-N 3.04Å; L335-R337 VanDerWaalsContact C-N 3.26Å; L335-R337 PolarHBondContact O-N 2.91Å; L335-V338 PolarHBondContact O-N 3.29Å; L335-V338 VanDerWaalsContact O-N 3.12Å; L335-E339 PolarHBondContact O-N 3.24Å
336	C	96.4	Very high	95.8	Very high	4 Å²	4	28.8 Å²	28.8	3%	0.027	14%	0.14	C	C	.	.	H	α-helix	trans	-55.6	-40.8	175	-72.1	0	0	0	0	112.2	V295 P323 D332 Y334 E340	V295-C336 HydrophobicContact CG1-CB 4.08Å; P323-C336 HydrophobicContact CB-CB 4.45Å; P323-C336 HydrophobicContact CG-CB 4.23Å; P323-C336 WeakPolarHBondContact CG-O 3.46Å; D332-C336 PolarHBondContact O-N 3Å; D332-C336 PolarHBondContact O-SG 3.19Å; Y334-C336 PolarHBondContact O-N 2.89Å; C336-E340 VanDerWaalsContact O-CB 3.32Å; C336-E340 WeakPolarHBondContact O-CB 3.45Å; C336-E340 VanDerWaalsContact O-CG 3.3Å; C336-E340 WeakPolarHBondContact O-CG 3.42Å; C336-E340 PolarHBondContact O-N 3.49Å
337	R	96.9	Very high	96	Very high	11 Å²	11	24.9 Å²	24.9	4%	0.042	11%	0.113	C	C	.	.	H	α-helix	trans	-68.4	-39.7	177.3	-71.4	-178.7	176.5	100.7	-3.4	112.6	I191 V295 R333 Y334 L335 E340 M341 T457	I191-R337 HydrophobicContact CD1-CB 3.92Å; I191-R337 HydrophobicContact CG1-CB 4.17Å; V295-R337 HydrophobicContact CG1-CG 4.08Å; V295-R337 HydrophobicContact CG2-CG 4.14Å; R333-R337 WeakPolarHBondContact O-CG 3.27Å; R333-R337 PolarHBondContact O-N 3.42Å; Y334-R337 PolarHBondContact O-N 2.64Å; Y334-R337 VanDerWaalsContact O-N 3.15Å; L335-R337 VanDerWaalsContact C-N 3.26Å; L335-R337 PolarHBondContact O-N 2.91Å; R337-E340 PolarHBondContact O-N 3.02Å; R337-M341 WeakPolarHBondContact O-CG 3.42Å; R337-M341 PolarHBondContact O-N 3.43Å; R337-T457 VanDerWaalsContact CZ-O 3.24Å; R337-T457 PolarHBondContact NH1-O 3.13Å; R337-T457 PolarHBondContact NH2-O 3.27Å
338	V	96.6	Very high	96.2	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.024	9%	0.089	C	C	.	.	H	α-helix	trans	-63.9	-45.3	176.5	175.6	0	0	0	0	110.6	I191 I259 Y334 L335 M341 R342	I191-V338 HydrophobicContact CD1-CG2 3.8Å; I259-V338 HydrophobicContact CG2-CG1 4.04Å; Y334-V338 HydrophobicContact CD2-CG2 4.27Å; Y334-V338 HydrophobicContact CE1-CG2 4.33Å; Y334-V338 HydrophobicContact CE2-CG2 3.72Å; Y334-V338 WeakPolarHBondContact O-CG2 3.49Å; Y334-V338 PolarHBondContact O-N 3.16Å; Y334-V338 VanDerWaalsContact O-N 3.08Å; L335-V338 PolarHBondContact O-N 3.29Å; L335-V338 VanDerWaalsContact O-N 3.12Å; V338-M341 HydrophobicContact CG2-CE 4.37Å; V338-M341 WeakPolarHBondContact O-CB 3.26Å; V338-M341 PolarHBondContact O-N 2.88Å; V338-R342 PolarHBondContact O-N 2.99Å
339	E	96.9	Very high	96.4	Very high	90 Å²	90	23.4 Å²	23.4	42%	0.421	11%	0.105	S	C	.	.	H	α-helix	trans	-67	-37.5	176.2	-69.8	-173.7	175.4	0	0	112.1	P323 L335 M341 R342 Q343	P323-E339 HydrophobicContact CB-CB 3.79Å; P323-E339 WeakPolarHBondContact CB-OE2 3.44Å; P323-E339 HydrophobicContact CG-CB 4.05Å; L335-E339 PolarHBondContact O-N 3.24Å; E339-M341 VanDerWaalsContact C-N 3.32Å; E339-M341 PolarHBondContact O-N 3.24Å; E339-R342 WeakPolarHBondContact O-CB 3.18Å; E339-R342 PolarHBondContact O-N 2.72Å; E339-R342 VanDerWaalsContact O-N 3.12Å; E339-Q343 WeakPolarHBondContact O-CG 3.41Å; E339-Q343 PolarHBondContact O-N 3.38Å
340	E	96.8	Very high	96.4	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	11%	0.112	C	C	.	.	H	α-helix	trans	-59.8	-39.4	172.8	-83.1	177.1	-145.2	0	0	112	R183 H187 R298 P323 C336 R337 R342 Q343 S344	R183-E340 IonicContact NH1-OE2 3.78Å; H187-E340 IonicContact CE1-OE2 3.58Å; H187-E340 PolarHBondContact CE1-OE2 2.66Å; H187-E340 IonicContact NE2-OE2 2.73Å; H187-E340 PolarHBondContact NE2-OE2 3.38Å; H187-E340 VanDerWaalsContact NE2-OE2 3.11Å; R298-E340 IonicContact CZ-OE1 3.93Å; R298-E340 IonicContact NE-OE1 3.32Å; R298-E340 PolarHBondContact NE-OE1 2.95Å; R298-E340 VanDerWaalsContact NH2-CD 3.3Å; R298-E340 IonicContact NH2-OE1 3.41Å; R298-E340 PolarHBondContact NH2-OE1 2.74Å; R298-E340 IonicContact NH2-OE2 3.88Å; R298-E340 PolarHBondContact NH2-OE2 3.22Å; R298-E340 VanDerWaalsContact NH2-OE2 3.15Å; P323-E340 HydrophobicContact CG-CG 3.71Å; C336-E340 VanDerWaalsContact O-CB 3.32Å; C336-E340 WeakPolarHBondContact O-CB 3.45Å; C336-E340 VanDerWaalsContact O-CG 3.3Å; C336-E340 WeakPolarHBondContact O-CG 3.42Å; C336-E340 PolarHBondContact O-N 3.49Å; R337-E340 PolarHBondContact O-N 3.02Å; E340-R342 VanDerWaalsContact C-N 3.33Å; E340-R342 PolarHBondContact O-N 3.41Å; E340-Q343 PolarHBondContact O-N 3.42Å; E340-S344 WeakPolarHBondContact O-CB 3.33Å; E340-S344 PolarHBondContact O-N 2.76Å; E340-S344 PolarHBondContact O-OG 3.33Å; E340-S344 VanDerWaalsContact O-OG 3.11Å
341	M	96.4	Very high	96.4	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.015	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-40.2	173.6	-69.4	-170	-62.3	0	0	112.3	H187 I188 I191 I259 R337 V338 E339 S344 L345	H187-M341 HydrophobicContact CB-CG 3.57Å; H187-M341 HydrophobicContact CB-SD 3.89Å; I188-M341 HydrophobicContact CG1-SD 4.06Å; I191-M341 HydrophobicContact CD1-CE 3.51Å; I191-M341 HydrophobicContact CD1-SD 4.28Å; I259-M341 HydrophobicContact CD1-CB 4.04Å; I259-M341 HydrophobicContact CG2-CE 4.46Å; R337-M341 WeakPolarHBondContact O-CG 3.42Å; R337-M341 PolarHBondContact O-N 3.43Å; V338-M341 HydrophobicContact CG2-CE 4.37Å; V338-M341 WeakPolarHBondContact O-CB 3.26Å; V338-M341 PolarHBondContact O-N 2.88Å; E339-M341 VanDerWaalsContact C-N 3.32Å; E339-M341 PolarHBondContact O-N 3.24Å; M341-S344 PolarHBondContact O-N 2.62Å; M341-L345 PolarHBondContact O-N 2.73Å
342	R	96.7	Very high	96.3	Very high	82 Å²	82	24.4 Å²	24.4	31%	0.309	11%	0.111	S	C	.	.	H	α-helix	trans	-65.6	-39	175.9	-69.4	-176	166.8	135.9	-1.4	111.9	I259 D260 E263 V338 E339 E340 L345 R346	I259-R342 HydrophobicContact CD1-CG 4.36Å; I259-R342 HydrophobicContact CG2-CG 4.44Å; D260-R342 IonicContact OD1-CZ 3.42Å; D260-R342 IonicContact OD1-NE 2.66Å; D260-R342 IonicContact OD1-NH2 3.28Å; D260-R342 PolarHBondContact OD1-NH2 2.93Å; E263-R342 IonicContact OE2-CZ 2.9Å; E263-R342 IonicContact OE2-NH1 2.99Å; E263-R342 PolarHBondContact OE2-NH1 3.36Å; E263-R342 IonicContact OE2-NH2 3.76Å; E263-R342 PolarHBondContact OE2-NH2 3.02Å; V338-R342 PolarHBondContact O-N 2.99Å; E339-R342 WeakPolarHBondContact O-CB 3.18Å; E339-R342 PolarHBondContact O-N 2.72Å; E339-R342 VanDerWaalsContact O-N 3.12Å; E340-R342 VanDerWaalsContact C-N 3.33Å; E340-R342 PolarHBondContact O-N 3.41Å; R342-L345 WeakPolarHBondContact O-CB 3.39Å; R342-L345 PolarHBondContact O-N 3.22Å; R342-R346 PolarHBondContact O-N 3.14Å; R342-R346 VanDerWaalsContact O-N 3.1Å
343	Q	96.5	Very high	96.2	Very high	38 Å²	38	30.3 Å²	30.3	18%	0.178	14%	0.142	C	C	.	.	H	α-helix	trans	-71.4	-37.5	177.2	-62.8	-67.4	-17	0	0	111.6	F320 D321 E339 E340 L345 R346 I347	F320-Q343 HydrophobicContact CB-CB 4.49Å; D321-Q343 VanDerWaalsContact N-OE1 3.13Å; D321-Q343 VanDerWaalsContact O-CG 3.29Å; D321-Q343 WeakPolarHBondContact O-CG 3.5Å; E339-Q343 WeakPolarHBondContact O-CG 3.41Å; E339-Q343 PolarHBondContact O-N 3.38Å; E340-Q343 PolarHBondContact O-N 3.42Å; Q343-L345 VanDerWaalsContact C-N 3.34Å; Q343-L345 PolarHBondContact O-N 3.31Å; Q343-R346 WeakPolarHBondContact O-CB 3.26Å; Q343-R346 PolarHBondContact O-N 2.83Å; Q343-R346 VanDerWaalsContact O-N 3.14Å; Q343-I347 WeakPolarHBondContact O-CG1 3.26Å; Q343-I347 PolarHBondContact O-N 2.75Å
344	S	97	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-44.4	170.8	-67.5	0	0	0	0	111.9	E180 R183 E340 M341 R346 I347 I348	E180-S344 WeakPolarHBondContact OE2-CA 3.4Å; E180-S344 VanDerWaalsContact OE2-CB 3.24Å; E180-S344 WeakPolarHBondContact OE2-CB 3.42Å; E180-S344 PolarHBondContact OE2-OG 3.39Å; R183-S344 WeakPolarHBondContact CD-OG 3.37Å; E340-S344 WeakPolarHBondContact O-CB 3.33Å; E340-S344 PolarHBondContact O-N 2.76Å; E340-S344 PolarHBondContact O-OG 3.33Å; E340-S344 VanDerWaalsContact O-OG 3.11Å; M341-S344 PolarHBondContact O-N 2.62Å; S344-R346 VanDerWaalsContact C-N 3.31Å; S344-R346 PolarHBondContact O-N 3.37Å; S344-I347 PolarHBondContact O-N 3.09Å; S344-I348 VanDerWaalsContact O-CG1 3.29Å; S344-I348 WeakPolarHBondContact O-CG1 3.49Å; S344-I348 PolarHBondContact O-N 3.27Å
345	L	96	Very high	95.9	Very high	11 Å²	11	36.2 Å²	36.2	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-57	-44.4	173.3	-85.6	-178	0	0	0	112.1	I184 W251 F255 I259 M341 R342 Q343 I347 I348 L349	I184-L345 HydrophobicContact CD1-CD2 4.12Å; I184-L345 HydrophobicContact CD1-CG 4.18Å; W251-L345 HydrophobicContact CH2-CD2 4.42Å; W251-L345 HydrophobicContact CZ3-CD2 4.15Å; F255-L345 HydrophobicContact CB-CD2 4.42Å; F255-L345 HydrophobicContact CD1-CD1 3.7Å; F255-L345 HydrophobicContact CD1-CD2 3.74Å; F255-L345 HydrophobicContact CD1-CG 3.82Å; F255-L345 HydrophobicContact CE1-CD1 4.4Å; F255-L345 HydrophobicContact CE1-CG 4.4Å; I259-L345 HydrophobicContact CD1-CD1 3.72Å; M341-L345 PolarHBondContact O-N 2.73Å; R342-L345 WeakPolarHBondContact O-CB 3.39Å; R342-L345 PolarHBondContact O-N 3.22Å; Q343-L345 VanDerWaalsContact C-N 3.34Å; Q343-L345 PolarHBondContact O-N 3.31Å; L345-I347 VanDerWaalsContact C-N 3.33Å; L345-I347 PolarHBondContact O-N 3.25Å; L345-I348 PolarHBondContact O-N 3.36Å; L345-L349 WeakPolarHBondContact O-CG 3.44Å; L345-L349 PolarHBondContact O-N 3.47Å
346	R	96.9	Very high	95.8	Very high	93 Å²	93	36 Å²	36	35%	0.351	17%	0.17	S	C	.	.	H	α-helix	trans	-60.8	-41.8	176.5	-175.6	177.7	178.9	-176.5	-3	111.7	E319 D321 R342 Q343 S344 Q350	E319-R346 PolarHBondContact O-NE 2.74Å; D321-R346 IonicContact OD2-NH1 2.67Å; D321-R346 PolarHBondContact OD2-NH1 3.09Å; R342-R346 PolarHBondContact O-N 3.14Å; R342-R346 VanDerWaalsContact O-N 3.1Å; Q343-R346 WeakPolarHBondContact O-CB 3.26Å; Q343-R346 PolarHBondContact O-N 2.83Å; Q343-R346 VanDerWaalsContact O-N 3.14Å; S344-R346 VanDerWaalsContact C-N 3.31Å; S344-R346 PolarHBondContact O-N 3.37Å; R346-Q350 WeakPolarHBondContact O-CG 3.48Å; R346-Q350 PolarHBondContact O-N 3.01Å; R346-Q350 VanDerWaalsContact O-N 3.14Å
347	I	96.7	Very high	95.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-43.5	176.8	-62.3	163.1	0	0	0	110.7	V176 E180 V318 F320 Q343 S344 L345 L349 Q350 A351	V176-I347 HydrophobicContact CG1-CG2 3.99Å; E180-I347 HydrophobicContact CG-CB 4.01Å; E180-I347 HydrophobicContact CG-CD1 4.03Å; E180-I347 HydrophobicContact CG-CG2 3.73Å; V318-I347 HydrophobicContact CB-CG2 4.32Å; V318-I347 HydrophobicContact CG1-CG2 4.21Å; V318-I347 HydrophobicContact CG2-CG2 4.24Å; F320-I347 HydrophobicContact CB-CD1 3.94Å; F320-I347 HydrophobicContact CB-CG1 3.83Å; F320-I347 HydrophobicContact CD1-CD1 3.87Å; F320-I347 HydrophobicContact CD1-CG1 4.11Å; F320-I347 HydrophobicContact CD2-CD1 4.25Å; F320-I347 HydrophobicContact CE1-CD1 4.43Å; F320-I347 HydrophobicContact CG-CD1 3.76Å; F320-I347 HydrophobicContact CG-CG1 4.1Å; Q343-I347 WeakPolarHBondContact O-CG1 3.26Å; Q343-I347 PolarHBondContact O-N 2.75Å; S344-I347 PolarHBondContact O-N 3.09Å; L345-I347 VanDerWaalsContact C-N 3.33Å; L345-I347 PolarHBondContact O-N 3.25Å; I347-L349 PolarHBondContact O-N 3.43Å; I347-Q350 PolarHBondContact O-N 3.15Å; I347-A351 WeakPolarHBondContact O-CB 2.87Å; I347-A351 PolarHBondContact O-N 3.35Å
348	I	96.2	Very high	95.3	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-47.3	178.5	-69.6	164.1	0	0	0	110.6	E180 L181 I184 I248 W251 S344 L345 Q350 A351 L352	E180-I348 HydrophobicContact CB-CD1 4.29Å; E180-I348 HydrophobicContact CB-CG1 3.93Å; L181-I348 HydrophobicContact CD2-CD1 3.8Å; L181-I348 HydrophobicContact CG-CD1 4.11Å; I184-I348 HydrophobicContact CD1-CD1 3.57Å; I248-I348 HydrophobicContact CG2-CG2 3.89Å; W251-I348 HydrophobicContact CZ3-CD1 4.37Å; S344-I348 VanDerWaalsContact O-CG1 3.29Å; S344-I348 WeakPolarHBondContact O-CG1 3.49Å; S344-I348 PolarHBondContact O-N 3.27Å; L345-I348 PolarHBondContact O-N 3.36Å; I348-Q350 VanDerWaalsContact C-N 3.32Å; I348-Q350 PolarHBondContact O-N 3.47Å; I348-A351 PolarHBondContact O-N 3.17Å; I348-L352 HydrophobicContact CG2-CD1 4.16Å; I348-L352 HydrophobicContact CG2-CG 4.49Å; I348-L352 WeakPolarHBondContact O-CG 3.37Å; I348-L352 PolarHBondContact O-N 3.08Å
349	L	95.6	Very high	95.2	Very high	63 Å²	63	50.3 Å²	50.3	33%	0.33	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-39.2	177.9	-69.3	174.4	0	0	0	112.4	Y249 L345 I347 N353	Y249-L349 HydrophobicContact CD2-CD2 3.78Å; Y249-L349 HydrophobicContact CE2-CD2 3.97Å; L345-L349 WeakPolarHBondContact O-CG 3.44Å; L345-L349 PolarHBondContact O-N 3.47Å; I347-L349 PolarHBondContact O-N 3.43Å; L349-N353 PolarHBondContact O-N 3.19Å; L349-N353 PolarHBondContact O-ND2 3.06Å
350	Q	95.3	Very high	95	Very high	32 Å²	32	47.6 Å²	47.6	15%	0.15	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-40.4	175.2	-70.8	174.7	24.3	0	0	112.2	E319 R346 I347 I348 L352 N353 K354	E319-Q350 PolarHBondContact O-NE2 3.06Å; R346-Q350 WeakPolarHBondContact O-CG 3.48Å; R346-Q350 PolarHBondContact O-N 3.01Å; R346-Q350 VanDerWaalsContact O-N 3.14Å; I347-Q350 PolarHBondContact O-N 3.15Å; I348-Q350 VanDerWaalsContact C-N 3.32Å; I348-Q350 PolarHBondContact O-N 3.47Å; Q350-L352 VanDerWaalsContact C-N 3.35Å; Q350-N353 PolarHBondContact O-N 3.45Å; Q350-K354 WeakPolarHBondContact O-CB 3.23Å; Q350-K354 WeakPolarHBondContact O-CG 3.49Å; Q350-K354 PolarHBondContact O-N 3.3Å
351	A	94.9	Very high	94.9	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-38.6	178.5	0	0	0	0	0	111.8	W173 L177 I347 I348 M355	W173-A351 HydrophobicContact CE3-CB 4.01Å; W173-A351 HydrophobicContact CZ3-CB 4.17Å; L177-A351 HydrophobicContact CB-CB 4.36Å; I347-A351 WeakPolarHBondContact O-CB 2.87Å; I347-A351 PolarHBondContact O-N 3.35Å; I348-A351 PolarHBondContact O-N 3.17Å; A351-M355 WeakPolarHBondContact O-CB 3.39Å; A351-M355 PolarHBondContact O-N 2.66Å; A351-M355 VanDerWaalsContact O-N 3.17Å
352	L	94.6	Very high	94.8	Very high	18 Å²	18	51 Å²	51	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-43.6	173.3	-70.5	172.4	0	0	0	111.9	L177 M245 I248 Y249 I348 Q350 M355	L177-L352 HydrophobicContact CD1-CD2 3.72Å; L177-L352 HydrophobicContact CD1-CG 4.17Å; M245-L352 HydrophobicContact CB-CD2 3.99Å; M245-L352 HydrophobicContact CE-CD2 4.06Å; M245-L352 HydrophobicContact CG-CD2 4.12Å; I248-L352 HydrophobicContact CG2-CD1 4.13Å; Y249-L352 HydrophobicContact CD2-CD1 4.49Å; I348-L352 HydrophobicContact CG2-CD1 4.16Å; I348-L352 HydrophobicContact CG2-CG 4.49Å; I348-L352 WeakPolarHBondContact O-CG 3.37Å; I348-L352 PolarHBondContact O-N 3.08Å; Q350-L352 VanDerWaalsContact C-N 3.35Å; L352-M355 HydrophobicContact CD2-CE 4.05Å
353	N	95.4	Very high	94.6	Very high	138 Å²	138	54.3 Å²	54.3	74%	0.738	28%	0.277	S	S	*	.	H	α-helix	trans	-72.3	-31	-179.8	-70.8	-28	0	0	0	113.7	L349 Q350	L349-N353 PolarHBondContact O-N 3.19Å; L349-N353 PolarHBondContact O-ND2 3.06Å; Q350-N353 PolarHBondContact O-N 3.45Å
354	K	94.1	Very high	94.3	Very high	100 Å²	100	55.4 Å²	55.4	44%	0.435	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	7.6	-175.7	-67	-177.7	179.8	-176.5	0	113.6	W173 E317 Q350 P356	W173-K354 HydrophobicContact CH2-CB 3.9Å; W173-K354 HydrophobicContact CH2-CD 3.84Å; W173-K354 HydrophobicContact CZ2-CB 4.06Å; W173-K354 HydrophobicContact CZ2-CD 4.36Å; W173-K354 HydrophobicContact CZ3-CB 4.27Å; E317-K354 PolarHBondContact O-NZ 3.46Å; Q350-K354 WeakPolarHBondContact O-CB 3.23Å; Q350-K354 WeakPolarHBondContact O-CG 3.49Å; Q350-K354 PolarHBondContact O-N 3.3Å; K354-P356 VanDerWaalsContact O-CD 3.23Å; K354-P356 WeakPolarHBondContact O-CD 3.46Å
355	M	92	Very high	94.1	Very high	27 Å²	27	57 Å²	57	13%	0.133	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-67.6	116.9	-171.5	-150.5	174.3	-70.6	0	0	111.3	L177 L240 M245 A351 L352	L177-M355 HydrophobicContact CD1-CE 3.46Å; L177-M355 VanDerWaalsContact CD1-CE 3.46Å; L240-M355 HydrophobicContact CD1-CE 4.38Å; L240-M355 HydrophobicContact CD1-SD 3.83Å; M245-M355 HydrophobicContact CE-CB 3.9Å; M245-M355 HydrophobicContact CE-CE 3.65Å; M245-M355 HydrophobicContact CE-CG 4.33Å; M245-M355 HydrophobicContact CE-SD 3.52Å; M245-M355 VanDerWaalsContact CE-SD 3.52Å; M245-M355 HydrophobicContact CG-CE 4.46Å; M245-M355 HydrophobicContact CG-SD 4.39Å; M245-M355 HydrophobicContact SD-CE 4.21Å; M245-M355 HydrophobicContact SD-SD 3.58Å; A351-M355 WeakPolarHBondContact O-CB 3.39Å; A351-M355 PolarHBondContact O-N 2.66Å; A351-M355 VanDerWaalsContact O-N 3.17Å; L352-M355 HydrophobicContact CD2-CE 4.05Å
356	P	93.8	Very high	93.9	Very high	39 Å²	39	63 Å²	63	25%	0.253	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-80.6	151.7	-180	32.4	-33.8	0	0	0	111.4	P169 R170 W173 K354	P169-P356 HydrophobicContact CB-CG 4.43Å; R170-P356 HydrophobicContact CB-CG 4.39Å; R170-P356 WeakPolarHBondContact CG-O 3.47Å; R170-P356 PolarHBondContact NH1-O 3.01Å; W173-P356 HydrophobicContact CG-CG 4.39Å; K354-P356 VanDerWaalsContact O-CD 3.23Å; K354-P356 WeakPolarHBondContact O-CD 3.46Å
357	E	92.1	Very high	93.6	Very high	184 Å²	184	59.2 Å²	59.2	86%	0.86	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-70.8	151.9	161.1	-62.2	-175.6	175.6	0	0	109.9
358	G	91.8	Very high	93.4	Very high	46 Å²	46	59.5 Å²	59.5	47%	0.474	31%	0.313	S	S	.	.	S	Bend	trans	151.6	-170.5	176.7	0	0	0	0	0	113.9	R170	R170-G358 WeakPolarHBondContact CD-O 3.1Å
359	E	93	Very high	93.3	Very high	89 Å²	89	60.7 Å²	60.7	42%	0.416	32%	0.321	S	S	.	.			trans	-82.8	152.5	178.5	-57.5	-151.5	124.6	0	0	112.5	P168 K371	P168-E359 WeakPolarHBondContact CB-O 3.38Å; P168-E359 WeakPolarHBondContact CG-O 3.34Å; E359-K371 IonicContact OE1-NZ 3.23Å; E359-K371 PolarHBondContact OE1-NZ 3.4Å
360	I	94.1	Very high	93.2	Very high	32 Å²	32	58.6 Å²	58.6	16%	0.164	31%	0.311	C	S	.	.	S	Bend	trans	-100.2	-15.5	-174.4	-47.9	103.2	0	0	0	111.8	A171 I174 V236 D239	A171-I360 VanDerWaalsContact CB-O 3.23Å; A171-I360 WeakPolarHBondContact CB-O 3.39Å; I174-I360 HydrophobicContact CD1-CG2 4.32Å; V236-I360 HydrophobicContact CB-CG2 3.5Å; V236-I360 VanDerWaalsContact CB-CG2 3.5Å; V236-I360 HydrophobicContact CG1-CG2 3.84Å; V236-I360 PolarHBondContact N-O 2.75Å; D239-I360 HydrophobicContact CB-CD1 3.47Å; D239-I360 VanDerWaalsContact CB-CD1 3.47Å; D239-I360 HydrophobicContact CB-CG1 3.77Å
361	K	94.1	Very high	93.1	Very high	53 Å²	53	62 Å²	62	23%	0.23	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-122.9	154.9	179.6	-66.3	176.8	-174	169.7	0	109.4	G234 V236 H237 A368	G234-K361 WeakPolarHBondContact O-CA 3.28Å; V236-K361 WeakPolarHBondContact O-CE 3.17Å; V236-K361 VanDerWaalsContact O-CG 3.27Å; V236-K361 WeakPolarHBondContact O-CG 3.33Å; H237-K361 WeakPolarHBondContact O-CE 3.26Å; H237-K361 PolarHBondContact O-NZ 2.86Å; H237-K361 VanDerWaalsContact O-NZ 3.1Å; K361-A368 HydrophobicContact CB-CB 3.98Å; K361-A368 HydrophobicContact CD-CB 4.27Å; K361-A368 HydrophobicContact CG-CB 4.49Å
362	V	94.4	Very high	92.9	Very high	25 Å²	25	71.1 Å²	71.1	15%	0.152	36%	0.36	C	S	.	.			trans	-61.3	141	169.8	177.8	0	0	0	0	109.5	I165 Q166 G234 D364	I165-V362 HydrophobicContact CG2-CB 4.12Å; I165-V362 HydrophobicContact CG2-CG1 3.58Å; I165-V362 HydrophobicContact CG2-CG2 3.53Å; Q166-V362 WeakPolarHBondContact O-CG2 3.46Å; G234-V362 WeakPolarHBondContact O-CG2 3.43Å; G234-V362 PolarHBondContact O-N 2.9Å; V362-D364 HydrophobicContact CG1-CB 4.04Å; V362-D364 PolarHBondContact O-N 2.83Å
363	D	91.3	Very high	92.9	Very high	150 Å²	150	74.1 Å²	74.1	80%	0.802	38%	0.382	S	S	*	.	S	Bend	trans	-71.6	13.7	179.5	-162.3	17.4	0	0	0	113.8
364	D	91.8	Very high	92.8	Very high	61 Å²	61	71.6 Å²	71.6	33%	0.326	37%	0.366	S	S	.	.			trans	-102.1	101.9	175	-171.7	-1.7	0	0	0	110.3	V362 K366 V367 A368	V362-D364 HydrophobicContact CG1-CB 4.04Å; V362-D364 PolarHBondContact O-N 2.83Å; D364-K366 PolarHBondContact O-N 3.26Å; D364-K366 VanDerWaalsContact OD1-CB 3.27Å; D364-K366 WeakPolarHBondContact OD1-CB 3.43Å; D364-K366 WeakPolarHBondContact OD1-CG 3.31Å; D364-K366 PolarHBondContact OD1-N 2.9Å; D364-V367 PolarHBondContact O-N 3.41Å; D364-A368 PolarHBondContact O-N 3.45Å
365	A	91.4	Very high	92.7	Very high	33 Å²	33	67.8 Å²	67.8	27%	0.273	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-8.1	177.7	0	0	0	0	0	114	A368 H384 L388	A365-A368 CarbonylContact C-O 3.5Å; A365-A368 WeakPolarHBondContact CA-O 3.27Å; A365-H384 HydrophobicContact CB-CB 4.45Å; A365-L388 WeakPolarHBondContact O-CD1 3.35Å
366	K	91.8	Very high	92.8	Very high	139 Å²	139	74.2 Å²	74.2	60%	0.604	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-15.8	172.6	-63.2	177	-178.4	173.9	0	113.4	D364 L388	D364-K366 PolarHBondContact O-N 3.26Å; D364-K366 VanDerWaalsContact OD1-CB 3.27Å; D364-K366 WeakPolarHBondContact OD1-CB 3.43Å; D364-K366 WeakPolarHBondContact OD1-CG 3.31Å; D364-K366 PolarHBondContact OD1-N 2.9Å; K366-L388 VanDerWaalsContact O-CD2 3.28Å; K366-L388 WeakPolarHBondContact O-CD2 3.42Å
367	V	91.5	Very high	92.8	Very high	12 Å²	12	80.6 Å²	80.6	7%	0.073	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-52	178.7	178.4	0	0	0	0	110.2	L163 I165 D364	L163-V367 HydrophobicContact CD1-CG1 3.89Å; L163-V367 HydrophobicContact CD1-CG2 4.34Å; I165-V367 HydrophobicContact CD1-CB 4.19Å; I165-V367 HydrophobicContact CD1-CG1 4.29Å; I165-V367 HydrophobicContact CD1-CG2 3.55Å; D364-V367 PolarHBondContact O-N 3.41Å
368	A	92.6	Very high	93	Very high	7 Å²	7	73.4 Å²	73.4	6%	0.058	38%	0.376	C	S	.	.	S	Bend	trans	-91	137.2	178	0	0	0	0	0	110.8	K361 D364 A365	K361-A368 HydrophobicContact CB-CB 3.98Å; K361-A368 HydrophobicContact CD-CB 4.27Å; K361-A368 HydrophobicContact CG-CB 4.49Å; D364-A368 PolarHBondContact O-N 3.45Å; A365-A368 CarbonylContact C-O 3.5Å; A365-A368 WeakPolarHBondContact CA-O 3.27Å
369	P	93.4	Very high	93.1	Very high	26 Å²	26	77.5 Å²	77.5	17%	0.169	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-70.1	138	176	27.9	-32.8	0	0	0	110.7	L388 Y389	P369-L388 HydrophobicContact CB-CD1 4.3Å; P369-Y389 HydrophobicContact CB-CE2 4.06Å
370	P	93.3	Very high	93.2	Very high	19 Å²	19	79.2 Å²	79.2	12%	0.123	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-65.7	164.7	-179.6	26.5	-33.8	0	0	0	112.3	M375 S381 H385	P370-M375 HydrophobicContact CG-CB 4.47Å; P370-S381 WeakPolarHBondContact CG-O 3.26Å; P370-H385 HydrophobicContact CG-CB 4.31Å
371	K	93.2	Very high	93.1	Very high	105 Å²	105	78.5 Å²	78.5	46%	0.457	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.7	148.8	177.1	-66.4	171.3	-171.3	153.9	0	109.9	E359 S373 E374 M375	E359-K371 IonicContact OE1-NZ 3.23Å; E359-K371 PolarHBondContact OE1-NZ 3.4Å; K371-S373 PolarHBondContact O-N 3.34Å; K371-E374 PolarHBondContact O-N 3.26Å; K371-M375 WeakPolarHBondContact O-CB 3.43Å; K371-M375 PolarHBondContact O-N 3.21Å
372	R	92.1	Very high	93.2	Very high	191 Å²	191	79.9 Å²	79.9	72%	0.721	40%	0.4	S	S	*	.	H	α-helix	trans	-65.1	-27.3	-177.4	-62.7	-168.6	90.5	116.3	2.1	113.2	M375 K376	R372-M375 HydrophobicContact CB-CE 4.46Å; R372-M375 HydrophobicContact CG-CE 4.46Å; R372-K376 WeakPolarHBondContact O-CG 3.39Å
373	S	93.6	Very high	93.3	Very high	80 Å²	80	82.2 Å²	82.2	56%	0.559	41%	0.41	S	S	*	.	H	α-helix	trans	-64.7	-52.2	173.6	44.4	0	0	0	0	110.9	K371 K376 M377	K371-S373 PolarHBondContact O-N 3.34Å; S373-K376 PolarHBondContact O-N 3.39Å; S373-M377 WeakPolarHBondContact O-CG 3.31Å
374	E	92.5	Very high	93.4	Very high	85 Å²	85	77.6 Å²	77.6	40%	0.397	38%	0.384	S	S	.	.	H	α-helix	trans	-64.9	-42.5	179.8	-71.1	159.2	-166.2	0	0	112	K371 K376 M377 S378	K371-E374 PolarHBondContact O-N 3.26Å; E374-K376 PolarHBondContact O-N 3.16Å; E374-K376 VanDerWaalsContact O-N 3.16Å; E374-M377 PolarHBondContact O-N 3.17Å; E374-S378 PolarHBondContact O-N 3.41Å
375	M	92.8	Very high	93.6	Very high	20 Å²	20	77.1 Å²	77.1	10%	0.099	38%	0.379	C	S	.	.	H	α-helix	trans	-57.6	-29.7	177.5	175.5	-96.2	-70.9	0	0	113.7	P370 K371 R372 L382 H385	P370-M375 HydrophobicContact CG-CB 4.47Å; K371-M375 WeakPolarHBondContact O-CB 3.43Å; K371-M375 PolarHBondContact O-N 3.21Å; R372-M375 HydrophobicContact CB-CE 4.46Å; R372-M375 HydrophobicContact CG-CE 4.46Å; M375-L382 HydrophobicContact CG-CD1 4.06Å; M375-L382 HydrophobicContact SD-CD1 3.97Å; M375-H385 HydrophobicContact CG-CB 3.97Å
376	K	94	Very high	93.9	Very high	163 Å²	163	82.1 Å²	82.1	71%	0.709	40%	0.395	S	S	*	.	H	α-helix	trans	-84	-18.1	177.7	-70.7	177.6	179.4	-175.6	0	113.6	R372 S373 E374	R372-K376 WeakPolarHBondContact O-CG 3.39Å; S373-K376 PolarHBondContact O-N 3.39Å; E374-K376 PolarHBondContact O-N 3.16Å; E374-K376 VanDerWaalsContact O-N 3.16Å
377	M	94.2	Very high	94.1	Very high	172 Å²	172	81.1 Å²	81.1	85%	0.847	39%	0.391	S	S	*	.	H	α-helix	trans	-107	-40.3	-173.7	-64.6	-62.5	-67.7	0	0	112.6	S373 E374	S373-M377 WeakPolarHBondContact O-CG 3.31Å; E374-M377 PolarHBondContact O-N 3.17Å
378	S	95.5	Very high	94.2	Very high	34 Å²	34	81.4 Å²	81.4	24%	0.238	39%	0.392	C	S	.	.			trans	-95.8	135.4	-179.2	154.4	0	0	0	0	111.1	E374 E380 S381 L382	E374-S378 PolarHBondContact O-N 3.41Å; S378-E380 PolarHBondContact OG-N 3.08Å; S378-E380 PolarHBondContact OG-OE2 3.19Å; S378-S381 WeakPolarHBondContact CB-OG 3.45Å; S378-S381 PolarHBondContact OG-N 3.1Å; S378-S381 VanDerWaalsContact OG-N 3.11Å; S378-S381 PolarHBondContact OG-OG 3.07Å; S378-L382 PolarHBondContact O-N 3.44Å
379	M	94.5	Very high	94.3	Very high	131 Å²	131	85.8 Å²	85.8	65%	0.645	41%	0.408	S	S	*	.	H	α-helix	trans	-69.1	-40.7	174.5	-173.9	60.6	-180	0	0	111.7	S381 L382 I383	M379-S381 VanDerWaalsContact C-N 3.32Å; M379-S381 PolarHBondContact O-N 2.88Å; M379-L382 PolarHBondContact O-N 3.34Å; M379-I383 HydrophobicContact CE-CD1 4.27Å; M379-I383 HydrophobicContact CE-CG1 4.33Å; M379-I383 HydrophobicContact CG-CD1 4.19Å; M379-I383 WeakPolarHBondContact O-CG1 3.3Å; M379-I383 PolarHBondContact O-N 3.29Å
380	E	94.1	Very high	94.4	Very high	125 Å²	125	88.6 Å²	88.6	58%	0.584	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-42.9	177.8	-58.2	98.7	169.4	0	0	111.3	S378 L382 I383 H384	S378-E380 PolarHBondContact OG-N 3.08Å; S378-E380 PolarHBondContact OG-OE2 3.19Å; E380-L382 VanDerWaalsContact C-N 3.27Å; E380-L382 PolarHBondContact O-N 2.95Å; E380-I383 WeakPolarHBondContact O-CB 3.37Å; E380-I383 PolarHBondContact O-N 3.38Å; E380-I383 VanDerWaalsContact O-N 3.12Å; E380-H384 PolarHBondContact O-CD2 3.49Å; E380-H384 PolarHBondContact O-N 3.16Å
381	S	93.6	Very high	94.4	Very high	18 Å²	18	91.9 Å²	91.9	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-60.3	-38.7	179.2	-63.1	0	0	0	0	111.8	P370 S378 M379 H385	P370-S381 WeakPolarHBondContact CG-O 3.26Å; S378-S381 WeakPolarHBondContact CB-OG 3.45Å; S378-S381 PolarHBondContact OG-N 3.1Å; S378-S381 VanDerWaalsContact OG-N 3.11Å; S378-S381 PolarHBondContact OG-OG 3.07Å; M379-S381 VanDerWaalsContact C-N 3.32Å; M379-S381 PolarHBondContact O-N 2.88Å; S381-H385 VanDerWaalsContact O-CB 3.3Å; S381-H385 WeakPolarHBondContact O-CB 3.1Å; S381-H385 PolarHBondContact O-N 3Å
382	L	95.9	Very high	94.5	Very high	82 Å²	82	87.5 Å²	87.5	43%	0.429	42%	0.422	S	S	.	.	H	α-helix	trans	-67.3	-41.5	175.4	-173.7	62.7	0	0	0	112.2	M375 S378 M379 E380 H385 F386	M375-L382 HydrophobicContact CG-CD1 4.06Å; M375-L382 HydrophobicContact SD-CD1 3.97Å; S378-L382 PolarHBondContact O-N 3.44Å; M379-L382 PolarHBondContact O-N 3.34Å; E380-L382 VanDerWaalsContact C-N 3.27Å; E380-L382 PolarHBondContact O-N 2.95Å; L382-H385 PolarHBondContact O-N 3.25Å; L382-F386 WeakPolarHBondContact O-CB 3.45Å; L382-F386 PolarHBondContact O-N 2.84Å
383	I	95.6	Very high	94.6	Very high	73 Å²	73	79.3 Å²	79.3	37%	0.374	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-47.9	176.1	-66.5	165.6	0	0	0	110.4	M379 E380 F386 K387	M379-I383 HydrophobicContact CE-CD1 4.27Å; M379-I383 HydrophobicContact CE-CG1 4.33Å; M379-I383 HydrophobicContact CG-CD1 4.19Å; M379-I383 WeakPolarHBondContact O-CG1 3.3Å; M379-I383 PolarHBondContact O-N 3.29Å; E380-I383 WeakPolarHBondContact O-CB 3.37Å; E380-I383 PolarHBondContact O-N 3.38Å; E380-I383 VanDerWaalsContact O-N 3.12Å; I383-F386 PolarHBondContact O-N 3.45Å; I383-K387 HydrophobicContact CG2-CD 4.42Å; I383-K387 PolarHBondContact O-N 3.17Å
384	H	94.9	Very high	94.7	Very high	54 Å²	54	81.3 Å²	81.3	25%	0.25	39%	0.392	C	S	.	.	H	α-helix	trans	-61.3	-47.8	178.4	-74.6	-58.4	0	0	0	111.8	A365 E380 F386 K387 L388	A365-H384 HydrophobicContact CB-CB 4.45Å; E380-H384 PolarHBondContact O-CD2 3.49Å; E380-H384 PolarHBondContact O-N 3.16Å; H384-F386 VanDerWaalsContact C-N 3.34Å; H384-F386 PolarHBondContact O-N 3.13Å; H384-K387 PolarHBondContact O-N 3.11Å; H384-L388 VanDerWaalsContact O-CB 3.29Å; H384-L388 WeakPolarHBondContact O-CB 3.38Å; H384-L388 VanDerWaalsContact O-CG 3.29Å; H384-L388 WeakPolarHBondContact O-CG 3.48Å; H384-L388 PolarHBondContact O-N 3.1Å
385	H	95.8	Very high	94.9	Very high	50 Å²	50	77.3 Å²	77.3	23%	0.231	37%	0.374	C	S	.	.	H	α-helix	trans	-56.9	-47	175.3	178.9	-80	0	0	0	111.7	P370 M375 S381 L382 Y389	P370-H385 HydrophobicContact CG-CB 4.31Å; M375-H385 HydrophobicContact CG-CB 3.97Å; S381-H385 VanDerWaalsContact O-CB 3.3Å; S381-H385 WeakPolarHBondContact O-CB 3.1Å; S381-H385 PolarHBondContact O-N 3Å; L382-H385 PolarHBondContact O-N 3.25Å; H385-Y389 AromaticContact CD2-CD2 3.88Å; H385-Y389 AromaticContact CD2-CE2 3.61Å; H385-Y389 AromaticContact CE1-CD2 3.73Å; H385-Y389 AromaticContact NE2-CD2 3.66Å; H385-Y389 AromaticContact NE2-CE2 3.45Å; H385-Y389 WeakPolarHBondContact NE2-CE2 3.28Å; H385-Y389 VanDerWaalsContact O-CD2 3.3Å; H385-Y389 WeakPolarHBondContact O-CD2 3.41Å; H385-Y389 PolarHBondContact O-N 3.22Å
386	F	96.4	Very high	95	Very high	138 Å²	138	79.2 Å²	79.2	61%	0.605	39%	0.388	S	S	*	.	H	α-helix	trans	-61.9	-47.4	-179.7	-175.7	-95.1	0	0	0	112.2	L382 I383 H384 T390	L382-F386 WeakPolarHBondContact O-CB 3.45Å; L382-F386 PolarHBondContact O-N 2.84Å; I383-F386 PolarHBondContact O-N 3.45Å; H384-F386 VanDerWaalsContact C-N 3.34Å; H384-F386 PolarHBondContact O-N 3.13Å; F386-T390 HydrophobicContact CE1-CG2 4.3Å; F386-T390 HydrophobicContact CE2-CG2 4.27Å; F386-T390 HydrophobicContact CZ-CG2 4.13Å; F386-T390 WeakPolarHBondContact O-CB 3.11Å; F386-T390 WeakPolarHBondContact O-CG2 3.38Å; F386-T390 PolarHBondContact O-N 2.96Å; F386-T390 PolarHBondContact O-OG1 2.9Å
387	K	95.7	Very high	95.2	Very high	119 Å²	119	76.2 Å²	76.2	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-67	-42.6	-179.9	-72.4	-169.4	175.2	-169.7	0	112.8	I383 H384 Y389 T390 E391 G392	I383-K387 HydrophobicContact CG2-CD 4.42Å; I383-K387 PolarHBondContact O-N 3.17Å; H384-K387 PolarHBondContact O-N 3.11Å; K387-Y389 VanDerWaalsContact C-N 3.31Å; K387-Y389 PolarHBondContact O-N 3.02Å; K387-T390 PolarHBondContact O-N 3.35Å; K387-T390 PolarHBondContact O-OG1 2.8Å; K387-E391 PolarHBondContact O-N 3.49Å; K387-G392 PolarHBondContact O-N 3.47Å; K387-G392 VanDerWaalsContact O-N 3.13Å
388	L	94.4	Very high	95.3	Very high	18 Å²	18	69.4 Å²	69.4	9%	0.094	36%	0.358	C	S	.	.	H	α-helix	trans	-60	-38.3	-179.9	-81.2	176.4	0	0	0	113.3	A365 K366 P369 H384 G392 Y393	A365-L388 WeakPolarHBondContact O-CD1 3.35Å; K366-L388 VanDerWaalsContact O-CD2 3.28Å; K366-L388 WeakPolarHBondContact O-CD2 3.42Å; P369-L388 HydrophobicContact CB-CD1 4.3Å; H384-L388 VanDerWaalsContact O-CB 3.29Å; H384-L388 WeakPolarHBondContact O-CB 3.38Å; H384-L388 VanDerWaalsContact O-CG 3.29Å; H384-L388 WeakPolarHBondContact O-CG 3.48Å; H384-L388 PolarHBondContact O-N 3.1Å; L388-G392 VanDerWaalsContact O-CA 3.31Å; L388-G392 WeakPolarHBondContact O-CA 3.01Å; L388-G392 PolarHBondContact O-N 3.46Å; L388-Y393 HydrophobicContact CD2-CD1 3.96Å; L388-Y393 HydrophobicContact CD2-CG 4.5Å
389	Y	95.3	Very high	95.3	Very high	98 Å²	98	70.6 Å²	70.6	38%	0.384	37%	0.37	S	S	.	.	H	α-helix	trans	-89.1	-14.8	-178.4	-75.7	-69.4	0	0	0	114.4	L134 P369 H385 K387	L134-Y389 HydrophobicContact CD2-CD1 4.21Å; L134-Y389 HydrophobicContact CD2-CE1 3.88Å; P369-Y389 HydrophobicContact CB-CE2 4.06Å; H385-Y389 AromaticContact CD2-CD2 3.88Å; H385-Y389 AromaticContact CD2-CE2 3.61Å; H385-Y389 AromaticContact CE1-CD2 3.73Å; H385-Y389 AromaticContact NE2-CD2 3.66Å; H385-Y389 AromaticContact NE2-CE2 3.45Å; H385-Y389 WeakPolarHBondContact NE2-CE2 3.28Å; H385-Y389 VanDerWaalsContact O-CD2 3.3Å; H385-Y389 WeakPolarHBondContact O-CD2 3.41Å; H385-Y389 PolarHBondContact O-N 3.22Å; K387-Y389 VanDerWaalsContact C-N 3.31Å; K387-Y389 PolarHBondContact O-N 3.02Å
390	T	94.3	Very high	95.5	Very high	85 Å²	85	65.1 Å²	65.1	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-98.9	-59.2	178.1	52.1	0	0	0	0	111.8	F386 K387	F386-T390 HydrophobicContact CE1-CG2 4.3Å; F386-T390 HydrophobicContact CE2-CG2 4.27Å; F386-T390 HydrophobicContact CZ-CG2 4.13Å; F386-T390 WeakPolarHBondContact O-CB 3.11Å; F386-T390 WeakPolarHBondContact O-CG2 3.38Å; F386-T390 PolarHBondContact O-N 2.96Å; F386-T390 PolarHBondContact O-OG1 2.9Å; K387-T390 PolarHBondContact O-N 3.35Å; K387-T390 PolarHBondContact O-OG1 2.8Å
391	E	94.4	Very high	95.6	Very high	89 Å²	89	63.7 Å²	63.7	42%	0.416	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-39.7	-179.2	-171.3	-177.8	163.7	0	0	112	T132 K387 Q394 S421	T132-E391 WeakPolarHBondContact CG2-O 3.42Å; K387-E391 PolarHBondContact O-N 3.49Å; E391-Q394 PolarHBondContact OE1-NE2 3.43Å; E391-S421 VanDerWaalsContact O-CB 3.23Å; E391-S421 WeakPolarHBondContact O-CB 3.39Å; E391-S421 PolarHBondContact O-OG 2.83Å
392	G	94.3	Very high	95.8	Very high	12 Å²	12	63.5 Å²	63.5	12%	0.124	33%	0.333	C	S	.	.			trans	88.7	165	-167.1	0	0	0	0	0	112.5	K387 L388	K387-G392 PolarHBondContact O-N 3.47Å; K387-G392 VanDerWaalsContact O-N 3.13Å; L388-G392 VanDerWaalsContact O-CA 3.31Å; L388-G392 WeakPolarHBondContact O-CA 3.01Å; L388-G392 PolarHBondContact O-N 3.46Å
393	Y	95	Very high	95.8	Very high	19 Å²	19	60.7 Å²	60.7	8%	0.075	32%	0.321	C	S	.	.			trans	-75.3	143	171.5	51.8	-99.5	0	0	0	110.4	Y133 V159 L163 P233 L388 V395 S421	Y133-Y393 VanDerWaalsContact CB-OH 3.32Å; Y133-Y393 WeakPolarHBondContact CB-OH 3.34Å; Y133-Y393 HydrophobicContact CD2-CD2 4.48Å; Y133-Y393 HydrophobicContact CD2-CE2 4.04Å; Y133-Y393 AromaticContact CG-CE2 4Å; Y133-Y393 HydrophobicContact CG-CE2 4Å; V159-Y393 HydrophobicContact CG1-CE2 3.94Å; L163-Y393 HydrophobicContact CD1-CD2 4.2Å; L163-Y393 HydrophobicContact CD1-CE2 4.07Å; P233-Y393 WeakPolarHBondContact CB-OH 3.39Å; P233-Y393 WeakPolarHBondContact CG-OH 3.41Å; L388-Y393 HydrophobicContact CD2-CD1 3.96Å; L388-Y393 HydrophobicContact CD2-CG 4.5Å; Y393-V395 HydrophobicContact CD2-CG2 3.84Å; Y393-V395 HydrophobicContact CE2-CG2 3.82Å; Y393-S421 WeakPolarHBondContact O-CA 3.28Å; Y393-S421 WeakPolarHBondContact O-CB 3.44Å
394	Q	95.4	Very high	95.9	Very high	123 Å²	123	57.2 Å²	57.2	58%	0.575	30%	0.303	S	S	*	.			trans	-83	132.7	176	-66	166.9	-5.2	0	0	108.8	E391	E391-Q394 PolarHBondContact OE1-NE2 3.43Å
395	V	96.1	Very high	95.9	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.292	C	S	.	.			trans	-104.3	131.3	178.1	177.4	0	0	0	0	108.3	Y133 V159 L162 L163 Y393 G419 S420	Y133-V395 HydrophobicContact CD1-CG2 4.3Å; Y133-V395 HydrophobicContact CD2-CB 4.49Å; Y133-V395 HydrophobicContact CD2-CG2 3.56Å; Y133-V395 HydrophobicContact CE1-CB 4.47Å; Y133-V395 HydrophobicContact CE1-CG2 4Å; Y133-V395 HydrophobicContact CE2-CB 3.7Å; Y133-V395 HydrophobicContact CE2-CG2 3.23Å; Y133-V395 HydrophobicContact CG-CG2 4.1Å; Y133-V395 VanDerWaalsContact CZ-CG2 3.48Å; V159-V395 HydrophobicContact CG1-CG2 4.45Å; L162-V395 HydrophobicContact CB-CG1 3.57Å; L162-V395 HydrophobicContact CD1-CG1 4.07Å; L162-V395 HydrophobicContact CG-CG1 4.39Å; L163-V395 HydrophobicContact CD2-CB 4.41Å; L163-V395 HydrophobicContact CD2-CG1 4.45Å; L163-V395 HydrophobicContact CD2-CG2 4.02Å; L163-V395 HydrophobicContact CG-CG2 4.3Å; Y393-V395 HydrophobicContact CD2-CG2 3.84Å; Y393-V395 HydrophobicContact CE2-CG2 3.82Å; V395-G419 CarbonylContact O-C 3.54Å; V395-G419 WeakPolarHBondContact O-CA 3.24Å; V395-S420 PolarHBondContact N-O 2.92Å
396	P	96.6	Very high	95.9	Very high	60 Å²	60	52.4 Å²	52.4	39%	0.39	28%	0.281	S	S	.	.			trans	-51.5	144.3	177.7	-27.1	34.1	0	0	0	112.1	G398 S417	P396-G398 PolarHBondContact O-N 3.36Å; P396-S417 WeakPolarHBondContact O-CB 3.15Å; P396-S417 PolarHBondContact O-OG 3.06Å
397	P	96.8	Very high	95.9	Very high	99 Å²	99	45.8 Å²	45.8	64%	0.643	25%	0.252	S	S	*	.	S	Bend	trans	-64.5	130	178.4	27	-33.3	0	0	0	110.6	S417	P397-S417 WeakPolarHBondContact CA-O 3.46Å
398	G	96.1	Very high	95.8	Very high	29 Å²	29	40.3 Å²	40.3	30%	0.299	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	175	172.3	-175.2	0	0	0	0	0	112.9	P396 V416 S417	P396-G398 PolarHBondContact O-N 3.36Å; G398-V416 WeakPolarHBondContact O-CA 3.36Å; G398-S417 PolarHBondContact N-O 3.48Å; G398-S417 VanDerWaalsContact N-O 3.08Å; G398-S417 PolarHBondContact N-OG 3.36Å; G398-S417 PolarHBondContact O-N 3.19Å; G398-S417 PolarHBondContact O-OG 2.91Å
399	A	96.9	Very high	95.8	Very high	59 Å²	59	39.5 Å²	39.5	49%	0.488	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132	172.7	0	0	0	0	0	109.5	Y414 L415 V416	A399-Y414 HydrophobicContact CB-CE2 4.24Å; A399-L415 CarbonylContact C-O 3.26Å; A399-L415 VanDerWaalsContact CA-O 3.28Å; A399-L415 WeakPolarHBondContact CA-O 3.16Å; A399-V416 HydrophobicContact CB-CG2 4.17Å
400	T	97.3	Very high	95.9	Very high	17 Å²	17	36.6 Å²	36.6	10%	0.104	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	141.5	176.3	53.1	0	0	0	0	110.6	K161 L162 Y414 L415	K161-T400 HydrophobicContact CD-CG2 4.26Å; K161-T400 HydrophobicContact CG-CG2 4.19Å; L162-T400 HydrophobicContact CD2-CG2 3.37Å; L162-T400 HydrophobicContact CG-CG2 3.64Å; L162-T400 WeakPolarHBondContact CG-OG1 3.4Å; T400-Y414 CarbonylContact O-C 3.58Å; T400-Y414 VanDerWaalsContact O-CA 3.28Å; T400-Y414 WeakPolarHBondContact O-CA 3.46Å; T400-Y414 WeakPolarHBondContact O-CD2 3.44Å; T400-L415 PolarHBondContact N-O 3.38Å; T400-L415 PolarHBondContact O-N 3.28Å
401	Y	97.8	Very high	96	Very high	95 Å²	95	32.6 Å²	32.6	37%	0.373	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.9	159.5	-178.3	-107	0	0	0	107.5	A403 E410 V413 K429	Y401-A403 HydrophobicContact CE1-CB 4.05Å; Y401-E410 PolarHBondContact OH-OE1 3.16Å; Y401-V413 WeakPolarHBondContact CA-O 3.13Å; Y401-K429 HydrophobicContact CE2-CB 4.48Å; Y401-K429 WeakPolarHBondContact OH-CD 3.4Å
402	T	97	Very high	96.1	Very high	14 Å²	14	28.4 Å²	28.4	9%	0.086	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.5	172.3	51.4	0	0	0	0	108.4	A158 K161 G412 V413	A158-T402 VanDerWaalsContact CA-OG1 3.22Å; A158-T402 WeakPolarHBondContact CA-OG1 3.2Å; A158-T402 HydrophobicContact CB-CG2 4.45Å; A158-T402 WeakPolarHBondContact CB-OG1 3.39Å; K161-T402 HydrophobicContact CB-CG2 4.25Å; K161-T402 HydrophobicContact CD-CG2 3.41Å; K161-T402 VanDerWaalsContact CD-CG2 3.41Å; K161-T402 HydrophobicContact CG-CG2 4.48Å; T402-G412 WeakPolarHBondContact O-CA 3.3Å; T402-V413 PolarHBondContact N-O 3.25Å; T402-V413 VanDerWaalsContact N-O 3.08Å; T402-V413 PolarHBondContact O-N 3.27Å
403	A	96.7	Very high	96.3	Very high	22 Å²	22	27.8 Å²	27.8	18%	0.182	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.3	178.2	0	0	0	0	0	110.4	L306 Y401 E410 F411	L306-A403 HydrophobicContact CD1-CB 4.05Å; Y401-A403 HydrophobicContact CE1-CB 4.05Å; A403-E410 HydrophobicContact CB-CG 3.68Å; A403-F411 CarbonylContact C-O 3.46Å; A403-F411 VanDerWaalsContact CA-O 3.27Å; A403-F411 WeakPolarHBondContact CA-O 3.46Å
404	V	96.3	Very high	96.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.7	179.9	168.3	0	0	0	0	107.3	C154 L157 Y312 A406 F411	C154-V404 HydrophobicContact CB-CB 3.96Å; C154-V404 HydrophobicContact CB-CG2 3.72Å; L157-V404 HydrophobicContact CD1-CG2 3.7Å; Y312-V404 HydrophobicContact CD2-CG2 4.48Å; Y312-V404 HydrophobicContact CE1-CG1 4.33Å; Y312-V404 HydrophobicContact CE2-CG1 3.78Å; Y312-V404 HydrophobicContact CE2-CG2 4.23Å; Y312-V404 VanDerWaalsContact OH-CG1 3.28Å; Y312-V404 WeakPolarHBondContact OH-CG1 3.21Å; V404-A406 VanDerWaalsContact C-N 3.29Å; V404-A406 PolarHBondContact O-N 3.36Å; V404-F411 PolarHBondContact N-O 3.19Å; V404-F411 PolarHBondContact O-N 2.91Å
405	E	96.3	Very high	96.5	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	84.2	171.2	-162	76.6	-170.9	0	0	108.8	R183 G294 R298 D305 L306 R307 Y312	R183-E405 PolarHBondContact NH2-O 3.4Å; G294-E405 WeakPolarHBondContact CA-OE1 3.3Å; R298-E405 IonicContact CZ-OE1 3.5Å; R298-E405 IonicContact NH1-OE1 2.82Å; R298-E405 PolarHBondContact NH1-OE1 3.28Å; R298-E405 IonicContact NH2-OE1 2.62Å; D305-E405 VanDerWaalsContact OD1-CG 3.31Å; D305-E405 WeakPolarHBondContact OD1-CG 3.48Å; L306-E405 HydrophobicContact CB-CB 4.13Å; L306-E405 WeakPolarHBondContact CB-OE2 3.22Å; L306-E405 VanDerWaalsContact CG-OE2 3.31Å; L306-E405 WeakPolarHBondContact CG-OE2 3.49Å; L306-E405 PolarHBondContact N-OE2 3.26Å; L306-E405 VanDerWaalsContact N-OE2 3.08Å; R307-E405 HydrophobicContact CG-CB 3.88Å; Y312-E405 PolarHBondContact OH-N 3.29Å
406	A	95.5	Very high	96.6	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	160.7	167	0	0	0	0	0	109.7	V404 K408 G409 F411	V404-A406 VanDerWaalsContact C-N 3.29Å; V404-A406 PolarHBondContact O-N 3.36Å; A406-K408 PolarHBondContact O-N 3.31Å; A406-K408 VanDerWaalsContact O-N 3.15Å; A406-G409 WeakPolarHBondContact CA-O 3.28Å; A406-G409 WeakPolarHBondContact CB-O 3.24Å; A406-G409 PolarHBondContact N-O 3.06Å; A406-G409 PolarHBondContact O-N 3.01Å; A406-G409 VanDerWaalsContact O-O 3.14Å; A406-F411 HydrophobicContact CB-CB 3.65Å
407	P	95.7	Very high	96.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.4	-179.2	-21.8	34.4	0	0	0	113.2	R183 N186 H187	R183-P407 HydrophobicContact CB-CG 4.02Å; R183-P407 HydrophobicContact CG-CB 4.03Å; R183-P407 HydrophobicContact CG-CG 4.05Å; N186-P407 HydrophobicContact CB-CB 3.65Å; N186-P407 HydrophobicContact CB-CG 3.81Å; H187-P407 PolarHBondContact CE1-O 2.87Å
408	K	94.3	Very high	96.5	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.017	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-23.4	173	-63	-175.8	-174.4	-62	0	113.2	D144 A406 P431 H435 D459 V461 E464	D144-K408 WeakPolarHBondContact OD1-CE 3.45Å; D144-K408 VanDerWaalsContact OD2-CD 3.23Å; D144-K408 WeakPolarHBondContact OD2-CD 3.31Å; D144-K408 WeakPolarHBondContact OD2-CE 3.29Å; A406-K408 PolarHBondContact O-N 3.31Å; A406-K408 VanDerWaalsContact O-N 3.15Å; K408-P431 HydrophobicContact CB-CB 4.26Å; K408-P431 HydrophobicContact CB-CG 3.56Å; K408-H435 PolarHBondContact O-CE1 2.88Å; K408-D459 WeakPolarHBondContact CD-O 3.34Å; K408-D459 WeakPolarHBondContact CG-OD2 3.41Å; K408-D459 PolarHBondContact NZ-O 3.14Å; K408-D459 IonicContact NZ-OD1 2.81Å; K408-D459 PolarHBondContact NZ-OD1 3.37Å; K408-D459 IonicContact NZ-OD2 3.9Å; K408-D459 PolarHBondContact NZ-OD2 3.38Å; K408-V461 VanDerWaalsContact CE-CG2 3.5Å; K408-V461 VanDerWaalsContact NZ-CG2 3.34Å; K408-E464 WeakPolarHBondContact CD-OE1 3.47Å
409	G	94.8	Very high	96.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.6	-149.9	-179.6	0	0	0	0	0	113	A406 F411	A406-G409 WeakPolarHBondContact CA-O 3.28Å; A406-G409 WeakPolarHBondContact CB-O 3.24Å; A406-G409 PolarHBondContact N-O 3.06Å; A406-G409 PolarHBondContact O-N 3.01Å; A406-G409 VanDerWaalsContact O-O 3.14Å; G409-F411 PolarHBondContact O-N 3.02Å
410	E	96.1	Very high	96.2	Very high	38 Å²	38	23.4 Å²	23.4	18%	0.178	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	100.6	-177.2	179.6	-176	158.6	0	0	110.1	S293 L306 Y401 A403 K429	S293-E410 PolarHBondContact OG-N 2.91Å; L306-E410 HydrophobicContact CD1-CB 4.16Å; L306-E410 HydrophobicContact CD1-CG 3.77Å; Y401-E410 PolarHBondContact OH-OE1 3.16Å; A403-E410 HydrophobicContact CB-CG 3.68Å; E410-K429 HydrophobicContact CG-CD 4.49Å; E410-K429 IonicContact OE1-NZ 3.62Å; E410-K429 PolarHBondContact OE1-NZ 2.99Å; E410-K429 IonicContact OE2-NZ 3.12Å; E410-K429 PolarHBondContact OE2-NZ 2.92Å
411	F	96.9	Very high	96.2	Very high	1 Å²	1	23.4 Å²	23.4	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	119.9	169.3	-176.5	-97.8	0	0	0	108.4	F140 L143 N151 C154 A403 V404 A406 G409 V413 I428	F140-F411 HydrophobicContact CD1-CE1 4.45Å; F140-F411 HydrophobicContact CD1-CZ 4.3Å; L143-F411 HydrophobicContact CD1-CZ 4.27Å; N151-F411 HydrophobicContact CB-CE1 4.22Å; N151-F411 HydrophobicContact CB-CZ 4.32Å; C154-F411 HydrophobicContact CB-CD1 3.53Å; C154-F411 HydrophobicContact CB-CE1 3.84Å; C154-F411 PolarHBondContact SG-O 2.87Å; C154-F411 VanDerWaalsContact SG-O 3.38Å; A403-F411 CarbonylContact C-O 3.46Å; A403-F411 VanDerWaalsContact CA-O 3.27Å; A403-F411 WeakPolarHBondContact CA-O 3.46Å; V404-F411 PolarHBondContact N-O 3.19Å; V404-F411 PolarHBondContact O-N 2.91Å; A406-F411 HydrophobicContact CB-CB 3.65Å; G409-F411 PolarHBondContact O-N 3.02Å; F411-V413 HydrophobicContact CD1-CG2 4.42Å; F411-V413 HydrophobicContact CE1-CG2 3.74Å; F411-V413 HydrophobicContact CZ-CG2 4.35Å; F411-I428 HydrophobicContact CD2-CG2 4.45Å; F411-I428 HydrophobicContact CE1-CG2 4.41Å; F411-I428 HydrophobicContact CE2-CG2 3.5Å; F411-I428 HydrophobicContact CZ-CG2 3.48Å; F411-I428 VanDerWaalsContact CZ-CG2 3.48Å
412	G	96.6	Very high	96.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	142.5	-173.6	0	0	0	0	0	111.8	T402 K429	T402-G412 WeakPolarHBondContact O-CA 3.3Å; G412-K429 PolarHBondContact N-O 2.91Å; G412-K429 PolarHBondContact O-N 3.4Å
413	V	97.4	Very high	96.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	121.1	174.7	175.5	0	0	0	0	108.3	F140 C154 A158 Y401 T402 F411 L415	F140-V413 HydrophobicContact CD1-CG2 4.36Å; F140-V413 HydrophobicContact CE1-CG1 4.3Å; F140-V413 HydrophobicContact CE1-CG2 3.74Å; F140-V413 HydrophobicContact CZ-CG1 4.43Å; C154-V413 HydrophobicContact CB-CG2 4.45Å; A158-V413 HydrophobicContact CB-CB 4.36Å; A158-V413 HydrophobicContact CB-CG1 4.15Å; Y401-V413 WeakPolarHBondContact CA-O 3.13Å; T402-V413 PolarHBondContact N-O 3.25Å; T402-V413 VanDerWaalsContact N-O 3.08Å; T402-V413 PolarHBondContact O-N 3.27Å; F411-V413 HydrophobicContact CD1-CG2 4.42Å; F411-V413 HydrophobicContact CE1-CG2 3.74Å; F411-V413 HydrophobicContact CZ-CG2 4.35Å; V413-L415 HydrophobicContact CG1-CD1 4.18Å; V413-L415 HydrophobicContact CG1-CD2 4.39Å; V413-L415 HydrophobicContact CG1-CG 3.75Å
414	Y	98.1	Very high	96.1	Very high	102 Å²	102	30.8 Å²	30.8	40%	0.4	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	104.5	171	-178.6	-111	0	0	0	109.2	A399 T400 V416 C426 K427	A399-Y414 HydrophobicContact CB-CE2 4.24Å; T400-Y414 CarbonylContact O-C 3.58Å; T400-Y414 VanDerWaalsContact O-CA 3.28Å; T400-Y414 WeakPolarHBondContact O-CA 3.46Å; T400-Y414 WeakPolarHBondContact O-CD2 3.44Å; Y414-V416 HydrophobicContact CD1-CG2 4.25Å; Y414-V416 HydrophobicContact CE1-CG2 3.56Å; Y414-C426 WeakPolarHBondContact O-CA 3.17Å; Y414-K427 HydrophobicContact CD1-CB 4.23Å; Y414-K427 PolarHBondContact N-O 3.29Å; Y414-K427 PolarHBondContact O-N 3.07Å
415	L	97.4	Very high	96.1	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.5	178.1	-79	172.5	0	0	0	110.7	Y155 A158 V159 L162 A399 T400 V413 P423 C426	Y155-L415 HydrophobicContact CD2-CD1 4.1Å; Y155-L415 HydrophobicContact CE2-CD1 3.91Å; Y155-L415 HydrophobicContact CE2-CD2 4.27Å; A158-L415 HydrophobicContact CB-CD1 3.54Å; A158-L415 HydrophobicContact CB-CG 4.36Å; V159-L415 HydrophobicContact CG2-CD1 3.75Å; L162-L415 HydrophobicContact CD1-CB 3.95Å; A399-L415 CarbonylContact C-O 3.26Å; A399-L415 VanDerWaalsContact CA-O 3.28Å; A399-L415 WeakPolarHBondContact CA-O 3.16Å; T400-L415 PolarHBondContact N-O 3.38Å; T400-L415 PolarHBondContact O-N 3.28Å; V413-L415 HydrophobicContact CG1-CD1 4.18Å; V413-L415 HydrophobicContact CG1-CD2 4.39Å; V413-L415 HydrophobicContact CG1-CG 3.75Å; L415-P423 HydrophobicContact CD2-CB 4.17Å; L415-C426 HydrophobicContact CD2-CB 3.63Å; L415-C426 VanDerWaalsContact CD2-SG 3.59Å
416	V	97.8	Very high	96.1	Very high	33 Å²	33	34.3 Å²	34.3	20%	0.2	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.5	168.8	-175.1	0	0	0	0	108	G398 A399 Y414 Y424 R425	G398-V416 WeakPolarHBondContact O-CA 3.36Å; A399-V416 HydrophobicContact CB-CG2 4.17Å; Y414-V416 HydrophobicContact CD1-CG2 4.25Å; Y414-V416 HydrophobicContact CE1-CG2 3.56Å; V416-Y424 HydrophobicContact CB-CD1 4.48Å; V416-Y424 HydrophobicContact CG1-CD1 4.08Å; V416-Y424 WeakPolarHBondContact O-CB 3.25Å; V416-Y424 PolarHBondContact O-N 2.88Å; V416-R425 HydrophobicContact CB-CB 4.01Å; V416-R425 HydrophobicContact CG2-CB 4.17Å; V416-R425 PolarHBondContact N-O 2.81Å; V416-R425 PolarHBondContact O-N 3.3Å
417	S	96.6	Very high	96.2	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.8	175	54.2	0	0	0	0	110.1	Y133 P396 P397 G398	Y133-S417 VanDerWaalsContact OH-CB 3.26Å; Y133-S417 WeakPolarHBondContact OH-CB 3.31Å; P396-S417 WeakPolarHBondContact O-CB 3.15Å; P396-S417 PolarHBondContact O-OG 3.06Å; P397-S417 WeakPolarHBondContact CA-O 3.46Å; G398-S417 PolarHBondContact N-O 3.48Å; G398-S417 VanDerWaalsContact N-O 3.08Å; G398-S417 PolarHBondContact N-OG 3.36Å; G398-S417 PolarHBondContact O-N 3.19Å; G398-S417 PolarHBondContact O-OG 2.91Å
418	D	94.5	Very high	96.2	Very high	88 Å²	88	38.6 Å²	38.6	47%	0.471	18%	0.181	S	C	.	.			trans	-99.4	6.4	176.6	61.5	-9.7	0	0	0	112.9	S420 Y424	D418-S420 WeakPolarHBondContact OD1-CB 3.45Å; D418-S420 PolarHBondContact OD1-N 3.29Å; D418-S420 PolarHBondContact OD1-OG 3.31Å; D418-Y424 HydrophobicContact CB-CD2 4.39Å
419	G	93.3	Very high	96.3	Very high	28 Å²	28	41.3 Å²	41.3	29%	0.289	19%	0.192	S	C	.	.	S	Bend	trans	95.1	-7.4	-172.6	0	0	0	0	0	113.8	V395	V395-G419 CarbonylContact O-C 3.54Å; V395-G419 WeakPolarHBondContact O-CA 3.24Å
420	S	95	Very high	96.3	Very high	40 Å²	40	41.5 Å²	41.5	28%	0.28	19%	0.194	S	C	.	.	S	Bend	trans	-86.2	178.3	179.2	79.8	0	0	0	0	112.8	V395 D418 R422	V395-S420 PolarHBondContact N-O 2.92Å; D418-S420 WeakPolarHBondContact OD1-CB 3.45Å; D418-S420 PolarHBondContact OD1-N 3.29Å; D418-S420 PolarHBondContact OD1-OG 3.31Å; S420-R422 PolarHBondContact O-N 3.37Å; S420-R422 PolarHBondContact OG-N 3.4Å; S420-R422 PolarHBondContact OG-O 2.61Å; S420-R422 VanDerWaalsContact OG-O 3.05Å
421	S	95.5	Very high	96.2	Very high	16 Å²	16	39.7 Å²	39.7	11%	0.112	19%	0.185	C	C	.	.	S	Bend	trans	-82	3.3	173.6	66.1	0	0	0	0	114	T132 Y133 E391 Y393	T132-S421 VanDerWaalsContact CA-O 3.32Å; T132-S421 WeakPolarHBondContact CA-O 3.42Å; T132-S421 WeakPolarHBondContact CB-O 3.44Å; Y133-S421 WeakPolarHBondContact CD2-O 3.39Å; Y133-S421 VanDerWaalsContact CE2-C 3.5Å; Y133-S421 WeakPolarHBondContact CE2-O 3.38Å; Y133-S421 PolarHBondContact N-O 2.96Å; E391-S421 VanDerWaalsContact O-CB 3.23Å; E391-S421 WeakPolarHBondContact O-CB 3.39Å; E391-S421 PolarHBondContact O-OG 2.83Å; Y393-S421 WeakPolarHBondContact O-CA 3.28Å; Y393-S421 WeakPolarHBondContact O-CB 3.44Å
422	R	96.3	Very high	96.1	Very high	131 Å²	131	39.7 Å²	39.7	49%	0.494	19%	0.185	S	C	.	.	S	Bend	trans	-117.1	141.7	177.4	-59.2	-177	-174.2	172.7	0.9	109.4	T132 Y133 S420 Y424	T132-R422 HydrophobicContact CG2-CG 4.28Å; Y133-R422 PolarHBondContact OH-O 3.43Å; S420-R422 PolarHBondContact O-N 3.37Å; S420-R422 PolarHBondContact OG-N 3.4Å; S420-R422 PolarHBondContact OG-O 2.61Å; S420-R422 VanDerWaalsContact OG-O 3.05Å; R422-Y424 PolarHBondContact O-N 3.15Å
423	P	96.7	Very high	96.1	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.013	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	127.7	172.5	29	-29.2	0	0	0	109.1	I128 K131 Y133 L415	I128-P423 HydrophobicContact CG2-CB 4.42Å; I128-P423 HydrophobicContact CG2-CG 3.52Å; K131-P423 WeakPolarHBondContact O-CD 3.43Å; Y133-P423 HydrophobicContact CD1-CB 4.4Å; Y133-P423 HydrophobicContact CE1-CB 3.78Å; Y133-P423 HydrophobicContact CE1-CG 4.4Å; L415-P423 HydrophobicContact CD2-CB 4.17Å
424	Y	96.9	Very high	96	Very high	153 Å²	153	45.4 Å²	45.4	60%	0.6	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68	-42.5	176.9	177.4	-97.1	0	0	0	111.1	V416 D418 R422	V416-Y424 HydrophobicContact CB-CD1 4.48Å; V416-Y424 HydrophobicContact CG1-CD1 4.08Å; V416-Y424 WeakPolarHBondContact O-CB 3.25Å; V416-Y424 PolarHBondContact O-N 2.88Å; D418-Y424 HydrophobicContact CB-CD2 4.39Å; R422-Y424 PolarHBondContact O-N 3.15Å
425	R	96.1	Very high	95.8	Very high	77 Å²	77	40.7 Å²	40.7	29%	0.291	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	137.9	174.8	-172.8	70.3	-174.9	110.8	14.9	109.7	E125 E129 V416	E125-R425 IonicContact OE2-CZ 3.44Å; E125-R425 IonicContact OE2-NH1 3.85Å; E125-R425 IonicContact OE2-NH2 3.11Å; E125-R425 PolarHBondContact OE2-NH2 3.19Å; E129-R425 VanDerWaalsContact OE1-CD 3.3Å; E129-R425 WeakPolarHBondContact OE1-CD 3.06Å; E129-R425 IonicContact OE1-CZ 4Å; E129-R425 IonicContact OE1-NE 3.97Å; E129-R425 IonicContact OE1-NH1 2.88Å; E129-R425 PolarHBondContact OE1-NH1 2.86Å; V416-R425 HydrophobicContact CB-CB 4.01Å; V416-R425 HydrophobicContact CG2-CB 4.17Å; V416-R425 PolarHBondContact N-O 2.81Å; V416-R425 PolarHBondContact O-N 3.3Å
426	C	96.4	Very high	95.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	110.2	170.4	-178.5	0	0	0	0	108.8	E125 I128 Y414 L415	E125-C426 WeakPolarHBondContact CG-O 3.47Å; I128-C426 HydrophobicContact CB-CB 4.48Å; I128-C426 HydrophobicContact CG2-CB 3.68Å; Y414-C426 WeakPolarHBondContact O-CA 3.17Å; L415-C426 HydrophobicContact CD2-CB 3.63Å; L415-C426 VanDerWaalsContact CD2-SG 3.59Å
427	K	97.1	Very high	95.5	Very high	89 Å²	89	42.4 Å²	42.4	39%	0.387	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.2	172.6	177.9	71.8	-154	147.1	0	109.1	E125 Y414	E125-K427 WeakPolarHBondContact OE1-CD 3.26Å; E125-K427 WeakPolarHBondContact OE1-CE 3.06Å; E125-K427 IonicContact OE1-NZ 3.76Å; E125-K427 PolarHBondContact OE1-NZ 3.1Å; E125-K427 IonicContact OE2-NZ 3.74Å; E125-K427 PolarHBondContact OE2-NZ 3.48Å; Y414-K427 HydrophobicContact CD1-CB 4.23Å; Y414-K427 PolarHBondContact N-O 3.29Å; Y414-K427 PolarHBondContact O-N 3.07Å
428	I	96.6	Very high	95.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.8	-179.1	-48.3	-177.6	0	0	0	107.9	E125 F140 L143 F411 R467	E125-I428 HydrophobicContact CG-CG1 4.48Å; E125-I428 PolarHBondContact OE1-N 3.19Å; F140-I428 HydrophobicContact CD1-CD1 4.23Å; F140-I428 HydrophobicContact CE1-CD1 3.69Å; F140-I428 HydrophobicContact CE1-CG1 4.18Å; F140-I428 HydrophobicContact CZ-CD1 4.31Å; L143-I428 HydrophobicContact CD1-CD1 3.24Å; L143-I428 HydrophobicContact CD1-CG2 4.35Å; L143-I428 HydrophobicContact CD2-CD1 4.35Å; L143-I428 HydrophobicContact CG-CD1 4.43Å; F411-I428 HydrophobicContact CD2-CG2 4.45Å; F411-I428 HydrophobicContact CE1-CG2 4.41Å; F411-I428 HydrophobicContact CE2-CG2 3.5Å; F411-I428 HydrophobicContact CZ-CG2 3.48Å; F411-I428 VanDerWaalsContact CZ-CG2 3.48Å; I428-R467 VanDerWaalsContact CG2-NH1 3.32Å; I428-R467 VanDerWaalsContact O-CZ 3.31Å; I428-R467 PolarHBondContact O-NH1 3.14Å
429	K	96.1	Very high	95.4	Very high	61 Å²	61	38 Å²	38	27%	0.265	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	115.7	166.8	-176.3	-151	174.8	-165.3	0	107.3	Y401 E410 G412	Y401-K429 HydrophobicContact CE2-CB 4.48Å; Y401-K429 WeakPolarHBondContact OH-CD 3.4Å; E410-K429 HydrophobicContact CG-CD 4.49Å; E410-K429 IonicContact OE1-NZ 3.62Å; E410-K429 PolarHBondContact OE1-NZ 2.99Å; E410-K429 IonicContact OE2-NZ 3.12Å; E410-K429 PolarHBondContact OE2-NZ 2.92Å; G412-K429 PolarHBondContact N-O 2.91Å; G412-K429 PolarHBondContact O-N 3.4Å
430	A	94.8	Very high	95.4	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.025	19%	0.186	C	C	.	.			trans	-107	134.2	179	0	0	0	0	0	107.7	G432 F433 E464	A430-G432 VanDerWaalsContact C-N 3.34Å; A430-F433 HydrophobicContact CB-CB 4.42Å; A430-F433 PolarHBondContact O-N 3.31Å; A430-E464 HydrophobicContact CB-CB 3.89Å; A430-E464 HydrophobicContact CB-CG 4.18Å; A430-E464 WeakPolarHBondContact CB-O 3.49Å
431	P	94.9	Very high	95.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.5	-44.6	175.5	23.7	-33	0	0	0	111.3	K408 F433 A434 H435 E464	K408-P431 HydrophobicContact CB-CB 4.26Å; K408-P431 HydrophobicContact CB-CG 3.56Å; P431-F433 PolarHBondContact O-N 3.02Å; P431-F433 VanDerWaalsContact O-N 3.14Å; P431-A434 PolarHBondContact O-N 2.8Å; P431-A434 VanDerWaalsContact O-N 3.11Å; P431-H435 PolarHBondContact O-CD2 3.16Å; P431-H435 VanDerWaalsContact O-CD2 3.28Å; P431-H435 VanDerWaalsContact O-CG 3.22Å; P431-H435 PolarHBondContact O-N 2.85Å; P431-E464 WeakPolarHBondContact CD-OE2 3.33Å
432	G	93.9	Very high	95.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-27.4	-177.8	0	0	0	0	0	114.6	A430 L436 E464	A430-G432 VanDerWaalsContact C-N 3.34Å; G432-L436 VanDerWaalsContact O-CB 3.28Å; G432-L436 WeakPolarHBondContact O-CB 3.23Å; G432-L436 PolarHBondContact O-N 3.37Å; G432-E464 VanDerWaalsContact CA-OE1 3.26Å; G432-E464 WeakPolarHBondContact CA-OE1 3.45Å; G432-E464 PolarHBondContact N-OE1 3.22Å
433	F	95.7	Very high	95.1	Very high	102 Å²	102	33.6 Å²	33.6	45%	0.447	16%	0.161	S	C	.	.	H	α-helix	trans	-68.1	-44.8	176.3	-177	-93.5	0	0	0	111.9	I117 A430 P431 A437 V465	I117-F433 HydrophobicContact CD1-CD2 4.15Å; I117-F433 HydrophobicContact CD1-CE2 3.77Å; A430-F433 HydrophobicContact CB-CB 4.42Å; A430-F433 PolarHBondContact O-N 3.31Å; P431-F433 PolarHBondContact O-N 3.02Å; P431-F433 VanDerWaalsContact O-N 3.14Å; F433-A437 PolarHBondContact O-N 3.1Å; F433-A437 VanDerWaalsContact O-N 3.14Å; F433-V465 HydrophobicContact CD2-CG1 4.09Å
434	A	95.8	Very high	94.9	Very high	19 Å²	19	38 Å²	38	16%	0.157	18%	0.181	C	C	.	.	H	α-helix	trans	-68.9	-39.7	176.4	0	0	0	0	0	111	G291 F292 P431 A437 G438	G291-A434 WeakPolarHBondContact O-CB 3.41Å; F292-A434 WeakPolarHBondContact CE1-O 3.49Å; P431-A434 PolarHBondContact O-N 2.8Å; P431-A434 VanDerWaalsContact O-N 3.11Å; A434-A437 WeakPolarHBondContact O-CB 3.42Å; A434-A437 PolarHBondContact O-N 3.42Å; A434-G438 PolarHBondContact O-N 3.37Å
435	H	95.1	Very high	94.7	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-49.5	175.6	-62.5	175.7	0	0	0	111.4	F292 S293 K408 P431 A437 G438 L439 Q458	F292-H435 AromaticContact CD1-CD2 3.83Å; S293-H435 PolarHBondContact O-NE2 2.67Å; S293-H435 VanDerWaalsContact O-NE2 3.15Å; K408-H435 PolarHBondContact O-CE1 2.88Å; P431-H435 PolarHBondContact O-CD2 3.16Å; P431-H435 VanDerWaalsContact O-CD2 3.28Å; P431-H435 VanDerWaalsContact O-CG 3.22Å; P431-H435 PolarHBondContact O-N 2.85Å; H435-A437 VanDerWaalsContact C-N 3.3Å; H435-A437 PolarHBondContact O-N 2.79Å; H435-G438 PolarHBondContact O-N 3.39Å; H435-L439 PolarHBondContact O-N 3.42Å; H435-Q458 HydrophobicContact CB-CB 4.37Å; H435-Q458 HydrophobicContact CB-CG 4.49Å; H435-Q458 PolarHBondContact O-NE2 2.93Å
436	L	94.4	Very high	94.6	Very high	4 Å²	4	32 Å²	32	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-31.1	-179.5	-171.4	69.8	0	0	0	112.6	P115 I117 G432 G438 L439 I460 F462 V465	P115-L436 HydrophobicContact CB-CD1 4.12Å; P115-L436 HydrophobicContact CB-CD2 4.32Å; P115-L436 HydrophobicContact CB-CG 4.14Å; P115-L436 HydrophobicContact CG-CG 4.25Å; I117-L436 HydrophobicContact CG2-CD2 3.29Å; G432-L436 VanDerWaalsContact O-CB 3.28Å; G432-L436 WeakPolarHBondContact O-CB 3.23Å; G432-L436 PolarHBondContact O-N 3.37Å; L436-G438 PolarHBondContact O-N 3.05Å; L436-L439 HydrophobicContact CD1-CB 4.3Å; L436-L439 HydrophobicContact CD1-CD2 3.95Å; L436-L439 WeakPolarHBondContact O-CB 3.28Å; L436-L439 PolarHBondContact O-N 3.01Å; L436-I460 HydrophobicContact CD1-CD1 3.73Å; L436-F462 HydrophobicContact CD2-CE1 4.45Å; L436-V465 HydrophobicContact CD2-CG1 4Å
437	A	94.3	Very high	94.5	Very high	66 Å²	66	37 Å²	37	55%	0.545	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-29.6	172.3	0	0	0	0	0	112.5	F433 A434 H435	F433-A437 PolarHBondContact O-N 3.1Å; F433-A437 VanDerWaalsContact O-N 3.14Å; A434-A437 WeakPolarHBondContact O-CB 3.42Å; A434-A437 PolarHBondContact O-N 3.42Å; H435-A437 VanDerWaalsContact C-N 3.3Å; H435-A437 PolarHBondContact O-N 2.79Å
438	G	93.3	Very high	94.3	Very high	1 Å²	1	36 Å²	36	1%	0.01	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-1	174.4	0	0	0	0	0	115.1	A434 H435 L436 D440 K441 M442	A434-G438 PolarHBondContact O-N 3.37Å; H435-G438 PolarHBondContact O-N 3.39Å; L436-G438 PolarHBondContact O-N 3.05Å; G438-D440 VanDerWaalsContact C-N 3.33Å; G438-D440 PolarHBondContact O-N 3.07Å; G438-K441 PolarHBondContact O-N 3.48Å; G438-M442 VanDerWaalsContact O-CE 3.3Å; G438-M442 WeakPolarHBondContact O-CE 3.42Å; G438-M442 PolarHBondContact O-N 2.91Å
439	L	94.3	Very high	94.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.5	-44.7	-176.7	-174.1	77.6	0	0	0	112.2	L101 P115 H435 L436 K441 M442 A443 I454 I455	L101-L439 HydrophobicContact CD1-CD2 4.41Å; L101-L439 HydrophobicContact CD2-CD2 3.71Å; P115-L439 HydrophobicContact CB-CD2 4.32Å; P115-L439 HydrophobicContact CG-CD2 4.45Å; H435-L439 PolarHBondContact O-N 3.42Å; L436-L439 HydrophobicContact CD1-CB 4.3Å; L436-L439 HydrophobicContact CD1-CD2 3.95Å; L436-L439 WeakPolarHBondContact O-CB 3.28Å; L436-L439 PolarHBondContact O-N 3.01Å; L439-K441 VanDerWaalsContact C-N 3.34Å; L439-K441 PolarHBondContact O-N 3.08Å; L439-M442 PolarHBondContact O-N 2.84Å; L439-A443 VanDerWaalsContact O-CB 3.24Å; L439-A443 WeakPolarHBondContact O-CB 3.44Å; L439-A443 PolarHBondContact O-N 2.77Å; L439-I454 HydrophobicContact CD1-CG2 3.87Å; L439-I455 HydrophobicContact CD1-CG1 3.95Å
440	D	94.4	Very high	94	Very high	41 Å²	41	36 Å²	36	22%	0.219	21%	0.211	C	C	.	.	H	α-helix	trans	-56.5	-49	180	-177	44.2	0	0	0	111.4	K112 C113 G438 M442 A443 Q444	K112-D440 WeakPolarHBondContact CA-OD1 3.41Å; C113-D440 PolarHBondContact N-OD1 3.35Å; C113-D440 WeakPolarHBondContact O-CB 3.23Å; G438-D440 VanDerWaalsContact C-N 3.33Å; G438-D440 PolarHBondContact O-N 3.07Å; D440-M442 VanDerWaalsContact C-N 3.35Å; D440-M442 PolarHBondContact O-N 2.87Å; D440-A443 PolarHBondContact O-N 2.85Å; D440-Q444 VanDerWaalsContact O-CG 3.28Å; D440-Q444 WeakPolarHBondContact O-CG 3.45Å; D440-Q444 PolarHBondContact O-N 3.24Å; D440-Q444 PolarHBondContact OD2-NE2 2.97Å
441	K	93.6	Very high	94	Very high	76 Å²	76	36 Å²	36	33%	0.33	21%	0.211	S	C	.	.	H	α-helix	trans	-62.7	-39.5	180	-179	164.6	179.4	161.1	0	112.9	D286 Y290 G438 L439	D286-K441 VanDerWaalsContact CG-CE 3.4Å; D286-K441 IonicContact OD1-NZ 2.72Å; D286-K441 PolarHBondContact OD1-NZ 2.73Å; D286-K441 WeakPolarHBondContact OD2-CE 3.27Å; D286-K441 IonicContact OD2-NZ 3.15Å; D286-K441 PolarHBondContact OD2-NZ 3.45Å; Y290-K441 HydrophobicContact CD2-CD 4.41Å; Y290-K441 HydrophobicContact CE1-CB 4.31Å; Y290-K441 HydrophobicContact CE1-CD 4.27Å; Y290-K441 HydrophobicContact CE2-CD 3.52Å; Y290-K441 VanDerWaalsContact CZ-CD 3.44Å; Y290-K441 VanDerWaalsContact OH-CD 3.28Å; Y290-K441 WeakPolarHBondContact OH-CD 3.49Å; G438-K441 PolarHBondContact O-N 3.48Å; L439-K441 VanDerWaalsContact C-N 3.34Å; L439-K441 PolarHBondContact O-N 3.08Å
442	M	93.8	Very high	93.9	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.03	22%	0.219	C	C	.	.	H	α-helix	trans	-76.7	-24.3	178.2	-65.5	174.7	-66.3	0	0	113.1	V282 F292 M296 G438 L439 D440 H446 I454 Q458	V282-M442 HydrophobicContact CG2-CG 3.61Å; V282-M442 HydrophobicContact CG2-SD 3.61Å; F292-M442 HydrophobicContact CE2-SD 4.24Å; F292-M442 HydrophobicContact CZ-CE 4.16Å; F292-M442 HydrophobicContact CZ-SD 4.25Å; M296-M442 HydrophobicContact CE-SD 3.73Å; G438-M442 VanDerWaalsContact O-CE 3.3Å; G438-M442 WeakPolarHBondContact O-CE 3.42Å; G438-M442 PolarHBondContact O-N 2.91Å; L439-M442 PolarHBondContact O-N 2.84Å; D440-M442 VanDerWaalsContact C-N 3.35Å; D440-M442 PolarHBondContact O-N 2.87Å; M442-H446 PolarHBondContact O-CD2 2.89Å; M442-I454 HydrophobicContact CB-CD1 4.44Å; M442-I454 HydrophobicContact CB-CG2 4.01Å; M442-I454 HydrophobicContact CE-CG2 4.01Å; M442-I454 VanDerWaalsContact O-CD1 3.25Å; M442-I454 WeakPolarHBondContact O-CD1 3.38Å; M442-I454 HydrophobicContact SD-CG2 4.32Å; M442-Q458 HydrophobicContact CE-CG 4.35Å
443	A	93.5	Very high	94	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-86.8	-22	-178.5	0	0	0	0	0	112.9	V110 C113 L439 D440 G445 H446 V451 I454	V110-A443 HydrophobicContact CG1-CB 4.29Å; C113-A443 HydrophobicContact CB-CB 4.39Å; L439-A443 VanDerWaalsContact O-CB 3.24Å; L439-A443 WeakPolarHBondContact O-CB 3.44Å; L439-A443 PolarHBondContact O-N 2.77Å; D440-A443 PolarHBondContact O-N 2.85Å; A443-G445 PolarHBondContact O-N 2.91Å; A443-H446 WeakPolarHBondContact O-CB 3.47Å; A443-H446 PolarHBondContact O-N 3.16Å; A443-H446 VanDerWaalsContact O-N 3.1Å; A443-V451 HydrophobicContact CB-CG2 4.14Å; A443-I454 HydrophobicContact CB-CD1 4.44Å
444	Q	93.1	Very high	93.9	Very high	94 Å²	94	32.3 Å²	32.3	44%	0.439	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	126.8	179.7	-83.4	171.1	23	0	0	112.3	D440 H446	D440-Q444 VanDerWaalsContact O-CG 3.28Å; D440-Q444 WeakPolarHBondContact O-CG 3.45Å; D440-Q444 PolarHBondContact O-N 3.24Å; D440-Q444 PolarHBondContact OD2-NE2 2.97Å; Q444-H446 PolarHBondContact O-N 2.9Å
445	G	90.9	Very high	93.8	Very high	65 Å²	65	31.6 Å²	31.6	67%	0.67	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	-5.1	179.1	0	0	0	0	0	115	V110 A443	V110-G445 PolarHBondContact O-N 2.81Å; A443-G445 PolarHBondContact O-N 2.91Å
446	H	94.9	Very high	93.7	Very high	41 Å²	41	31.7 Å²	31.7	19%	0.19	19%	0.192	C	C	.	.	S	Bend	trans	-90	167.8	175.4	-71	-74.7	0	0	0	112.4	V110 G280 M442 A443 Q444 D450	V110-H446 WeakPolarHBondContact CB-O 3.39Å; V110-H446 WeakPolarHBondContact CG2-O 3.47Å; V110-H446 PolarHBondContact N-O 3.14Å; G280-H446 PolarHBondContact N-NE2 3.24Å; M442-H446 PolarHBondContact O-CD2 2.89Å; A443-H446 WeakPolarHBondContact O-CB 3.47Å; A443-H446 PolarHBondContact O-N 3.16Å; A443-H446 VanDerWaalsContact O-N 3.1Å; Q444-H446 PolarHBondContact O-N 2.9Å; H446-D450 HydrophobicContact CB-CB 3.98Å
447	M	94.6	Very high	93.6	Very high	103 Å²	103	31.6 Å²	31.6	51%	0.507	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-82.7	160	176.1	-58.2	-178.9	-163.4	0	0	111.1	E108 A449 D450 V451	E108-M447 WeakPolarHBondContact O-CA 3.11Å; M447-A449 PolarHBondContact O-N 3.29Å; M447-A449 VanDerWaalsContact O-N 3.16Å; M447-D450 PolarHBondContact N-OD2 3.4Å; M447-D450 WeakPolarHBondContact O-CB 3.45Å; M447-D450 PolarHBondContact O-N 3.04Å; M447-V451 PolarHBondContact O-N 3.06Å
448	L	91.9	Very high	93.5	Very high	69 Å²	69	28.5 Å²	28.5	36%	0.361	17%	0.166	S	C	.	.	H	α-helix	trans	-51	-40.4	175	-177.8	67.8	0	0	0	113.1	M103 E108 D450 V451	M103-L448 HydrophobicContact CE-CD1 3.21Å; M103-L448 HydrophobicContact SD-CD1 3.72Å; E108-L448 PolarHBondContact O-N 2.85Å; L448-D450 PolarHBondContact O-N 2.87Å; L448-V451 WeakPolarHBondContact O-CB 3.25Å; L448-V451 PolarHBondContact O-N 3.24Å
449	A	93	Very high	93.4	Very high	47 Å²	47	28.9 Å²	28.9	39%	0.388	17%	0.168	S	C	.	.	H	α-helix	trans	-68.8	-24	-179.8	0	0	0	0	0	112.9	R275 M447	R275-A449 PolarHBondContact NH2-O 2.93Å; M447-A449 PolarHBondContact O-N 3.29Å; M447-A449 VanDerWaalsContact O-N 3.16Å
450	D	94.7	Very high	93.2	Very high	15 Å²	15	29.4 Å²	29.4	8%	0.08	17%	0.17	C	C	.	.	H	α-helix	trans	-83.1	-27.1	-179.6	-57.9	-23	0	0	0	111	R275 I279 H446 M447 L448 V452 A453 I454	R275-D450 IonicContact CZ-OD1 2.61Å; R275-D450 IonicContact NH1-OD1 2.86Å; R275-D450 PolarHBondContact NH1-OD1 3.1Å; R275-D450 IonicContact NH2-OD1 3.15Å; I279-D450 HydrophobicContact CD1-CB 4.43Å; I279-D450 HydrophobicContact CG1-CB 4.45Å; I279-D450 HydrophobicContact CG2-CB 3.94Å; H446-D450 HydrophobicContact CB-CB 3.98Å; M447-D450 PolarHBondContact N-OD2 3.4Å; M447-D450 WeakPolarHBondContact O-CB 3.45Å; M447-D450 PolarHBondContact O-N 3.04Å; L448-D450 PolarHBondContact O-N 2.87Å; D450-V452 PolarHBondContact O-N 3.43Å; D450-A453 WeakPolarHBondContact O-CB 3.1Å; D450-A453 PolarHBondContact O-N 3.5Å; D450-I454 VanDerWaalsContact O-CG1 3.31Å; D450-I454 WeakPolarHBondContact O-CG1 3.43Å; D450-I454 PolarHBondContact O-N 2.98Å
451	V	93.5	Very high	93.1	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.024	16%	0.162	C	C	.	.	H	α-helix	trans	-56.2	-39.1	171.7	-178.6	0	0	0	0	110.9	L101 M103 V110 A443 M447 L448 I454 I455	L101-V451 HydrophobicContact CD1-CG1 4.35Å; M103-V451 HydrophobicContact SD-CG1 4.3Å; M103-V451 HydrophobicContact SD-CG2 4.42Å; V110-V451 HydrophobicContact CG2-CG2 3.71Å; A443-V451 HydrophobicContact CB-CG2 4.14Å; M447-V451 PolarHBondContact O-N 3.06Å; L448-V451 WeakPolarHBondContact O-CB 3.25Å; L448-V451 PolarHBondContact O-N 3.24Å; V451-I454 PolarHBondContact O-N 2.92Å; V451-I455 HydrophobicContact CG1-CD1 4.03Å; V451-I455 VanDerWaalsContact O-CG1 3.26Å; V451-I455 WeakPolarHBondContact O-CG1 3.44Å; V451-I455 PolarHBondContact O-N 3.16Å
452	V	93.4	Very high	93	Very high	26 Å²	26	24.4 Å²	24.4	16%	0.158	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-44.7	175.4	171.9	0	0	0	0	111.7	A94 D197 D450 I455 G456	A94-V452 HydrophobicContact CB-CB 4.4Å; A94-V452 HydrophobicContact CB-CG1 3.63Å; A94-V452 HydrophobicContact CB-CG2 3.96Å; D197-V452 HydrophobicContact CB-CG1 3.75Å; D450-V452 PolarHBondContact O-N 3.43Å; V452-I455 PolarHBondContact O-N 3.16Å; V452-G456 PolarHBondContact O-N 3.09Å; V452-G456 VanDerWaalsContact O-N 3.08Å
453	A	94.9	Very high	92.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-42.1	175.9	0	0	0	0	0	111.3	H194 I198 D450 I455 G456 T457	H194-A453 PolarHBondContact NE2-O 2.99Å; I198-A453 HydrophobicContact CD1-CB 4.12Å; I198-A453 HydrophobicContact CG1-CB 4.37Å; D450-A453 WeakPolarHBondContact O-CB 3.1Å; D450-A453 PolarHBondContact O-N 3.5Å; A453-I455 PolarHBondContact O-N 2.83Å; A453-G456 PolarHBondContact O-N 3.19Å; A453-T457 WeakPolarHBondContact O-CG2 3.37Å; A453-T457 PolarHBondContact O-N 2.87Å
454	I	95.1	Very high	92.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-49.5	177.1	-65.6	163.7	0	0	0	110.2	I279 L439 M442 A443 D450 V451 G456 T457 Q458	I279-I454 HydrophobicContact CG2-CD1 4.26Å; I279-I454 HydrophobicContact CG2-CG1 3.82Å; L439-I454 HydrophobicContact CD1-CG2 3.87Å; M442-I454 HydrophobicContact CB-CD1 4.44Å; M442-I454 HydrophobicContact CB-CG2 4.01Å; M442-I454 HydrophobicContact CE-CG2 4.01Å; M442-I454 VanDerWaalsContact O-CD1 3.25Å; M442-I454 WeakPolarHBondContact O-CD1 3.38Å; M442-I454 HydrophobicContact SD-CG2 4.32Å; A443-I454 HydrophobicContact CB-CD1 4.44Å; D450-I454 VanDerWaalsContact O-CG1 3.31Å; D450-I454 WeakPolarHBondContact O-CG1 3.43Å; D450-I454 PolarHBondContact O-N 2.98Å; V451-I454 PolarHBondContact O-N 2.92Å; I454-G456 VanDerWaalsContact C-N 3.35Å; I454-G456 PolarHBondContact O-N 3.28Å; I454-T457 PolarHBondContact O-N 2.86Å; I454-T457 VanDerWaalsContact O-N 3.16Å; I454-T457 PolarHBondContact O-OG1 3.47Å; I454-Q458 WeakPolarHBondContact O-CG 3.39Å; I454-Q458 PolarHBondContact O-N 3.36Å
455	I	93.5	Very high	92.6	Very high	4 Å²	4	20 Å²	20	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-56.7	-48.5	177.9	-67.3	163.1	0	0	0	110.9	L99 L101 L439 V451 V452 A453 T457 Q458 I460	L99-I455 HydrophobicContact CD2-CD1 4.44Å; L101-I455 HydrophobicContact CD1-CD1 3.62Å; L439-I455 HydrophobicContact CD1-CG1 3.95Å; V451-I455 HydrophobicContact CG1-CD1 4.03Å; V451-I455 VanDerWaalsContact O-CG1 3.26Å; V451-I455 WeakPolarHBondContact O-CG1 3.44Å; V451-I455 PolarHBondContact O-N 3.16Å; V452-I455 PolarHBondContact O-N 3.16Å; A453-I455 PolarHBondContact O-N 2.83Å; I455-T457 VanDerWaalsContact C-N 3.32Å; I455-T457 PolarHBondContact O-N 3.32Å; I455-Q458 PolarHBondContact O-N 2.95Å; I455-I460 HydrophobicContact CG2-CD1 4.21Å
456	G	91.9	Very high	92.5	Very high	4 Å²	4	17.2 Å²	17.2	4%	0.041	10%	0.097	C	C	.	.	H	α-helix	trans	-62.8	-37.1	178.9	0	0	0	0	0	112.8	V452 A453 I454 Q458 D459	V452-G456 PolarHBondContact O-N 3.09Å; V452-G456 VanDerWaalsContact O-N 3.08Å; A453-G456 PolarHBondContact O-N 3.19Å; I454-G456 VanDerWaalsContact C-N 3.35Å; I454-G456 PolarHBondContact O-N 3.28Å; G456-Q458 VanDerWaalsContact C-N 3.28Å; G456-Q458 PolarHBondContact O-N 3.09Å; G456-D459 PolarHBondContact O-N 3.5Å
457	T	93.8	Very high	91.9	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-71.9	-18.8	179.1	68.5	0	0	0	0	115	H194 C330 R333 R337 A453 I454 I455 D459	H194-T457 WeakPolarHBondContact NE2-CG2 3.5Å; C330-T457 HydrophobicContact CB-CG2 3.38Å; C330-T457 WeakPolarHBondContact SG-CG2 3.24Å; R333-T457 PolarHBondContact NH1-OG1 3.3Å; R337-T457 VanDerWaalsContact CZ-O 3.24Å; R337-T457 PolarHBondContact NH1-O 3.13Å; R337-T457 PolarHBondContact NH2-O 3.27Å; A453-T457 WeakPolarHBondContact O-CG2 3.37Å; A453-T457 PolarHBondContact O-N 2.87Å; I454-T457 PolarHBondContact O-N 2.86Å; I454-T457 VanDerWaalsContact O-N 3.16Å; I454-T457 PolarHBondContact O-OG1 3.47Å; I455-T457 VanDerWaalsContact C-N 3.32Å; I455-T457 PolarHBondContact O-N 3.32Å; T457-D459 VanDerWaalsContact C-N 3.29Å
458	Q	92.3	Very high	91.7	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-81.4	-14.1	174.4	-66.1	-171.3	-56	0	0	112.4	M296 H435 M442 I454 I455 G456 I460	M296-Q458 HydrophobicContact CE-CG 4.34Å; M296-Q458 HydrophobicContact SD-CG 4.22Å; H435-Q458 HydrophobicContact CB-CB 4.37Å; H435-Q458 HydrophobicContact CB-CG 4.49Å; H435-Q458 PolarHBondContact O-NE2 2.93Å; M442-Q458 HydrophobicContact CE-CG 4.35Å; I454-Q458 WeakPolarHBondContact O-CG 3.39Å; I454-Q458 PolarHBondContact O-N 3.36Å; I455-Q458 PolarHBondContact O-N 2.95Å; G456-Q458 VanDerWaalsContact C-N 3.28Å; G456-Q458 PolarHBondContact O-N 3.09Å; Q458-I460 HydrophobicContact CB-CD1 4.02Å; Q458-I460 HydrophobicContact CB-CG1 3.65Å
459	D	90.9	Very high	91.7	Very high	9 Å²	9	9.1 Å²	9.1	5%	0.048	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	61.6	-178.6	-176.5	25.9	0	0	0	111.9	N186 A190 K408 G456 T457	N186-D459 PolarHBondContact OD1-OD2 3.32Å; A190-D459 HydrophobicContact CB-CB 3.91Å; K408-D459 WeakPolarHBondContact CD-O 3.34Å; K408-D459 WeakPolarHBondContact CG-OD2 3.41Å; K408-D459 PolarHBondContact NZ-O 3.14Å; K408-D459 IonicContact NZ-OD1 2.81Å; K408-D459 PolarHBondContact NZ-OD1 3.37Å; K408-D459 IonicContact NZ-OD2 3.9Å; K408-D459 PolarHBondContact NZ-OD2 3.38Å; G456-D459 PolarHBondContact O-N 3.5Å; T457-D459 VanDerWaalsContact C-N 3.29Å
460	I	89.6	Confident	91.7	Very high	12 Å²	12	7 Å²	7	6%	0.062	4%	0.038	C	C	.	.			trans	-86.6	127.1	-172.4	-47.2	-178.8	0	0	0	110.5	L436 I455 Q458 F462 V465	L436-I460 HydrophobicContact CD1-CD1 3.73Å; I455-I460 HydrophobicContact CG2-CD1 4.21Å; Q458-I460 HydrophobicContact CB-CD1 4.02Å; Q458-I460 HydrophobicContact CB-CG1 3.65Å; I460-F462 HydrophobicContact CB-CZ 4.45Å; I460-F462 HydrophobicContact CG2-CD1 4.39Å; I460-F462 HydrophobicContact CG2-CE1 3.87Å; I460-F462 HydrophobicContact CG2-CE2 4.34Å; I460-F462 HydrophobicContact CG2-CZ 3.82Å; I460-V465 HydrophobicContact CG2-CG2 3.83Å
461	V	92.3	Very high	91.5	Very high	6 Å²	6	6.5 Å²	6.5	4%	0.036	4%	0.035	C	C	.	.			trans	-117.6	114.3	169	169.5	0	0	0	0	108.6	Y145 V146 K408 G463 E464 V465	Y145-V461 HydrophobicContact CD1-CG1 3.63Å; Y145-V461 HydrophobicContact CE1-CG1 3.25Å; Y145-V461 HydrophobicContact CE2-CG1 4.18Å; Y145-V461 HydrophobicContact CG-CG1 4.27Å; V146-V461 HydrophobicContact CG2-CG2 3.89Å; K408-V461 VanDerWaalsContact CE-CG2 3.5Å; K408-V461 VanDerWaalsContact NZ-CG2 3.34Å; V461-G463 PolarHBondContact O-N 3.21Å; V461-G463 VanDerWaalsContact O-N 3.07Å; V461-E464 HydrophobicContact CB-CG 4.39Å; V461-E464 WeakPolarHBondContact O-CG 3.37Å; V461-E464 PolarHBondContact O-N 3.42Å; V461-E464 VanDerWaalsContact O-N 3.1Å; V461-V465 PolarHBondContact O-N 3.21Å
462	F	90.9	Very high	91.4	Very high	5 Å²	5	6.7 Å²	6.7	2%	0.022	4%	0.036	C	C	.	.	H	α-helix	trans	-64.7	-19.2	-173.2	-66.8	-73.5	0	0	0	114.2	A95 L99 L436 I460 E464 V465 D466	A95-F462 WeakPolarHBondContact O-CE2 3.35Å; L99-F462 HydrophobicContact CB-CE1 3.9Å; L99-F462 HydrophobicContact CB-CE2 4.17Å; L99-F462 HydrophobicContact CB-CZ 3.58Å; L99-F462 HydrophobicContact CD1-CE1 3.78Å; L99-F462 HydrophobicContact CD1-CZ 4.16Å; L99-F462 HydrophobicContact CD2-CE1 4.35Å; L99-F462 HydrophobicContact CD2-CZ 3.92Å; L99-F462 HydrophobicContact CG-CE1 4.2Å; L99-F462 HydrophobicContact CG-CZ 4.08Å; L436-F462 HydrophobicContact CD2-CE1 4.45Å; I460-F462 HydrophobicContact CB-CZ 4.45Å; I460-F462 HydrophobicContact CG2-CD1 4.39Å; I460-F462 HydrophobicContact CG2-CE1 3.87Å; I460-F462 HydrophobicContact CG2-CE2 4.34Å; I460-F462 HydrophobicContact CG2-CZ 3.82Å; F462-E464 VanDerWaalsContact C-N 3.28Å; F462-E464 PolarHBondContact O-N 3.17Å; F462-V465 PolarHBondContact O-N 3.11Å; F462-D466 WeakPolarHBondContact O-CB 3.32Å; F462-D466 PolarHBondContact O-N 2.94Å
463	G	89.1	Confident	91.2	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.01	3%	0.028	C	C	.	.	H	α-helix	trans	-63.7	-29.1	174.3	0	0	0	0	0	114.4	L143 V461	L143-G463 CarbonylContact O-C 3.53Å; L143-G463 WeakPolarHBondContact O-CA 3.39Å; V461-G463 PolarHBondContact O-N 3.21Å; V461-G463 VanDerWaalsContact O-N 3.07Å
464	E	91.1	Very high	91	Very high	1 Å²	1	5.8 Å²	5.8	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-92.8	-22.1	173.8	62.9	153.9	-157.9	0	0	113.3	L143 D144 K408 A430 P431 G432 V461 F462 R467	L143-E464 PolarHBondContact O-N 3.27Å; D144-E464 HydrophobicContact CB-CB 4.24Å; D144-E464 HydrophobicContact CB-CG 4.38Å; K408-E464 WeakPolarHBondContact CD-OE1 3.47Å; A430-E464 HydrophobicContact CB-CB 3.89Å; A430-E464 HydrophobicContact CB-CG 4.18Å; A430-E464 WeakPolarHBondContact CB-O 3.49Å; P431-E464 WeakPolarHBondContact CD-OE2 3.33Å; G432-E464 VanDerWaalsContact CA-OE1 3.26Å; G432-E464 WeakPolarHBondContact CA-OE1 3.45Å; G432-E464 PolarHBondContact N-OE1 3.22Å; V461-E464 HydrophobicContact CB-CG 4.39Å; V461-E464 WeakPolarHBondContact O-CG 3.37Å; V461-E464 PolarHBondContact O-N 3.42Å; V461-E464 VanDerWaalsContact O-N 3.1Å; F462-E464 VanDerWaalsContact C-N 3.28Å; F462-E464 PolarHBondContact O-N 3.17Å; E464-R467 WeakPolarHBondContact O-CD 3.32Å; E464-R467 VanDerWaalsContact O-CG 3.28Å; E464-R467 WeakPolarHBondContact O-CG 3.38Å; E464-R467 PolarHBondContact O-NE 3.37Å
465	V	92.3	Very high	90.6	Very high	5 Å²	5	6.2 Å²	6.2	3%	0.03	3%	0.032	C	C	.	.	H	α-helix	trans	-73	-49.5	175.2	179.6	0	0	0	0	109.5	I117 F433 L436 I460 V461 F462	I117-V465 HydrophobicContact CB-CG1 4.42Å; I117-V465 HydrophobicContact CD1-CG1 3.82Å; I117-V465 HydrophobicContact CG2-CG1 4.15Å; F433-V465 HydrophobicContact CD2-CG1 4.09Å; L436-V465 HydrophobicContact CD2-CG1 4Å; I460-V465 HydrophobicContact CG2-CG2 3.83Å; V461-V465 PolarHBondContact O-N 3.21Å; F462-V465 PolarHBondContact O-N 3.11Å
466	D	87.9	Confident	90.4	Very high	7 Å²	7	6.4 Å²	6.4	4%	0.037	3%	0.033	C	C	.	.			trans	-97.7	98.3	-175.9	-69.6	-13.3	0	0	0	111.1	I117 G118 L119 L120 H121 F462	I117-D466 WeakPolarHBondContact CB-OD1 3.47Å; G118-D466 VanDerWaalsContact CA-CG 3.46Å; G118-D466 WeakPolarHBondContact CA-OD1 3.29Å; G118-D466 VanDerWaalsContact CA-OD2 3.24Å; G118-D466 WeakPolarHBondContact CA-OD2 3.42Å; G118-D466 PolarHBondContact N-OD1 3.22Å; G118-D466 PolarHBondContact N-OD2 3.09Å; L119-D466 PolarHBondContact N-OD2 3.24Å; L119-D466 VanDerWaalsContact N-OD2 3.16Å; L120-D466 HydrophobicContact CB-CB 4.16Å; L120-D466 PolarHBondContact N-OD2 3.36Å; H121-D466 HydrophobicContact CB-CB 4.23Å; F462-D466 WeakPolarHBondContact O-CB 3.32Å; F462-D466 PolarHBondContact O-N 2.94Å
467	R	82.8	Confident	90.3	Very high	25 Å²	25	6.6 Å²	6.6	9%	0.094	3%	0.032	C	C	.	.			trans	-122.3	0	-169.4	-65.4	173.2	-74.6	-165.2	-11.7	114.2	H121 G123 T124 L143 I428 E464	H121-R467 VanDerWaalsContact CE1-C 3.43Å; H121-R467 PolarHBondContact CE1-O 3.25Å; H121-R467 PolarHBondContact ND1-O 3.16Å; G123-R467 PolarHBondContact N-OXT 3.1Å; T124-R467 WeakPolarHBondContact CB-OXT 3.29Å; T124-R467 PolarHBondContact N-OXT 3Å; T124-R467 PolarHBondContact OG1-OXT 3.33Å; L143-R467 HydrophobicContact CD2-CG 3.9Å; I428-R467 VanDerWaalsContact CG2-NH1 3.32Å; I428-R467 VanDerWaalsContact O-CZ 3.31Å; I428-R467 PolarHBondContact O-NH1 3.14Å; E464-R467 WeakPolarHBondContact O-CD 3.32Å; E464-R467 VanDerWaalsContact O-CG 3.28Å; E464-R467 WeakPolarHBondContact O-CG 3.38Å; E464-R467 PolarHBondContact O-NE 3.37Å

Retrieved 467 of 467 residues in 195.9 ms (Link to these results)

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