A0A096N040_PAPAN Loading...

Erlin

Component of the ERLIN1/ERLIN2 complex which mediates the endoplasmic reticulum-associated degradation (ERAD) of inositol 1,4,5-trisphosphate receptors (IP3Rs) such as ITPR1. Promotes sterol-accelerated ERAD of HMGCR probably implicating an AMFR/gp78-containing ubiquitin ligase complex. Involved in regulation of cellular cholesterol homeostasis by regulation the SREBP signaling pathway. May promote ER retention of the SCAP-SREBF complex. Mediates the endoplasmic reticulum-associated degradation (ERAD) of inositol 1,4,5-trisphosphate receptors (IP3Rs). Involved in regulation of cellular cholesterol homeostasis by regulation the SREBP signaling pathway.

AlphaFold DB (A0A2K6LPQ6), UniProt , Accession A0A096N040, Species PAPAN (Papio anubis, Olive baboon), Gene ERLIN2, Length 380 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	41.3	Very low	34.9	Very low	241 Å²	241	174.8 Å²	174.8	100%	1.187	85%	0.845	S	S	*	*				0	83.5	0	-73.1	166.3	154.4	0	0	107.1
2	A	37.3	Very low	34.3	Very low	106 Å²	106	168.6 Å²	168.6	88%	0.876	83%	0.833	S	S	*	*				65.8	123.2	101	0	0	0	0	0	112.9
3	S	31.4	Very low	34	Very low	112 Å²	112	174.2 Å²	174.2	78%	0.783	84%	0.839	S	S	*	*			cis	-168.9	116.6	-18.2	-178.1	0	0	0	0	105
4	S	37.3	Very low	33.8	Very low	113 Å²	113	168.9 Å²	168.9	79%	0.79	84%	0.838	S	S	*	*			trans	-94	140.4	160.2	95.2	0	0	0	0	108
5	K	37.6	Very low	33.7	Very low	159 Å²	159	170.9 Å²	170.9	69%	0.691	85%	0.845	S	S	*	*			trans	166.1	146.4	166.6	-96.7	160.4	-176.1	-176.9	0	106.9
6	R	34.1	Very low	33.5	Very low	207 Å²	207	164.6 Å²	164.6	78%	0.781	84%	0.837	S	S	*	*			cis	-174.9	149.1	-2	-120.8	173.1	-163.5	-176.1	0.3	104.9
7	R	36.6	Very low	33.3	Very low	229 Å²	229	162.9 Å²	162.9	86%	0.864	84%	0.841	S	S	*	*			trans	-60.8	160.4	157.2	-75.2	-179.6	176.2	-179.2	-1.5	110.4
8	P	37	Very low	33.1	Very low	132 Å²	132	163.6 Å²	163.6	86%	0.857	85%	0.847	S	S	*	*				-141.6	165.6	113	29.8	-11.4	0	0	0	115.4
9	R	30.6	Very low	33	Very low	209 Å²	209	158.8 Å²	158.8	79%	0.789	84%	0.842	S	S	*	*			trans	-96.2	150.4	178.7	-107.7	-179.6	172.8	179.2	-1.6	111.2
10	R	31.9	Very low	32.8	Very low	218 Å²	218	160.4 Å²	160.4	82%	0.823	84%	0.841	S	S	*	*			trans	61.5	125.9	145.4	-76.1	-176.4	169.3	-178.6	-4.1	119.8
11	K	29.2	Very low	32.8	Very low	197 Å²	197	159.3 Å²	159.3	86%	0.857	84%	0.836	S	S	*	*				-179.8	136.8	105.6	-107.7	178	177.2	-179.8	0	113.9
12	S	27.9	Very low	32.4	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	81%	0.809	S	S	*	*			trans	42.5	125.8	142.8	62.2	0	0	0	0	121.8
13	R	30	Very low	32.2	Very low	241 Å²	241	158 Å²	158	91%	0.909	81%	0.811	S	S	*	*				-172.9	134.1	95.6	-118.6	175.7	174.4	170.3	-3.3	110.2
14	A	30.4	Very low	32.4	Very low	100 Å²	100	155.9 Å²	155.9	83%	0.826	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.7	133.6	168.2	0	0	0	0	0	108.8
15	E	33.4	Very low	32.5	Very low	200 Å²	200	159 Å²	159	94%	0.935	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-96.1	125.3	165.8	-76.4	179.8	152.3	0	0	108.2
16	G	29.9	Very low	32.9	Very low	70 Å²	70	154.7 Å²	154.7	72%	0.722	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-103.9	147.1	161.9	0	0	0	0	0	109.3
17	C	30.1	Very low	33.4	Very low	135 Å²	135	156.7 Å²	156.7	91%	0.912	82%	0.822	S	S	*	*			trans	-173.1	104.4	141.3	-104.3	0	0	0	0	108.3
18	D	29.7	Very low	33.7	Very low	175 Å²	175	152.1 Å²	152.1	94%	0.936	82%	0.82	S	S	*	*			trans	-70.4	146.9	155.4	-82.6	-47.4	0	0	0	109.6
19	G	31.3	Very low	34	Very low	73 Å²	73	156.3 Å²	156.3	75%	0.753	82%	0.818	S	S	*	*			trans	167.9	76.7	169.5	0	0	0	0	0	117.5
20	F	29.8	Very low	34.6	Very low	190 Å²	190	151.3 Å²	151.3	83%	0.833	82%	0.815	S	S	*	*			trans	54.7	116.3	132.3	-106.7	-116.5	0	0	0	122.1
21	L	32.2	Very low	35.1	Very low	138 Å²	138	144.9 Å²	144.9	72%	0.723	81%	0.809	S	S	*	*				46.8	117.6	128.3	-90.8	127	0	0	0	119.6
22	A	33.8	Very low	35.8	Very low	77 Å²	77	139.7 Å²	139.7	64%	0.636	80%	0.796	S	S	*	*				163.2	138.3	90.2	0	0	0	0	0	112.4
23	R	33.1	Very low	36.4	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	80%	0.796	S	S	*	*			trans	51.3	122.8	138.9	-66.4	178.4	-176.9	-170.3	0.6	119.4
24	G	34.8	Very low	37.1	Very low	67 Å²	67	137.9 Å²	137.9	69%	0.691	78%	0.783	S	S	*	*			trans	125.3	134.7	134.2	0	0	0	0	0	114
25	L	40	Very low	37.8	Very low	178 Å²	178	137.3 Å²	137.3	93%	0.932	77%	0.773	S	S	*	*			trans	75.4	84.3	165	-51.1	163.9	0	0	0	112.3
26	G	45.8	Very low	38.5	Very low	69 Å²	69	134 Å²	134	71%	0.711	76%	0.761	S	S	*	*			cis	65.4	97.9	47.1	0	0	0	0	0	108.9
27	R	43.2	Very low	39.4	Very low	250 Å²	250	136.7 Å²	136.7	94%	0.943	76%	0.758	S	S	*	*	S	Bend	trans	87.9	43.8	158.8	-145.6	-179.9	-105.4	-173.4	-6.4	119.2
28	V	44.1	Very low	40.4	Very low	133 Å²	133	137.5 Å²	137.5	81%	0.806	75%	0.747	S	S	*	*	S	Bend	trans	-138.3	5	152.5	-169.1	0	0	0	0	112.7
29	R	42.8	Very low	41.6	Very low	220 Å²	220	131.2 Å²	131.2	83%	0.83	72%	0.723	S	S	*	*	S	Bend	trans	-95.8	-3.6	-170.3	-109.3	178.3	176.6	175.7	-0.8	116.7
30	S	42.3	Very low	42.9	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	71%	0.708	S	S	*	*	S	Bend	trans	-95.6	-21.9	178.2	71.5	0	0	0	0	114.5
31	A	43.1	Very low	44.2	Very low	84 Å²	84	126.9 Å²	126.9	69%	0.694	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-18.6	178.7	0	0	0	0	0	113.9
32	C	43.4	Very low	45.8	Very low	87 Å²	87	126.9 Å²	126.9	59%	0.588	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-15.7	-179	-117.4	0	0	0	0	114
33	R	42	Very low	47.5	Very low	185 Å²	185	126.3 Å²	126.3	70%	0.698	69%	0.689	S	S	*	*	H	α-helix	trans	-86.8	-30.1	-177.9	-153.4	172.2	-87.3	-147.5	-5	112.6	S35	R33-S35 VanDerWaalsContact C-N 3.35Å
34	D	44	Very low	49.4	Very low	119 Å²	119	120.9 Å²	120.9	64%	0.636	67%	0.674	S	S	*	*	H	α-helix	trans	-79.9	-14.7	174.1	-69.2	-17.2	0	0	0	114
35	S	44.2	Very low	51.4	Low	87 Å²	87	122.4 Å²	122.4	61%	0.608	67%	0.665	S	S	*	*	H	α-helix	trans	-87.9	-25.9	177.4	-149	0	0	0	0	112.6	R33 G39	R33-S35 VanDerWaalsContact C-N 3.35Å; S35-G39 PolarHBondContact O-N 2.89Å
36	L	48.7	Very low	53.4	Low	131 Å²	131	115.8 Å²	115.8	69%	0.686	64%	0.641	S	S	*	*	H	α-helix	trans	-80.7	-31.5	-179.5	-94.1	154.1	0	0	0	113.6	S40	L36-S40 PolarHBondContact O-N 3.39Å
37	D	49.4	Very low	55.1	Low	126 Å²	126	115.1 Å²	115.1	67%	0.674	63%	0.628	S	S	*	*	H	α-helix	trans	-77.5	-33.4	175.6	-94.9	-26.8	0	0	0	113.1	G39 L41	D37-G39 VanDerWaalsContact C-N 3.33Å; D37-L41 PolarHBondContact O-N 3.21Å
38	K	51	Low	57.1	Low	153 Å²	153	108 Å²	108	67%	0.665	61%	0.613	S	S	*	*	H	α-helix	trans	-68.6	-32.3	173.7	-72.8	179.1	-178.4	174.9	0	112.3	M42	K38-M42 WeakPolarHBondContact O-CB 3.44Å; K38-M42 WeakPolarHBondContact O-CG 3.47Å; K38-M42 PolarHBondContact O-N 3.35Å; K38-M42 VanDerWaalsContact O-N 3.09Å
39	G	53.8	Low	59.1	Low	42 Å²	42	106 Å²	106	43%	0.433	60%	0.601	S	S	.	*	H	α-helix	trans	-67.6	-39.3	175.9	0	0	0	0	0	113.5	S35 D37 A43	S35-G39 PolarHBondContact O-N 2.89Å; D37-G39 VanDerWaalsContact C-N 3.33Å; G39-A43 VanDerWaalsContact O-CB 3.23Å; G39-A43 WeakPolarHBondContact O-CB 3.47Å; G39-A43 PolarHBondContact O-N 3.23Å
40	S	58.8	Low	61.2	Low	64 Å²	64	98.1 Å²	98.1	45%	0.448	58%	0.582	S	S	.	*	H	α-helix	trans	-68.7	-43.7	177.4	-173.8	0	0	0	0	112.3	L36 A43 Q44	L36-S40 PolarHBondContact O-N 3.39Å; S40-A43 PolarHBondContact O-N 3.42Å; S40-Q44 WeakPolarHBondContact O-CG 3.19Å; S40-Q44 PolarHBondContact O-N 2.89Å
41	L	58.1	Low	63.4	Low	108 Å²	108	97.9 Å²	97.9	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-64.2	-43.6	176.8	-164.1	80.7	0	0	0	111.7	D37 Q44 L45	D37-L41 PolarHBondContact O-N 3.21Å; L41-Q44 PolarHBondContact O-N 2.78Å; L41-L45 HydrophobicContact CD2-CD1 4.48Å; L41-L45 HydrophobicContact CG-CD1 4.04Å; L41-L45 WeakPolarHBondContact O-CB 3.34Å; L41-L45 WeakPolarHBondContact O-CD1 3.34Å; L41-L45 PolarHBondContact O-N 3.36Å
42	M	65.6	Low	65.5	Low	139 Å²	139	96.6 Å²	96.6	69%	0.685	57%	0.566	S	S	*	*	H	α-helix	trans	-67.4	-35	176.4	-70.8	-67.2	-173.3	0	0	112.5	K38 G46	K38-M42 WeakPolarHBondContact O-CB 3.44Å; K38-M42 WeakPolarHBondContact O-CG 3.47Å; K38-M42 PolarHBondContact O-N 3.35Å; K38-M42 VanDerWaalsContact O-N 3.09Å; M42-G46 PolarHBondContact O-N 3.09Å
43	A	69.7	Low	67.5	Low	64 Å²	64	95.3 Å²	95.3	53%	0.529	56%	0.558	S	S	.	*	H	α-helix	trans	-68.3	-38.2	174.2	0	0	0	0	0	112.3	G39 S40 A47	G39-A43 VanDerWaalsContact O-CB 3.23Å; G39-A43 WeakPolarHBondContact O-CB 3.47Å; G39-A43 PolarHBondContact O-N 3.23Å; S40-A43 PolarHBondContact O-N 3.42Å; A43-A47 WeakPolarHBondContact O-CB 3.47Å; A43-A47 PolarHBondContact O-N 3.45Å
44	Q	72.6	Confident	69.5	Low	129 Å²	129	89.8 Å²	89.8	60%	0.603	55%	0.547	S	S	*	.	H	α-helix	trans	-70.4	-42.7	175	-72.7	-164.5	-16.5	0	0	112.6	S40 L41 G46 A47 V48	S40-Q44 WeakPolarHBondContact O-CG 3.19Å; S40-Q44 PolarHBondContact O-N 2.89Å; L41-Q44 PolarHBondContact O-N 2.78Å; Q44-G46 VanDerWaalsContact C-N 3.34Å; Q44-A47 PolarHBondContact O-N 3.06Å; Q44-V48 VanDerWaalsContact O-CG2 3.32Å; Q44-V48 WeakPolarHBondContact O-CG2 3.41Å; Q44-V48 PolarHBondContact O-N 3.28Å
45	L	76.3	Confident	71.5	Confident	99 Å²	99	90.5 Å²	90.5	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-62.4	-41.4	171.9	-95.2	127.2	0	0	0	111.7	L41 A47 V48 V49	L41-L45 HydrophobicContact CD2-CD1 4.48Å; L41-L45 HydrophobicContact CG-CD1 4.04Å; L41-L45 WeakPolarHBondContact O-CB 3.34Å; L41-L45 WeakPolarHBondContact O-CD1 3.34Å; L41-L45 PolarHBondContact O-N 3.36Å; L45-A47 PolarHBondContact O-N 3.24Å; L45-V48 PolarHBondContact O-N 3.43Å; L45-V49 WeakPolarHBondContact O-CB 3.35Å; L45-V49 VanDerWaalsContact O-CG2 3.24Å; L45-V49 WeakPolarHBondContact O-CG2 3.26Å; L45-V49 PolarHBondContact O-N 2.84Å
46	G	81.6	Confident	73.4	Confident	40 Å²	40	91.4 Å²	91.4	41%	0.412	54%	0.543	S	S	.	.	H	α-helix	trans	-60.8	-41.8	174.3	0	0	0	0	0	112.6	M42 Q44 A50	M42-G46 PolarHBondContact O-N 3.09Å; Q44-G46 VanDerWaalsContact C-N 3.34Å; G46-A50 VanDerWaalsContact O-CB 3.27Å; G46-A50 WeakPolarHBondContact O-CB 3.47Å; G46-A50 PolarHBondContact O-N 3.09Å
47	A	82.7	Confident	75.1	Confident	55 Å²	55	88.3 Å²	88.3	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-65.6	-43.5	175.5	0	0	0	0	0	112.3	A43 Q44 L45 A50 V51	A43-A47 WeakPolarHBondContact O-CB 3.47Å; A43-A47 PolarHBondContact O-N 3.45Å; Q44-A47 PolarHBondContact O-N 3.06Å; L45-A47 PolarHBondContact O-N 3.24Å; A47-A50 PolarHBondContact O-N 3.16Å; A47-V51 VanDerWaalsContact O-CG2 3.27Å; A47-V51 WeakPolarHBondContact O-CG2 3.35Å; A47-V51 PolarHBondContact O-N 3.08Å
48	V	85.4	Confident	76.7	Confident	101 Å²	101	84.8 Å²	84.8	61%	0.612	52%	0.519	S	S	*	.	H	α-helix	trans	-64.5	-42.2	177.2	173.3	0	0	0	0	111.3	Q44 L45 V51 A52	Q44-V48 VanDerWaalsContact O-CG2 3.32Å; Q44-V48 WeakPolarHBondContact O-CG2 3.41Å; Q44-V48 PolarHBondContact O-N 3.28Å; L45-V48 PolarHBondContact O-N 3.43Å; V48-V51 PolarHBondContact O-N 3.36Å; V48-A52 VanDerWaalsContact O-CB 3.31Å; V48-A52 WeakPolarHBondContact O-CB 3.3Å; V48-A52 PolarHBondContact O-N 3.44Å
49	V	86.3	Confident	78.1	Confident	91 Å²	91	78.5 Å²	78.5	55%	0.552	50%	0.495	S	S	*	.	H	α-helix	trans	-66.4	-38.5	176.3	172.2	0	0	0	0	111.3	L45 A52 S53	L45-V49 WeakPolarHBondContact O-CB 3.35Å; L45-V49 VanDerWaalsContact O-CG2 3.24Å; L45-V49 WeakPolarHBondContact O-CG2 3.26Å; L45-V49 PolarHBondContact O-N 2.84Å; V49-A52 PolarHBondContact O-N 2.96Å; V49-S53 VanDerWaalsContact O-CB 3.27Å; V49-S53 WeakPolarHBondContact O-CB 3.47Å; V49-S53 PolarHBondContact O-N 2.89Å; V49-S53 PolarHBondContact O-OG 3.48Å
50	A	86.7	Confident	79.5	Confident	54 Å²	54	81.5 Å²	81.5	45%	0.446	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-37.6	175.4	0	0	0	0	0	112.5	G46 A47 S53 S54	G46-A50 VanDerWaalsContact O-CB 3.27Å; G46-A50 WeakPolarHBondContact O-CB 3.47Å; G46-A50 PolarHBondContact O-N 3.09Å; A47-A50 PolarHBondContact O-N 3.16Å; A50-S53 WeakPolarHBondContact CA-OG 3.36Å; A50-S53 PolarHBondContact O-OG 3.33Å; A50-S53 VanDerWaalsContact O-OG 3.13Å; A50-S54 VanDerWaalsContact O-CB 3.28Å; A50-S54 WeakPolarHBondContact O-CB 3.44Å; A50-S54 PolarHBondContact O-N 2.87Å; A50-S54 PolarHBondContact O-OG 3.46Å
51	V	87.9	Confident	80.5	Confident	97 Å²	97	86.6 Å²	86.6	59%	0.588	52%	0.515	S	S	*	.	H	α-helix	trans	-70	-42.9	174.7	173.9	0	0	0	0	110.9	A47 V48 S54 F55	A47-V51 VanDerWaalsContact O-CG2 3.27Å; A47-V51 WeakPolarHBondContact O-CG2 3.35Å; A47-V51 PolarHBondContact O-N 3.08Å; V48-V51 PolarHBondContact O-N 3.36Å; V51-S54 WeakPolarHBondContact CA-OG 3.44Å; V51-S54 PolarHBondContact O-OG 3.4Å; V51-F55 VanDerWaalsContact O-CB 3.27Å; V51-F55 WeakPolarHBondContact O-CB 3.2Å; V51-F55 PolarHBondContact O-N 3.22Å
52	A	86.5	Confident	81.7	Confident	58 Å²	58	84.8 Å²	84.8	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-41.9	176.9	0	0	0	0	0	112.1	V48 V49 F55 L56	V48-A52 VanDerWaalsContact O-CB 3.31Å; V48-A52 WeakPolarHBondContact O-CB 3.3Å; V48-A52 PolarHBondContact O-N 3.44Å; V49-A52 PolarHBondContact O-N 2.96Å; A52-F55 PolarHBondContact O-N 3.48Å; A52-L56 WeakPolarHBondContact O-CB 3.34Å; A52-L56 PolarHBondContact O-N 2.88Å
53	S	85.4	Confident	82.6	Confident	60 Å²	60	78.7 Å²	78.7	42%	0.42	48%	0.483	S	S	.	.	H	α-helix	trans	-70.4	-40.1	178.7	66.5	0	0	0	0	112.2	V49 A50 L56 C57	V49-S53 VanDerWaalsContact O-CB 3.27Å; V49-S53 WeakPolarHBondContact O-CB 3.47Å; V49-S53 PolarHBondContact O-N 2.89Å; V49-S53 PolarHBondContact O-OG 3.48Å; A50-S53 WeakPolarHBondContact CA-OG 3.36Å; A50-S53 PolarHBondContact O-OG 3.33Å; A50-S53 VanDerWaalsContact O-OG 3.13Å; S53-L56 PolarHBondContact O-N 3.38Å; S53-C57 WeakPolarHBondContact O-CB 3.27Å; S53-C57 PolarHBondContact O-N 3.4Å; S53-C57 PolarHBondContact O-SG 3.42Å
54	S	85	Confident	83.6	Confident	69 Å²	69	79 Å²	79	48%	0.483	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-39.7	173.9	55.6	0	0	0	0	112.2	A50 V51 A58	A50-S54 VanDerWaalsContact O-CB 3.28Å; A50-S54 WeakPolarHBondContact O-CB 3.44Å; A50-S54 PolarHBondContact O-N 2.87Å; A50-S54 PolarHBondContact O-OG 3.46Å; V51-S54 WeakPolarHBondContact CA-OG 3.44Å; V51-S54 PolarHBondContact O-OG 3.4Å; S54-A58 VanDerWaalsContact O-CB 3.25Å; S54-A58 WeakPolarHBondContact O-CB 3.35Å; S54-A58 PolarHBondContact O-N 3.39Å
55	F	85.7	Confident	84.5	Confident	133 Å²	133	73.3 Å²	73.3	58%	0.583	45%	0.451	S	S	*	.	H	α-helix	trans	-64.3	-43.7	173.4	-174.2	-99.4	0	0	0	112.1	V51 A52 A58 S59 F96	V51-F55 VanDerWaalsContact O-CB 3.27Å; V51-F55 WeakPolarHBondContact O-CB 3.2Å; V51-F55 PolarHBondContact O-N 3.22Å; A52-F55 PolarHBondContact O-N 3.48Å; F55-A58 PolarHBondContact O-N 3.42Å; F55-S59 WeakPolarHBondContact O-CB 3.32Å; F55-S59 PolarHBondContact O-N 3.35Å; F55-F96 HydrophobicContact CZ-CE2 4.46Å; F55-F96 HydrophobicContact CZ-CZ 4.11Å
56	L	83.8	Confident	85.3	Confident	107 Å²	107	74.5 Å²	74.5	56%	0.56	45%	0.452	S	S	*	.	H	α-helix	trans	-62.6	-48.5	177.1	-159.5	101.4	0	0	0	110.9	A52 S53 A58 S59 L60	A52-L56 WeakPolarHBondContact O-CB 3.34Å; A52-L56 PolarHBondContact O-N 2.88Å; S53-L56 PolarHBondContact O-N 3.38Å; L56-A58 PolarHBondContact O-N 2.82Å; L56-S59 PolarHBondContact O-N 3.5Å; L56-S59 PolarHBondContact O-OG 2.92Å; L56-L60 HydrophobicContact CD2-CD1 4.36Å; L56-L60 WeakPolarHBondContact O-CG 3.35Å; L56-L60 PolarHBondContact O-N 2.84Å
57	C	84.1	Confident	85.9	Confident	66 Å²	66	72.7 Å²	72.7	45%	0.446	43%	0.433	S	S	.	.	H	α-helix	trans	-58.8	-46.5	175.4	-73.2	0	0	0	0	111.5	S53 S59 L60 F61	S53-C57 WeakPolarHBondContact O-CB 3.27Å; S53-C57 PolarHBondContact O-N 3.4Å; S53-C57 PolarHBondContact O-SG 3.42Å; C57-S59 VanDerWaalsContact C-N 3.29Å; C57-S59 PolarHBondContact O-N 2.87Å; C57-L60 PolarHBondContact O-N 2.88Å; C57-F61 WeakPolarHBondContact O-CD2 3.35Å; C57-F61 PolarHBondContact O-N 3.38Å
58	A	83.6	Confident	86.5	Confident	51 Å²	51	76 Å²	76	42%	0.421	44%	0.439	S	S	.	.	H	α-helix	trans	-60.5	-38.3	177.1	0	0	0	0	0	112.5	S54 F55 L56 S62	S54-A58 VanDerWaalsContact O-CB 3.25Å; S54-A58 WeakPolarHBondContact O-CB 3.35Å; S54-A58 PolarHBondContact O-N 3.39Å; F55-A58 PolarHBondContact O-N 3.42Å; L56-A58 PolarHBondContact O-N 2.82Å; A58-S62 WeakPolarHBondContact O-CB 3.39Å; A58-S62 PolarHBondContact O-N 2.91Å; A58-S62 PolarHBondContact O-OG 3.3Å
59	S	81.2	Confident	86.8	Confident	22 Å²	22	78.5 Å²	78.5	15%	0.154	44%	0.444	C	S	.	.	H	α-helix	trans	-66.7	-37.2	176.4	76.6	0	0	0	0	112.7	F55 L56 C57 S62 A63	F55-S59 WeakPolarHBondContact O-CB 3.32Å; F55-S59 PolarHBondContact O-N 3.35Å; L56-S59 PolarHBondContact O-N 3.5Å; L56-S59 PolarHBondContact O-OG 2.92Å; C57-S59 VanDerWaalsContact C-N 3.29Å; C57-S59 PolarHBondContact O-N 2.87Å; S59-S62 PolarHBondContact O-N 3.33Å; S59-A63 PolarHBondContact O-N 2.96Å
60	L	82.1	Confident	87.1	Confident	105 Å²	105	75 Å²	75	55%	0.55	43%	0.426	S	S	.	.	H	α-helix	trans	-71.6	-39.9	177.2	-68.1	172.5	0	0	0	111.9	L56 C57 S62 A63	L56-L60 HydrophobicContact CD2-CD1 4.36Å; L56-L60 WeakPolarHBondContact O-CG 3.35Å; L56-L60 PolarHBondContact O-N 2.84Å; C57-L60 PolarHBondContact O-N 2.88Å; L60-S62 VanDerWaalsContact C-N 3.29Å; L60-S62 PolarHBondContact O-N 2.82Å; L60-A63 WeakPolarHBondContact O-CB 3.37Å; L60-A63 PolarHBondContact O-N 3.28Å
61	F	81.3	Confident	87.4	Confident	170 Å²	170	74 Å²	74	75%	0.746	41%	0.412	S	S	*	.	H	α-helix	trans	-65.3	-35.3	172.7	-81.6	-71.1	0	0	0	112	C57 A63 V64	C57-F61 WeakPolarHBondContact O-CD2 3.35Å; C57-F61 PolarHBondContact O-N 3.38Å; F61-A63 VanDerWaalsContact C-N 3.26Å; F61-A63 PolarHBondContact O-N 2.98Å; F61-V64 PolarHBondContact O-N 2.9Å
62	S	81.4	Confident	87.7	Confident	70 Å²	70	70.2 Å²	70.2	49%	0.49	39%	0.389	S	S	.	.	H	α-helix	trans	-73.2	-17.7	175.2	-56.6	0	0	0	0	113.2	A58 S59 L60 M93	A58-S62 WeakPolarHBondContact O-CB 3.39Å; A58-S62 PolarHBondContact O-N 2.91Å; A58-S62 PolarHBondContact O-OG 3.3Å; S59-S62 PolarHBondContact O-N 3.33Å; L60-S62 VanDerWaalsContact C-N 3.29Å; L60-S62 PolarHBondContact O-N 2.82Å; S62-M93 VanDerWaalsContact O-CE 3.26Å; S62-M93 WeakPolarHBondContact O-CE 3.44Å
63	A	86.3	Confident	88.1	Confident	11 Å²	11	67.4 Å²	67.4	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-76.7	-27.7	177.5	0	0	0	0	0	112.2	S59 L60 F61 L92 M93	S59-A63 PolarHBondContact O-N 2.96Å; L60-A63 WeakPolarHBondContact O-CB 3.37Å; L60-A63 PolarHBondContact O-N 3.28Å; F61-A63 VanDerWaalsContact C-N 3.26Å; F61-A63 PolarHBondContact O-N 2.98Å; A63-L92 CarbonylContact O-C 3.56Å; A63-L92 WeakPolarHBondContact O-CA 3.22Å; A63-M93 VanDerWaalsContact CA-O 3.26Å; A63-M93 WeakPolarHBondContact CA-O 3.33Å; A63-M93 VanDerWaalsContact CB-O 3.22Å; A63-M93 WeakPolarHBondContact CB-O 3.33Å; A63-M93 WeakPolarHBondContact O-CG 3.36Å; A63-M93 PolarHBondContact O-N 3.46Å
64	V	90.1	Very high	88.5	Confident	70 Å²	70	64.6 Å²	64.6	42%	0.424	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.3	178.6	-177.5	0	0	0	0	109.2	F61 F90 L92	F61-V64 PolarHBondContact O-N 2.9Å; V64-F90 HydrophobicContact CG1-CD1 3.88Å; V64-L92 HydrophobicContact CG2-CD2 3.57Å
65	H	91	Very high	89	Confident	11 Å²	11	62.1 Å²	62.1	5%	0.051	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	160.8	167.8	67.5	-65.7	0	0	0	110.1	Y75 F90 H91 M93 Y100	H65-Y75 AromaticContact CE1-CE1 3.41Å; H65-Y75 VanDerWaalsContact CE1-CE1 3.41Å; H65-Y75 WeakPolarHBondContact CE1-CE1 3.06Å; H65-Y75 AromaticContact CE1-CZ 3.71Å; H65-Y75 PolarHBondContact CE1-OH 3.35Å; H65-Y75 AromaticContact NE2-CE1 3.46Å; H65-Y75 WeakPolarHBondContact NE2-CE1 3.35Å; H65-Y75 AromaticContact NE2-CZ 3.54Å; H65-Y75 PolarHBondContact NE2-OH 2.84Å; H65-F90 WeakPolarHBondContact O-CA 3.28Å; H65-H91 VanDerWaalsContact CE1-CB 3.41Å; H65-H91 WeakPolarHBondContact CE1-CB 3.36Å; H65-H91 PolarHBondContact CE1-O 3.45Å; H65-H91 PolarHBondContact N-O 3.34Å; H65-H91 PolarHBondContact ND1-O 2.83Å; H65-H91 PolarHBondContact O-N 2.88Å; H65-M93 HydrophobicContact CB-CE 4.22Å; H65-Y100 HydrophobicContact CB-CE1 3.8Å; H65-Y100 AromaticContact CD2-CD1 3.72Å; H65-Y100 AromaticContact CD2-CD2 3.6Å; H65-Y100 AromaticContact CD2-CE1 3.65Å; H65-Y100 AromaticContact CD2-CE2 3.52Å; H65-Y100 AromaticContact CD2-CG 3.7Å; H65-Y100 AromaticContact CD2-CZ 3.54Å; H65-Y100 AromaticContact CG-CD1 3.98Å; H65-Y100 AromaticContact CG-CE1 3.72Å; H65-Y100 AromaticContact CG-CZ 3.92Å; H65-Y100 AromaticContact NE2-CD2 3.94Å; H65-Y100 AromaticContact NE2-CG 3.83Å
66	K	93.3	Very high	89.4	Confident	123 Å²	123	57.8 Å²	57.8	54%	0.535	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.2	178.8	-179.2	-170.4	172.5	-163.3	0	108.8	G89 F90	K66-G89 WeakPolarHBondContact CA-O 3.43Å; K66-F90 HydrophobicContact CB-CD1 4.12Å; K66-F90 HydrophobicContact CB-CE1 3.97Å; K66-F90 HydrophobicContact CD-CZ 4.41Å; K66-F90 HydrophobicContact CG-CE1 4.32Å
67	I	95	Very high	89.8	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.015	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.4	167.3	-59.8	170.2	0	0	0	107.3	H71 G73 G89	I67-H71 HydrophobicContact CG2-CB 3.93Å; I67-H71 WeakPolarHBondContact CG2-O 3.23Å; I67-G73 VanDerWaalsContact CD1-CA 3.5Å; I67-G89 PolarHBondContact N-O 3.36Å; I67-G89 PolarHBondContact O-N 3.01Å
68	E	93.6	Very high	90.1	Very high	124 Å²	124	60 Å²	60	58%	0.579	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-72.2	155.6	178.1	-60.4	-166.9	160.2	0	0	111.6	H71	E68-H71 WeakPolarHBondContact O-CB 3.49Å; E68-H71 PolarHBondContact O-N 2.93Å
69	E	92.9	Very high	90.3	Very high	153 Å²	153	60.8 Å²	60.8	72%	0.715	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	144.7	172.6	-73.4	-64.2	162.1	0	0	110.9	H71 P88	E69-H71 PolarHBondContact O-N 3.41Å; E69-H71 PolarHBondContact O-ND1 2.8Å; E69-P88 HydrophobicContact CG-CB 4.44Å; E69-P88 VanDerWaalsContact OE2-CG 3.3Å; E69-P88 WeakPolarHBondContact OE2-CG 3.49Å
70	G	91.4	Very high	90.8	Very high	17 Å²	17	62.6 Å²	62.6	18%	0.175	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	7	-176.2	0	0	0	0	0	115.6	T105 T106	G70-T105 PolarHBondContact O-N 3.14Å; G70-T105 PolarHBondContact O-OG1 2.94Å; G70-T106 VanDerWaalsContact CA-CG2 3.41Å; G70-T106 PolarHBondContact O-N 3.37Å
71	H	94.6	Very high	91.3	Very high	34 Å²	34	59.4 Å²	59.4	16%	0.157	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	152.3	172.9	-63.4	72.8	0	0	0	111.4	I67 E68 E69 V103	I67-H71 HydrophobicContact CG2-CB 3.93Å; I67-H71 WeakPolarHBondContact CG2-O 3.23Å; E68-H71 WeakPolarHBondContact O-CB 3.49Å; E68-H71 PolarHBondContact O-N 2.93Å; E69-H71 PolarHBondContact O-N 3.41Å; E69-H71 PolarHBondContact O-ND1 2.8Å; H71-V103 CarbonylContact C-O 3.52Å; H71-V103 VanDerWaalsContact CA-O 3.3Å; H71-V103 WeakPolarHBondContact CA-O 3.37Å
72	I	94.4	Very high	91.9	Very high	17 Å²	17	54.1 Å²	54.1	9%	0.087	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.8	173.2	-64.4	-169.6	0	0	0	108.6	T85 V103 T105 P138 V141	I72-T85 HydrophobicContact CG2-CG2 4.2Å; I72-V103 PolarHBondContact N-O 3Å; I72-V103 PolarHBondContact O-N 2.9Å; I72-T105 HydrophobicContact CB-CG2 4.28Å; I72-T105 HydrophobicContact CD1-CG2 3.7Å; I72-T105 HydrophobicContact CG1-CG2 3.77Å; I72-P138 HydrophobicContact CD1-CB 3.52Å; I72-P138 HydrophobicContact CD1-CG 4.11Å; I72-V141 HydrophobicContact CB-CG1 4.49Å; I72-V141 HydrophobicContact CD1-CG2 4.17Å; I72-V141 HydrophobicContact CG2-CG1 4.19Å
73	G	94.3	Very high	92.3	Very high	0 Å²	0	56 Å²	56	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	127	177.7	0	0	0	0	0	111.1	I67 S86	I67-G73 VanDerWaalsContact CD1-CA 3.5Å; G73-S86 PolarHBondContact N-O 2.86Å; G73-S86 PolarHBondContact O-N 3.34Å
74	V	94.6	Very high	92.4	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.1	174.8	-174.9	0	0	0	0	108.6	L81 T85 Y100 K101 V103 V141 V145	V74-L81 HydrophobicContact CG1-CD1 3.15Å; V74-L81 HydrophobicContact CG1-CG 4.23Å; V74-T85 HydrophobicContact CG2-CG2 4.3Å; V74-Y100 CarbonylContact O-C 3.12Å; V74-Y100 VanDerWaalsContact O-CA 3.31Å; V74-Y100 WeakPolarHBondContact O-CA 3.49Å; V74-K101 PolarHBondContact N-O 3.49Å; V74-K101 PolarHBondContact O-N 3.38Å; V74-V103 HydrophobicContact CG2-CG2 4.17Å; V74-V141 HydrophobicContact CG2-CG1 3.72Å; V74-V145 HydrophobicContact CG1-CG1 4.08Å; V74-V145 HydrophobicContact CG2-CG2 4.4Å
75	Y	93.9	Very high	92.5	Very high	17 Å²	17	58.3 Å²	58.3	7%	0.067	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141	-172.6	-62.6	-85.5	0	0	0	112	H65 L82 S86 H91 S99 Y100	H65-Y75 AromaticContact CE1-CE1 3.41Å; H65-Y75 VanDerWaalsContact CE1-CE1 3.41Å; H65-Y75 WeakPolarHBondContact CE1-CE1 3.06Å; H65-Y75 AromaticContact CE1-CZ 3.71Å; H65-Y75 PolarHBondContact CE1-OH 3.35Å; H65-Y75 AromaticContact NE2-CE1 3.46Å; H65-Y75 WeakPolarHBondContact NE2-CE1 3.35Å; H65-Y75 AromaticContact NE2-CZ 3.54Å; H65-Y75 PolarHBondContact NE2-OH 2.84Å; Y75-L82 PolarHBondContact O-N 3.18Å; Y75-S86 VanDerWaalsContact CE2-OG 3.3Å; Y75-S86 WeakPolarHBondContact CE2-OG 3.28Å; Y75-H91 VanDerWaalsContact OH-CB 3.27Å; Y75-H91 WeakPolarHBondContact OH-CB 3.3Å; Y75-S99 WeakPolarHBondContact CA-O 3.28Å; Y75-Y100 HydrophobicContact CE1-CG 4.48Å
76	Y	94.1	Very high	92.6	Very high	42 Å²	42	59 Å²	59	17%	0.165	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.6	171.9	-60.5	-96.9	0	0	0	108.6	A80 L81 T98 S99 K101 V145	Y76-A80 CarbonylContact C-O 3.6Å; Y76-A80 VanDerWaalsContact CA-O 3.24Å; Y76-A80 WeakPolarHBondContact CA-O 3.3Å; Y76-L81 HydrophobicContact CD1-CB 4.47Å; Y76-L81 HydrophobicContact CD1-CD1 4.03Å; Y76-L81 HydrophobicContact CE1-CB 4.37Å; Y76-L81 HydrophobicContact CE1-CD1 3.6Å; Y76-L81 HydrophobicContact CE2-CD1 4.19Å; Y76-T98 CarbonylContact O-C 3.56Å; Y76-T98 WeakPolarHBondContact O-CA 3.42Å; Y76-S99 PolarHBondContact N-O 2.83Å; Y76-S99 PolarHBondContact O-N 3.2Å; Y76-K101 HydrophobicContact CE2-CB 4.35Å; Y76-K101 HydrophobicContact CE2-CG 4.27Å; Y76-V145 WeakPolarHBondContact OH-CG1 3.4Å
77	R	93.8	Very high	92.5	Very high	147 Å²	147	54.8 Å²	54.8	56%	0.555	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	114.2	174.9	-176	-179.5	174.7	169.2	-2.1	109.1	G79 A80 L82 I97 T98	R77-G79 PolarHBondContact O-N 3.4Å; R77-G79 VanDerWaalsContact O-N 3.16Å; R77-A80 PolarHBondContact N-O 3.01Å; R77-A80 PolarHBondContact O-N 2.96Å; R77-L82 HydrophobicContact CB-CD1 3.41Å; R77-L82 VanDerWaalsContact CB-CD1 3.41Å; R77-I97 HydrophobicContact CG-CG2 3.82Å; R77-T98 HydrophobicContact CB-CG2 4Å; R77-T98 HydrophobicContact CG-CG2 3.99Å
78	G	90.1	Very high	92.5	Very high	72 Å²	72	57.3 Å²	57.3	74%	0.742	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	29.7	-175.7	0	0	0	0	0	113.3	I97	G78-I97 PolarHBondContact N-O 2.91Å
79	G	86.3	Confident	92.5	Very high	67 Å²	67	52.8 Å²	52.8	69%	0.691	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-11.4	-177.5	0	0	0	0	0	115.8	R77	R77-G79 PolarHBondContact O-N 3.4Å; R77-G79 VanDerWaalsContact O-N 3.16Å
80	A	91.6	Very high	92.5	Very high	61 Å²	61	53 Å²	53	50%	0.504	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	136.1	177	0	0	0	0	0	111.9	Y76 R77	Y76-A80 CarbonylContact C-O 3.6Å; Y76-A80 VanDerWaalsContact CA-O 3.24Å; Y76-A80 WeakPolarHBondContact CA-O 3.3Å; R77-A80 PolarHBondContact N-O 3.01Å; R77-A80 PolarHBondContact O-N 2.96Å
81	L	93.9	Very high	92.6	Very high	38 Å²	38	54.4 Å²	54.4	20%	0.199	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	126.5	178.1	-169.6	64.8	0	0	0	111.7	V74 Y76 Y142 V145 K146	V74-L81 HydrophobicContact CG1-CD1 3.15Å; V74-L81 HydrophobicContact CG1-CG 4.23Å; Y76-L81 HydrophobicContact CD1-CB 4.47Å; Y76-L81 HydrophobicContact CD1-CD1 4.03Å; Y76-L81 HydrophobicContact CE1-CB 4.37Å; Y76-L81 HydrophobicContact CE1-CD1 3.6Å; Y76-L81 HydrophobicContact CE2-CD1 4.19Å; L81-Y142 HydrophobicContact CD2-CD2 3.94Å; L81-Y142 HydrophobicContact CD2-CE2 3.63Å; L81-Y142 HydrophobicContact CG-CD2 4.32Å; L81-Y142 HydrophobicContact CG-CE2 3.87Å; L81-V145 HydrophobicContact CD1-CG1 4.11Å; L81-V145 HydrophobicContact CD2-CG1 4.22Å; L81-K146 HydrophobicContact CD2-CB 3.79Å; L81-K146 HydrophobicContact CD2-CG 4.43Å
82	L	93	Very high	92.3	Very high	58 Å²	58	59.6 Å²	59.6	30%	0.304	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-76.1	141.8	172.9	-90.4	66.2	0	0	0	110.7	Y75 R77 S84 Y142	Y75-L82 PolarHBondContact O-N 3.18Å; R77-L82 HydrophobicContact CB-CD1 3.41Å; R77-L82 VanDerWaalsContact CB-CD1 3.41Å; L82-S84 VanDerWaalsContact C-N 3.3Å; L82-S84 PolarHBondContact O-N 3.18Å; L82-Y142 VanDerWaalsContact O-CE2 3.27Å; L82-Y142 WeakPolarHBondContact O-CE2 3.32Å
83	T	89.9	Confident	92.1	Very high	111 Å²	111	60.6 Å²	60.6	68%	0.681	37%	0.371	S	S	*	.	S	Bend	trans	-70.3	-24.6	178.8	51.6	0	0	0	0	113.5	Y142	T83-Y142 VanDerWaalsContact CA-CE2 3.47Å; T83-Y142 HydrophobicContact CG2-CE2 4.32Å
84	S	88.4	Confident	91.8	Very high	70 Å²	70	65.1 Å²	65.1	49%	0.49	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-88.2	119.8	178.3	57.2	0	0	0	0	110.9	L82	L82-S84 VanDerWaalsContact C-N 3.3Å; L82-S84 PolarHBondContact O-N 3.18Å
85	T	92.2	Very high	91.2	Very high	58 Å²	58	67 Å²	67	36%	0.356	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-90.4	141.4	167.6	54.6	0	0	0	0	110.5	I72 V74	I72-T85 HydrophobicContact CG2-CG2 4.2Å; V74-T85 HydrophobicContact CG2-CG2 4.3Å
86	S	93.2	Very high	90.7	Very high	27 Å²	27	74.6 Å²	74.6	19%	0.189	44%	0.441	C	S	.	.	B	Isolated β-bridge	trans	-102.8	138.5	175.4	-70.7	0	0	0	0	111.6	G73 Y75 H91	G73-S86 PolarHBondContact N-O 2.86Å; G73-S86 PolarHBondContact O-N 3.34Å; Y75-S86 VanDerWaalsContact CE2-OG 3.3Å; Y75-S86 WeakPolarHBondContact CE2-OG 3.28Å; S86-H91 VanDerWaalsContact CB-CE1 3.5Å; S86-H91 WeakPolarHBondContact CB-CE1 3.39Å
87	G	92.4	Very high	90.5	Very high	34 Å²	34	77.2 Å²	77.2	35%	0.351	46%	0.457	S	S	.	.			trans	-74.6	-174.7	171.8	0	0	0	0	0	113.5	H91	G87-H91 PolarHBondContact O-NE2 3.39Å
88	P	94.1	Very high	90.3	Very high	56 Å²	56	71.2 Å²	71.2	36%	0.364	44%	0.436	S	S	.	.	S	Bend	trans	-63.8	152.4	179.3	27.7	-35	0	0	0	112.1	E69	E69-P88 HydrophobicContact CG-CB 4.44Å; E69-P88 VanDerWaalsContact OE2-CG 3.3Å; E69-P88 WeakPolarHBondContact OE2-CG 3.49Å
89	G	94.1	Very high	90.4	Very high	28 Å²	28	71 Å²	71	29%	0.289	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	124.5	-168.2	-179.6	0	0	0	0	0	114.5	K66 I67 H91	K66-G89 WeakPolarHBondContact CA-O 3.43Å; I67-G89 PolarHBondContact N-O 3.36Å; I67-G89 PolarHBondContact O-N 3.01Å; G89-H91 PolarHBondContact O-CD2 2.81Å
90	F	92.8	Very high	90.7	Very high	157 Å²	157	71.8 Å²	71.8	69%	0.689	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.7	178.4	-72.2	-80	0	0	0	110.9	V64 H65 K66	V64-F90 HydrophobicContact CG1-CD1 3.88Å; H65-F90 WeakPolarHBondContact O-CA 3.28Å; K66-F90 HydrophobicContact CB-CD1 4.12Å; K66-F90 HydrophobicContact CB-CE1 3.97Å; K66-F90 HydrophobicContact CD-CZ 4.41Å; K66-F90 HydrophobicContact CG-CE1 4.32Å
91	H	92.5	Very high	90.7	Very high	47 Å²	47	73.3 Å²	73.3	22%	0.218	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	148.8	179.6	-67.4	-80.1	0	0	0	111.2	H65 Y75 S86 G87 G89	H65-H91 VanDerWaalsContact CE1-CB 3.41Å; H65-H91 WeakPolarHBondContact CE1-CB 3.36Å; H65-H91 PolarHBondContact CE1-O 3.45Å; H65-H91 PolarHBondContact N-O 3.34Å; H65-H91 PolarHBondContact ND1-O 2.83Å; H65-H91 PolarHBondContact O-N 2.88Å; Y75-H91 VanDerWaalsContact OH-CB 3.27Å; Y75-H91 WeakPolarHBondContact OH-CB 3.3Å; S86-H91 VanDerWaalsContact CB-CE1 3.5Å; S86-H91 WeakPolarHBondContact CB-CE1 3.39Å; G87-H91 PolarHBondContact O-NE2 3.39Å; G89-H91 PolarHBondContact O-CD2 2.81Å
92	L	89.6	Confident	90.7	Very high	144 Å²	144	74.7 Å²	74.7	75%	0.754	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	125	177.8	-70.7	166.2	0	0	0	109.5	A63 V64	A63-L92 CarbonylContact O-C 3.56Å; A63-L92 WeakPolarHBondContact O-CA 3.22Å; V64-L92 HydrophobicContact CG2-CD2 3.57Å
93	M	89	Confident	90.8	Very high	37 Å²	37	72.2 Å²	72.2	18%	0.182	40%	0.402	C	S	.	.			trans	-117.4	150.7	172.1	69.2	173	167.1	0	0	110	S62 A63 H65 P95 T98 Y100	S62-M93 VanDerWaalsContact O-CE 3.26Å; S62-M93 WeakPolarHBondContact O-CE 3.44Å; A63-M93 VanDerWaalsContact CA-O 3.26Å; A63-M93 WeakPolarHBondContact CA-O 3.33Å; A63-M93 VanDerWaalsContact CB-O 3.22Å; A63-M93 WeakPolarHBondContact CB-O 3.33Å; A63-M93 WeakPolarHBondContact O-CG 3.36Å; A63-M93 PolarHBondContact O-N 3.46Å; H65-M93 HydrophobicContact CB-CE 4.22Å; M93-P95 WeakPolarHBondContact O-CD 3.29Å; M93-T98 WeakPolarHBondContact CB-OG1 3.47Å; M93-Y100 HydrophobicContact CE-CD1 4Å; M93-Y100 HydrophobicContact CE-CE1 3.88Å; M93-Y100 HydrophobicContact SD-CD1 3.58Å; M93-Y100 VanDerWaalsContact SD-CD1 3.58Å; M93-Y100 HydrophobicContact SD-CE1 4.1Å
94	L	87.6	Confident	91	Very high	96 Å²	96	69.7 Å²	69.7	50%	0.503	38%	0.382	S	S	.	.			trans	-77.7	117.2	176.2	-68.1	171	0	0	0	109.1	T98	L94-T98 WeakPolarHBondContact CA-OG1 3.38Å; L94-T98 HydrophobicContact CB-CG2 4.24Å; L94-T98 PolarHBondContact N-OG1 2.94Å; L94-T98 PolarHBondContact O-N 3.49Å; L94-T98 PolarHBondContact O-OG1 3.29Å
95	P	82.8	Confident	91.1	Very high	40 Å²	40	67.4 Å²	67.4	26%	0.26	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	146	178.9	25.8	-33.4	0	0	0	109.8	M93 I97	M93-P95 WeakPolarHBondContact O-CD 3.29Å; P95-I97 VanDerWaalsContact C-N 3.26Å; P95-I97 PolarHBondContact O-N 3.41Å
96	F	83.1	Confident	91.2	Very high	176 Å²	176	67.5 Å²	67.5	77%	0.772	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	-32.4	-179.7	-47.5	-76.5	0	0	0	117.9	F55	F55-F96 HydrophobicContact CZ-CE2 4.46Å; F55-F96 HydrophobicContact CZ-CZ 4.11Å
97	I	89.5	Confident	91.2	Very high	97 Å²	97	71.6 Å²	71.6	50%	0.497	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-36.7	-175.2	-56.6	174.2	0	0	0	111.9	R77 G78 P95	R77-I97 HydrophobicContact CG-CG2 3.82Å; G78-I97 PolarHBondContact N-O 2.91Å; P95-I97 VanDerWaalsContact C-N 3.26Å; P95-I97 PolarHBondContact O-N 3.41Å
98	T	90.9	Very high	91.2	Very high	21 Å²	21	71.3 Å²	71.3	13%	0.129	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.5	-178.3	55.4	0	0	0	0	111.7	Y76 R77 M93 L94	Y76-T98 CarbonylContact O-C 3.56Å; Y76-T98 WeakPolarHBondContact O-CA 3.42Å; R77-T98 HydrophobicContact CB-CG2 4Å; R77-T98 HydrophobicContact CG-CG2 3.99Å; M93-T98 WeakPolarHBondContact CB-OG1 3.47Å; L94-T98 WeakPolarHBondContact CA-OG1 3.38Å; L94-T98 HydrophobicContact CB-CG2 4.24Å; L94-T98 PolarHBondContact N-OG1 2.94Å; L94-T98 PolarHBondContact O-N 3.49Å; L94-T98 PolarHBondContact O-OG1 3.29Å
99	S	90.9	Very high	91.3	Very high	67 Å²	67	72.4 Å²	72.4	47%	0.469	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	156.5	165.4	60.7	0	0	0	0	109.4	Y75 Y76	Y75-S99 WeakPolarHBondContact CA-O 3.28Å; Y76-S99 PolarHBondContact N-O 2.83Å; Y76-S99 PolarHBondContact O-N 3.2Å
100	Y	92.3	Very high	91.2	Very high	84 Å²	84	72.5 Å²	72.5	33%	0.329	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.2	175.1	77.4	-80.1	0	0	0	109.9	H65 V74 Y75 M93	H65-Y100 HydrophobicContact CB-CE1 3.8Å; H65-Y100 AromaticContact CD2-CD1 3.72Å; H65-Y100 AromaticContact CD2-CD2 3.6Å; H65-Y100 AromaticContact CD2-CE1 3.65Å; H65-Y100 AromaticContact CD2-CE2 3.52Å; H65-Y100 AromaticContact CD2-CG 3.7Å; H65-Y100 AromaticContact CD2-CZ 3.54Å; H65-Y100 AromaticContact CG-CD1 3.98Å; H65-Y100 AromaticContact CG-CE1 3.72Å; H65-Y100 AromaticContact CG-CZ 3.92Å; H65-Y100 AromaticContact NE2-CD2 3.94Å; H65-Y100 AromaticContact NE2-CG 3.83Å; V74-Y100 CarbonylContact O-C 3.12Å; V74-Y100 VanDerWaalsContact O-CA 3.31Å; V74-Y100 WeakPolarHBondContact O-CA 3.49Å; Y75-Y100 HydrophobicContact CE1-CG 4.48Å; M93-Y100 HydrophobicContact CE-CD1 4Å; M93-Y100 HydrophobicContact CE-CE1 3.88Å; M93-Y100 HydrophobicContact SD-CD1 3.58Å; M93-Y100 VanDerWaalsContact SD-CD1 3.58Å; M93-Y100 HydrophobicContact SD-CE1 4.1Å
101	K	93.3	Very high	91.3	Very high	93 Å²	93	69 Å²	69	40%	0.404	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.8	164.8	-75.2	-161.9	166.8	-164.2	0	108.6	V74 Y76 A150 D151	V74-K101 PolarHBondContact N-O 3.49Å; V74-K101 PolarHBondContact O-N 3.38Å; Y76-K101 HydrophobicContact CE2-CB 4.35Å; Y76-K101 HydrophobicContact CE2-CG 4.27Å; K101-A150 HydrophobicContact CB-CB 4.3Å; K101-A150 HydrophobicContact CD-CB 3.31Å; K101-A150 HydrophobicContact CG-CB 4.43Å; K101-D151 IonicContact NZ-OD1 2.75Å; K101-D151 PolarHBondContact NZ-OD1 3.03Å
102	S	93.6	Very high	91.4	Very high	67 Å²	67	67 Å²	67	47%	0.469	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	118.6	172.3	50.9	0	0	0	0	109
103	V	94.3	Very high	91.6	Very high	7 Å²	7	65.2 Å²	65.2	4%	0.042	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.2	172.3	179.7	0	0	0	0	107.9	H71 I72 V74 L136 V141 V145 Y152	H71-V103 CarbonylContact C-O 3.52Å; H71-V103 VanDerWaalsContact CA-O 3.3Å; H71-V103 WeakPolarHBondContact CA-O 3.37Å; I72-V103 PolarHBondContact N-O 3Å; I72-V103 PolarHBondContact O-N 2.9Å; V74-V103 HydrophobicContact CG2-CG2 4.17Å; V103-L136 HydrophobicContact CG1-CD2 3.77Å; V103-V141 HydrophobicContact CB-CG1 4.16Å; V103-V141 HydrophobicContact CG1-CG1 4.29Å; V103-V141 HydrophobicContact CG2-CG1 4.42Å; V103-V145 HydrophobicContact CG2-CG2 3.86Å; V103-Y152 HydrophobicContact CG1-CE1 3.9Å
104	Q	93.6	Very high	91.8	Very high	57 Å²	57	68.6 Å²	68.6	27%	0.266	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	136.7	179.5	-174	172.3	0.2	0	0	109.7	T106 Q108	Q104-T106 WeakPolarHBondContact CG-OG1 3.41Å; Q104-T106 PolarHBondContact NE2-OG1 3.02Å; Q104-Q108 VanDerWaalsContact CB-CD 3.46Å; Q104-Q108 HydrophobicContact CB-CG 4.19Å; Q104-Q108 VanDerWaalsContact CD-CD 3.44Å; Q104-Q108 VanDerWaalsContact CD-NE2 3.26Å; Q104-Q108 HydrophobicContact CG-CG 3.64Å; Q104-Q108 PolarHBondContact O-OE1 2.85Å
105	T	92.1	Very high	92.1	Very high	23 Å²	23	64 Å²	64	14%	0.141	33%	0.332	C	S	.	.			trans	-118	-2.5	-179.8	54.5	0	0	0	0	112.8	G70 I72 L136 V141	G70-T105 PolarHBondContact O-N 3.14Å; G70-T105 PolarHBondContact O-OG1 2.94Å; I72-T105 HydrophobicContact CB-CG2 4.28Å; I72-T105 HydrophobicContact CD1-CG2 3.7Å; I72-T105 HydrophobicContact CG1-CG2 3.77Å; T105-L136 VanDerWaalsContact CB-O 3.28Å; T105-L136 WeakPolarHBondContact CB-O 3.48Å; T105-V141 HydrophobicContact CG2-CG2 3.61Å
106	T	93.1	Very high	92.7	Very high	60 Å²	60	64.2 Å²	64.2	37%	0.368	33%	0.333	S	S	.	.	S	Bend	trans	-79	174.9	173	48.4	0	0	0	0	111.3	G70 Q104 Q108	G70-T106 VanDerWaalsContact CA-CG2 3.41Å; G70-T106 PolarHBondContact O-N 3.37Å; Q104-T106 WeakPolarHBondContact CG-OG1 3.41Å; Q104-T106 PolarHBondContact NE2-OG1 3.02Å; T106-Q108 PolarHBondContact O-N 3.1Å
107	L	94.1	Very high	93.2	Very high	112 Å²	112	55.9 Å²	55.9	59%	0.586	30%	0.297	S	S	*	.			trans	-57.2	122	169.8	-92.8	155.7	0	0	0	110	V133 Q207	L107-V133 HydrophobicContact CD2-CG1 3.38Å; L107-Q207 HydrophobicContact CD2-CB 4.29Å; L107-Q207 HydrophobicContact CD2-CG 4.46Å
108	Q	92.9	Very high	93.5	Very high	28 Å²	28	52.2 Å²	52.2	13%	0.131	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	155.5	178.8	-71.9	-178.4	-74.3	0	0	110.1	Q104 T106 V133 N134	Q104-Q108 VanDerWaalsContact CB-CD 3.46Å; Q104-Q108 HydrophobicContact CB-CG 4.19Å; Q104-Q108 VanDerWaalsContact CD-CD 3.44Å; Q104-Q108 VanDerWaalsContact CD-NE2 3.26Å; Q104-Q108 HydrophobicContact CG-CG 3.64Å; Q104-Q108 PolarHBondContact O-OE1 2.85Å; T106-Q108 PolarHBondContact O-N 3.1Å; Q108-V133 CarbonylContact O-C 3.49Å; Q108-V133 VanDerWaalsContact O-CA 3.24Å; Q108-V133 WeakPolarHBondContact O-CA 3.26Å; Q108-N134 WeakPolarHBondContact CB-OD1 3.43Å; Q108-N134 PolarHBondContact N-O 2.99Å; Q108-N134 PolarHBondContact O-N 3.45Å; Q108-N134 PolarHBondContact O-OD1 3.09Å
109	T	94.5	Very high	93.7	Very high	79 Å²	79	51.6 Å²	51.6	49%	0.485	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	109.8	172.7	-54.7	0	0	0	0	108.4	E131 V132 V133	T109-E131 HydrophobicContact CG2-CB 3.93Å; T109-E131 HydrophobicContact CG2-CG 4.45Å; T109-V132 CarbonylContact C-O 3.44Å; T109-V132 WeakPolarHBondContact CA-O 3.36Å; T109-V133 HydrophobicContact CG2-CG2 4.37Å
110	D	93.1	Very high	93.9	Very high	30 Å²	30	51.4 Å²	51.4	16%	0.16	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.6	174.7	-66.5	-36.1	0	0	0	109.7	E131 V132 N134 I157	D110-E131 WeakPolarHBondContact O-CA 3.45Å; D110-V132 PolarHBondContact N-O 3.47Å; D110-V132 PolarHBondContact O-N 3.48Å; D110-N134 PolarHBondContact OD2-ND2 3.25Å; D110-N134 PolarHBondContact OD2-OD1 2.93Å; D110-I157 WeakPolarHBondContact OD2-CD1 3.23Å
111	E	94.3	Very high	93.9	Very high	84 Å²	84	50.2 Å²	50.2	39%	0.393	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.3	176.8	-64.8	-167.2	157	0	0	110.9	K113 R129 I130 E131	E111-K113 WeakPolarHBondContact OE2-CE 3.33Å; E111-K113 IonicContact OE2-NZ 3.55Å; E111-K113 PolarHBondContact OE2-NZ 3.39Å; E111-R129 IonicContact OE1-CZ 3.41Å; E111-R129 IonicContact OE1-NH1 3.57Å; E111-R129 PolarHBondContact OE1-NH1 3.4Å; E111-I130 WeakPolarHBondContact CA-O 3.37Å; E111-E131 HydrophobicContact CG-CG 4.34Å
112	V	94.1	Very high	93.7	Very high	4 Å²	4	49 Å²	49	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128	169.9	-177.9	0	0	0	0	108.8	V115 R129 I130 F158 I161	V112-V115 HydrophobicContact CG1-CG2 3.4Å; V112-V115 VanDerWaalsContact CG1-CG2 3.4Å; V112-R129 CarbonylContact O-C 3.51Å; V112-R129 WeakPolarHBondContact O-CA 3.3Å; V112-I130 HydrophobicContact CB-CB 4.34Å; V112-I130 PolarHBondContact N-O 3.01Å; V112-I130 PolarHBondContact O-N 3.25Å; V112-F158 HydrophobicContact CB-CD2 4.18Å; V112-F158 HydrophobicContact CG1-CD2 3.55Å; V112-F158 HydrophobicContact CG1-CE2 3.58Å; V112-F158 HydrophobicContact CG2-CB 4.45Å; V112-F158 HydrophobicContact CG2-CD2 3.76Å; V112-I161 HydrophobicContact CG2-CD1 3.81Å
113	K	94.1	Very high	93.7	Very high	108 Å²	108	47.4 Å²	47.4	47%	0.47	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146.7	-173.6	-66.5	178.3	-179.6	163.1	0	112	E111 D128	E111-K113 WeakPolarHBondContact OE2-CE 3.33Å; E111-K113 IonicContact OE2-NZ 3.55Å; E111-K113 PolarHBondContact OE2-NZ 3.39Å; K113-D128 WeakPolarHBondContact CA-O 3.23Å
114	N	92.9	Very high	93.7	Very high	107 Å²	107	51.5 Å²	51.5	57%	0.572	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.6	55.7	174.5	-59.2	-57.5	0	0	0	113.2	P116 F127 D128	N114-P116 VanDerWaalsContact O-CD 3.26Å; N114-P116 WeakPolarHBondContact O-CD 3.42Å; N114-F127 CarbonylContact C-O 3.26Å; N114-F127 VanDerWaalsContact CA-O 3.27Å; N114-F127 WeakPolarHBondContact CA-O 3.24Å; N114-F127 PolarHBondContact N-O 2.92Å; N114-F127 VanDerWaalsContact N-O 3.1Å; N114-D128 PolarHBondContact N-O 2.8Å
115	V	94.4	Very high	93.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	113.5	176.4	176.7	0	0	0	0	109.4	V112 Y126 F127 I130 L165	V112-V115 HydrophobicContact CG1-CG2 3.4Å; V112-V115 VanDerWaalsContact CG1-CG2 3.4Å; V115-Y126 CarbonylContact O-C 3.52Å; V115-Y126 WeakPolarHBondContact O-CA 3.41Å; V115-F127 HydrophobicContact CB-CB 4.28Å; V115-F127 PolarHBondContact N-O 3.33Å; V115-F127 PolarHBondContact O-N 3.01Å; V115-I130 HydrophobicContact CB-CD1 4.27Å; V115-I130 HydrophobicContact CG2-CD1 3.82Å; V115-L165 HydrophobicContact CG1-CD1 4.22Å
116	P	94.9	Very high	93.9	Very high	45 Å²	45	52.8 Å²	52.8	29%	0.292	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.6	173.6	29.8	-33.1	0	0	0	110.2	N114 M124 Y126 N166	N114-P116 VanDerWaalsContact O-CD 3.26Å; N114-P116 WeakPolarHBondContact O-CD 3.42Å; P116-M124 HydrophobicContact CB-CE 4.13Å; P116-Y126 HydrophobicContact CB-CD1 3.95Å; P116-Y126 HydrophobicContact CB-CE1 3.72Å; P116-N166 PolarHBondContact O-OD1 2.93Å
117	C	95.3	Very high	94	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.2	175.5	-135.2	0	0	0	0	110.5	I125 F127 L165 N166 C169	C117-I125 HydrophobicContact CB-CD1 4.18Å; C117-I125 HydrophobicContact CB-CG1 3.67Å; C117-I125 PolarHBondContact N-O 3.17Å; C117-I125 WeakPolarHBondContact O-CG1 3.43Å; C117-I125 PolarHBondContact O-N 2.87Å; C117-F127 HydrophobicContact CB-CD2 4.18Å; C117-F127 HydrophobicContact CB-CE2 3.83Å; C117-L165 PolarHBondContact SG-O 3.24Å; C117-N166 WeakPolarHBondContact CA-OD1 3.4Å; C117-C169 HydrophobicContact CB-CB 3.93Å; C117-C169 WeakPolarHBondContact CB-SG 3.45Å; C117-C169 WeakPolarHBondContact SG-CB 3.39Å; C117-C169 CovalentContact SG-SG 2.03Å; C117-C169 PolarHBondContact SG-SG 2.95Å
118	G	94.9	Very high	94	Very high	21 Å²	21	47.9 Å²	47.9	22%	0.216	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	117.4	172.5	0	0	0	0	0	110.7	C169 S170	G118-C169 CarbonylContact O-C 3.56Å; G118-C169 VanDerWaalsContact O-C 3.26Å; G118-C169 VanDerWaalsContact O-CB 3.26Å; G118-C169 WeakPolarHBondContact O-CB 3.35Å; G118-S170 PolarHBondContact O-N 3.3Å
119	T	95.9	Very high	94.1	Very high	8 Å²	8	51 Å²	51	5%	0.049	30%	0.295	C	S	.	.			trans	-75.7	158.6	174.3	58.4	0	0	0	0	111.5	G121 G122 V123 I125 C169 L174	T119-G121 PolarHBondContact O-N 3.44Å; T119-G121 VanDerWaalsContact O-N 3.12Å; T119-G122 PolarHBondContact O-N 2.95Å; T119-V123 PolarHBondContact N-O 3.02Å; T119-V123 PolarHBondContact OG1-N 2.95Å; T119-V123 PolarHBondContact OG1-O 3.41Å; T119-I125 HydrophobicContact CG2-CD1 3.83Å; T119-I125 HydrophobicContact CG2-CG1 4.19Å; T119-I125 HydrophobicContact CG2-CG2 4.43Å; T119-C169 CarbonylContact C-O 3.52Å; T119-C169 VanDerWaalsContact CA-O 3.29Å; T119-C169 WeakPolarHBondContact CA-O 3.25Å; T119-L174 HydrophobicContact CG2-CB 4.27Å; T119-L174 HydrophobicContact CG2-CD1 4.18Å
120	S	95.1	Very high	94.2	Very high	62 Å²	62	47.3 Å²	47.3	43%	0.434	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.9	175.2	68.3	0	0	0	0	113.2	G122 C169 S170 H172 T173	S120-G122 PolarHBondContact O-N 3.42Å; S120-C169 PolarHBondContact N-O 2.93Å; S120-C169 VanDerWaalsContact N-O 3.14Å; S120-S170 VanDerWaalsContact CB-O 3.31Å; S120-S170 WeakPolarHBondContact CB-O 3.45Å; S120-H172 PolarHBondContact N-O 2.83Å; S120-H172 PolarHBondContact OG-O 3.25Å; S120-H172 VanDerWaalsContact OG-O 3.05Å; S120-T173 WeakPolarHBondContact OG-CA 3.48Å; S120-T173 PolarHBondContact OG-N 2.92Å
121	G	91	Very high	94.4	Very high	59 Å²	59	47.8 Å²	47.8	61%	0.608	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	3.4	174.2	0	0	0	0	0	115.1	T119 V123	T119-G121 PolarHBondContact O-N 3.44Å; T119-G121 VanDerWaalsContact O-N 3.12Å; G121-V123 VanDerWaalsContact C-N 3.27Å; G121-V123 PolarHBondContact O-N 3.43Å
122	G	90	Very high	94.5	Very high	67 Å²	67	43.8 Å²	43.8	69%	0.691	26%	0.255	S	S	*	.	S	Bend	trans	77.1	7.7	178.6	0	0	0	0	0	114.8	T119 S120	T119-G122 PolarHBondContact O-N 2.95Å; S120-G122 PolarHBondContact O-N 3.42Å
123	V	93.3	Very high	94.6	Very high	34 Å²	34	44.7 Å²	44.7	21%	0.206	26%	0.26	C	S	.	.			trans	-88	127.5	175.1	-177.7	0	0	0	0	109.2	T119 G121 I125 L174 I220	T119-V123 PolarHBondContact N-O 3.02Å; T119-V123 PolarHBondContact OG1-N 2.95Å; T119-V123 PolarHBondContact OG1-O 3.41Å; G121-V123 VanDerWaalsContact C-N 3.27Å; G121-V123 PolarHBondContact O-N 3.43Å; V123-I125 HydrophobicContact CG1-CG2 4.35Å; V123-L174 HydrophobicContact CG1-CD2 4.34Å; V123-I220 HydrophobicContact CB-CD1 4.37Å; V123-I220 HydrophobicContact CG1-CD1 3.58Å; V123-I220 HydrophobicContact CG2-CD1 3.8Å
124	M	93.4	Very high	94.6	Very high	93 Å²	93	39.5 Å²	39.5	46%	0.458	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	121.9	171.8	-66.3	-60.8	-62.3	0	0	110.1	P116	P116-M124 HydrophobicContact CB-CE 4.13Å
125	I	95.3	Very high	94.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	160	174.1	60.7	174.7	0	0	0	110.3	C117 T119 V123 F127 L174 V177 P214 I216	C117-I125 HydrophobicContact CB-CD1 4.18Å; C117-I125 HydrophobicContact CB-CG1 3.67Å; C117-I125 PolarHBondContact N-O 3.17Å; C117-I125 WeakPolarHBondContact O-CG1 3.43Å; C117-I125 PolarHBondContact O-N 2.87Å; T119-I125 HydrophobicContact CG2-CD1 3.83Å; T119-I125 HydrophobicContact CG2-CG1 4.19Å; T119-I125 HydrophobicContact CG2-CG2 4.43Å; V123-I125 HydrophobicContact CG1-CG2 4.35Å; I125-F127 HydrophobicContact CD1-CE2 4.06Å; I125-F127 HydrophobicContact CD1-CZ 4.32Å; I125-L174 HydrophobicContact CG2-CD1 3.34Å; I125-V177 HydrophobicContact CD1-CG1 4.01Å; I125-P214 HydrophobicContact CB-CB 4.23Å; I125-P214 HydrophobicContact CD1-CB 3.96Å; I125-P214 HydrophobicContact CD1-CG 4.05Å; I125-P214 HydrophobicContact CG1-CB 4.39Å; I125-I216 HydrophobicContact CG2-CG1 4.2Å
126	Y	95.7	Very high	94.7	Very high	108 Å²	108	37.4 Å²	37.4	42%	0.424	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.4	178.8	-62.5	-91.8	0	0	0	110.4	V115 P116 P214 N215	V115-Y126 CarbonylContact O-C 3.52Å; V115-Y126 WeakPolarHBondContact O-CA 3.41Å; P116-Y126 HydrophobicContact CB-CD1 3.95Å; P116-Y126 HydrophobicContact CB-CE1 3.72Å; Y126-P214 CarbonylContact O-C 3.58Å; Y126-P214 VanDerWaalsContact O-CA 3.23Å; Y126-P214 WeakPolarHBondContact O-CA 3.17Å; Y126-N215 PolarHBondContact N-O 2.82Å; Y126-N215 PolarHBondContact O-N 3.41Å
127	F	95.8	Very high	94.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.1	168.5	-68.7	-92.3	0	0	0	108.8	N114 V115 C117 I125 I130 L165 V177 V211 T212 P214	N114-F127 CarbonylContact C-O 3.26Å; N114-F127 VanDerWaalsContact CA-O 3.27Å; N114-F127 WeakPolarHBondContact CA-O 3.24Å; N114-F127 PolarHBondContact N-O 2.92Å; N114-F127 VanDerWaalsContact N-O 3.1Å; V115-F127 HydrophobicContact CB-CB 4.28Å; V115-F127 PolarHBondContact N-O 3.33Å; V115-F127 PolarHBondContact O-N 3.01Å; C117-F127 HydrophobicContact CB-CD2 4.18Å; C117-F127 HydrophobicContact CB-CE2 3.83Å; I125-F127 HydrophobicContact CD1-CE2 4.06Å; I125-F127 HydrophobicContact CD1-CZ 4.32Å; F127-I130 HydrophobicContact CB-CD1 4.15Å; F127-I130 HydrophobicContact CB-CG1 4.29Å; F127-L165 HydrophobicContact CD2-CD1 4.34Å; F127-L165 HydrophobicContact CD2-CD2 4.02Å; F127-L165 HydrophobicContact CE1-CD2 4.35Å; F127-L165 HydrophobicContact CE2-CD2 3.53Å; F127-L165 HydrophobicContact CZ-CD2 3.7Å; F127-V177 HydrophobicContact CZ-CG1 4.05Å; F127-V211 HydrophobicContact CD1-CG1 3.35Å; F127-V211 HydrophobicContact CE1-CG1 3.55Å; F127-V211 HydrophobicContact CG-CG1 4.36Å; F127-T212 WeakPolarHBondContact CD1-O 3.37Å; F127-P214 HydrophobicContact CD1-CB 3.92Å; F127-P214 HydrophobicContact CD1-CG 4.45Å; F127-P214 HydrophobicContact CD2-CB 4.31Å; F127-P214 HydrophobicContact CE1-CB 3.8Å; F127-P214 HydrophobicContact CE1-CG 3.9Å; F127-P214 HydrophobicContact CE2-CB 4.18Å; F127-P214 HydrophobicContact CG-CB 4.19Å; F127-P214 HydrophobicContact CZ-CB 3.94Å; F127-P214 HydrophobicContact CZ-CG 4.03Å
128	D	93.7	Very high	94.6	Very high	69 Å²	69	40.6 Å²	40.6	37%	0.369	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	-42.8	-175	-72	-14.7	0	0	0	111	K113 N114 N215	K113-D128 WeakPolarHBondContact CA-O 3.23Å; N114-D128 PolarHBondContact N-O 2.8Å; D128-N215 WeakPolarHBondContact OD1-CB 3.4Å
129	R	95.4	Very high	94.5	Very high	94 Å²	94	46.7 Å²	46.7	36%	0.355	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	137.4	179.3	-167.9	-169.1	-60.8	-148.5	-5.7	112.7	E111 V112 E131 T212	E111-R129 IonicContact OE1-CZ 3.41Å; E111-R129 IonicContact OE1-NH1 3.57Å; E111-R129 PolarHBondContact OE1-NH1 3.4Å; V112-R129 CarbonylContact O-C 3.51Å; V112-R129 WeakPolarHBondContact O-CA 3.3Å; R129-E131 WeakPolarHBondContact CD-OE1 3.31Å; R129-E131 HydrophobicContact CG-CG 4.01Å; R129-E131 IonicContact CZ-OE1 2.82Å; R129-E131 IonicContact NE-OE1 2.74Å; R129-E131 IonicContact NH1-OE1 3.88Å; R129-E131 PolarHBondContact NH1-OE1 3.31Å; R129-T212 HydrophobicContact CB-CG2 3.92Å; R129-T212 PolarHBondContact N-OG1 2.76Å; R129-T212 VanDerWaalsContact N-OG1 3.1Å; R129-T212 WeakPolarHBondContact O-CB 3.37Å; R129-T212 WeakPolarHBondContact O-CG2 3.49Å; R129-T212 PolarHBondContact O-N 3.5Å; R129-T212 PolarHBondContact O-OG1 3.14Å
130	I	96.2	Very high	94.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.5	167.6	-58.8	159.5	0	0	0	106.8	E111 V112 V115 F127 V132 I161 L165 L189 V209 R210 V211	E111-I130 WeakPolarHBondContact CA-O 3.37Å; V112-I130 HydrophobicContact CB-CB 4.34Å; V112-I130 PolarHBondContact N-O 3.01Å; V112-I130 PolarHBondContact O-N 3.25Å; V115-I130 HydrophobicContact CB-CD1 4.27Å; V115-I130 HydrophobicContact CG2-CD1 3.82Å; F127-I130 HydrophobicContact CB-CD1 4.15Å; F127-I130 HydrophobicContact CB-CG1 4.29Å; I130-V132 HydrophobicContact CG2-CG2 4.31Å; I130-I161 HydrophobicContact CD1-CG2 3.63Å; I130-I161 HydrophobicContact CG2-CD1 4.42Å; I130-I161 HydrophobicContact CG2-CG2 4.48Å; I130-L165 HydrophobicContact CD1-CD1 3.23Å; I130-L165 HydrophobicContact CG1-CD1 4.43Å; I130-L189 HydrophobicContact CG2-CD2 4.39Å; I130-V209 HydrophobicContact CG2-CG1 4.18Å; I130-R210 WeakPolarHBondContact CA-O 2.94Å; I130-V211 HydrophobicContact CG1-CG1 4.17Å; I130-V211 HydrophobicContact CG1-CG2 4.25Å; I130-V211 HydrophobicContact CG2-CG2 4.08Å
131	E	95.8	Very high	94.4	Very high	40 Å²	40	43.9 Å²	43.9	19%	0.187	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.2	179.2	-59.4	179.5	172.9	0	0	108.2	T109 D110 E111 R129 V209 R210	T109-E131 HydrophobicContact CG2-CB 3.93Å; T109-E131 HydrophobicContact CG2-CG 4.45Å; D110-E131 WeakPolarHBondContact O-CA 3.45Å; E111-E131 HydrophobicContact CG-CG 4.34Å; R129-E131 WeakPolarHBondContact CD-OE1 3.31Å; R129-E131 HydrophobicContact CG-CG 4.01Å; R129-E131 IonicContact CZ-OE1 2.82Å; R129-E131 IonicContact NE-OE1 2.74Å; R129-E131 IonicContact NH1-OE1 3.88Å; R129-E131 PolarHBondContact NH1-OE1 3.31Å; E131-V209 CarbonylContact O-C 3.57Å; E131-V209 WeakPolarHBondContact O-CA 3.29Å; E131-R210 HydrophobicContact CB-CB 4.38Å; E131-R210 PolarHBondContact N-O 3.12Å; E131-R210 PolarHBondContact O-N 2.92Å
132	V	96.4	Very high	94.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.5	174.5	179.2	0	0	0	0	108.6	T109 D110 I130 I157 I161 I206 V209	T109-V132 CarbonylContact C-O 3.44Å; T109-V132 WeakPolarHBondContact CA-O 3.36Å; D110-V132 PolarHBondContact N-O 3.47Å; D110-V132 PolarHBondContact O-N 3.48Å; I130-V132 HydrophobicContact CG2-CG2 4.31Å; V132-I157 HydrophobicContact CB-CG2 4.24Å; V132-I157 HydrophobicContact CG1-CG2 4.23Å; V132-I157 HydrophobicContact CG2-CG2 4.18Å; V132-I161 HydrophobicContact CG2-CD1 3.57Å; V132-I206 HydrophobicContact CG1-CD1 4.4Å; V132-I206 HydrophobicContact CG1-CG1 4.26Å; V132-I206 HydrophobicContact CG1-CG2 4.01Å; V132-V209 HydrophobicContact CG1-CG2 4.3Å; V132-V209 HydrophobicContact CG2-CG1 4.15Å; V132-V209 HydrophobicContact CG2-CG2 4.14Å
133	V	96.1	Very high	94.7	Very high	23 Å²	23	44.3 Å²	44.3	14%	0.139	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	114.2	175.4	-175.9	0	0	0	0	108.2	L107 Q108 T109 Q207 A208	L107-V133 HydrophobicContact CD2-CG1 3.38Å; Q108-V133 CarbonylContact O-C 3.49Å; Q108-V133 VanDerWaalsContact O-CA 3.24Å; Q108-V133 WeakPolarHBondContact O-CA 3.26Å; T109-V133 HydrophobicContact CG2-CG2 4.37Å; V133-Q207 HydrophobicContact CB-CB 4.37Å; V133-Q207 HydrophobicContact CG1-CB 4.06Å; V133-Q207 PolarHBondContact O-N 3.41Å; V133-A208 HydrophobicContact CB-CB 4.42Å; V133-A208 PolarHBondContact N-O 3.33Å; V133-A208 PolarHBondContact O-N 2.94Å
134	N	94.6	Very high	94.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	163.9	-178.5	62.5	-21.1	0	0	0	111.3	Q108 D110 I157 L204 V205	Q108-N134 WeakPolarHBondContact CB-OD1 3.43Å; Q108-N134 PolarHBondContact N-O 2.99Å; Q108-N134 PolarHBondContact O-N 3.45Å; Q108-N134 PolarHBondContact O-OD1 3.09Å; D110-N134 PolarHBondContact OD2-ND2 3.25Å; D110-N134 PolarHBondContact OD2-OD1 2.93Å; N134-I157 HydrophobicContact CB-CD1 4.46Å; N134-I157 WeakPolarHBondContact ND2-CD1 3.36Å; N134-L204 HydrophobicContact CB-CD1 4.37Å; N134-V205 CarbonylContact C-O 3.58Å; N134-V205 VanDerWaalsContact CA-O 3.26Å; N134-V205 WeakPolarHBondContact CA-O 3.28Å
135	F	94.6	Very high	94.8	Very high	62 Å²	62	38.6 Å²	38.6	27%	0.272	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149.3	164.2	71.8	-84.5	0	0	0	109.7	V137 V205	F135-V137 HydrophobicContact CE2-CG2 4.11Å; F135-V205 HydrophobicContact CD1-CB 4.11Å; F135-V205 HydrophobicContact CD1-CG1 4.45Å; F135-V205 HydrophobicContact CE1-CB 3.56Å; F135-V205 HydrophobicContact CE1-CG1 3.61Å; F135-V205 HydrophobicContact CE1-CG2 4.36Å; F135-V205 HydrophobicContact CE2-CB 4.31Å; F135-V205 HydrophobicContact CE2-CG2 4.38Å; F135-V205 HydrophobicContact CZ-CB 3.67Å; F135-V205 HydrophobicContact CZ-CG1 3.93Å; F135-V205 HydrophobicContact CZ-CG2 3.96Å; F135-V205 PolarHBondContact N-O 3.48Å; F135-V205 PolarHBondContact O-N 3.41Å
136	L	94.8	Very high	94.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.6	-179.3	173.1	55.9	0	0	0	110.2	V103 T105 A140 V141 I144 Y152 L204	V103-L136 HydrophobicContact CG1-CD2 3.77Å; T105-L136 VanDerWaalsContact CB-O 3.28Å; T105-L136 WeakPolarHBondContact CB-O 3.48Å; L136-A140 HydrophobicContact CD1-CB 4.29Å; L136-V141 HydrophobicContact CD2-CB 4.46Å; L136-V141 HydrophobicContact CD2-CG2 3.75Å; L136-V141 HydrophobicContact CG-CG2 3.86Å; L136-I144 HydrophobicContact CD1-CD1 3.29Å; L136-Y152 HydrophobicContact CD2-CE1 3.89Å; L136-L204 HydrophobicContact CB-CD1 4.23Å
137	V	94.8	Very high	94.6	Very high	50 Å²	50	44.6 Å²	44.6	30%	0.303	23%	0.225	S	C	.	.			trans	-65.8	129.1	176.8	179.5	0	0	0	0	110	F135 N139 A140 G203	F135-V137 HydrophobicContact CE2-CG2 4.11Å; V137-N139 HydrophobicContact CG1-CB 4.44Å; V137-N139 PolarHBondContact O-N 3.18Å; V137-A140 PolarHBondContact O-N 2.84Å; V137-G203 WeakPolarHBondContact CG2-O 3.23Å; V137-G203 PolarHBondContact N-O 2.77Å
138	P	92.9	Very high	94.5	Very high	62 Å²	62	47.3 Å²	47.3	40%	0.403	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-47	-40.7	-179	-37.1	40	0	0	0	115.8	I72 A140 V141	I72-P138 HydrophobicContact CD1-CB 3.52Å; I72-P138 HydrophobicContact CD1-CG 4.11Å; P138-A140 VanDerWaalsContact C-N 3.27Å; P138-A140 PolarHBondContact O-N 3.25Å; P138-V141 WeakPolarHBondContact O-CG2 3.39Å; P138-V141 PolarHBondContact O-N 3.16Å
139	N	93.2	Very high	94.4	Very high	149 Å²	149	48 Å²	48	80%	0.797	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-69.6	-23.6	-176	-61.6	-22.8	0	0	0	113.1	V137	V137-N139 HydrophobicContact CG1-CB 4.44Å; V137-N139 PolarHBondContact O-N 3.18Å
140	A	94.7	Very high	94.1	Very high	11 Å²	11	44.2 Å²	44.2	9%	0.091	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-93.8	-6.5	-177.6	0	0	0	0	0	113.3	L136 V137 P138 Y142 D143 I144 P202	L136-A140 HydrophobicContact CD1-CB 4.29Å; V137-A140 PolarHBondContact O-N 2.84Å; P138-A140 VanDerWaalsContact C-N 3.27Å; P138-A140 PolarHBondContact O-N 3.25Å; A140-Y142 VanDerWaalsContact C-N 3.33Å; A140-Y142 PolarHBondContact O-N 2.82Å; A140-D143 PolarHBondContact O-N 2.85Å; A140-I144 HydrophobicContact CB-CD1 4.09Å; A140-I144 PolarHBondContact O-N 3.44Å; A140-P202 VanDerWaalsContact CB-O 3.29Å; A140-P202 WeakPolarHBondContact CB-O 3.44Å
141	V	94.5	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-44.4	-175.4	173.7	0	0	0	0	111.8	I72 V74 V103 T105 L136 P138 D143 V145	I72-V141 HydrophobicContact CB-CG1 4.49Å; I72-V141 HydrophobicContact CD1-CG2 4.17Å; I72-V141 HydrophobicContact CG2-CG1 4.19Å; V74-V141 HydrophobicContact CG2-CG1 3.72Å; V103-V141 HydrophobicContact CB-CG1 4.16Å; V103-V141 HydrophobicContact CG1-CG1 4.29Å; V103-V141 HydrophobicContact CG2-CG1 4.42Å; T105-V141 HydrophobicContact CG2-CG2 3.61Å; L136-V141 HydrophobicContact CD2-CB 4.46Å; L136-V141 HydrophobicContact CD2-CG2 3.75Å; L136-V141 HydrophobicContact CG-CG2 3.86Å; P138-V141 WeakPolarHBondContact O-CG2 3.39Å; P138-V141 PolarHBondContact O-N 3.16Å; V141-D143 PolarHBondContact O-N 3.48Å; V141-V145 HydrophobicContact CG1-CG2 4.27Å; V141-V145 WeakPolarHBondContact O-CB 3.36Å; V141-V145 VanDerWaalsContact O-CG2 3.23Å; V141-V145 WeakPolarHBondContact O-CG2 3.27Å; V141-V145 PolarHBondContact O-N 3.45Å
142	Y	94.3	Very high	93.7	Very high	48 Å²	48	46.3 Å²	46.3	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-48	-179.4	174.5	-102.4	0	0	0	112.1	L81 L82 T83 A140 V145 K146	L81-Y142 HydrophobicContact CD2-CD2 3.94Å; L81-Y142 HydrophobicContact CD2-CE2 3.63Å; L81-Y142 HydrophobicContact CG-CD2 4.32Å; L81-Y142 HydrophobicContact CG-CE2 3.87Å; L82-Y142 VanDerWaalsContact O-CE2 3.27Å; L82-Y142 WeakPolarHBondContact O-CE2 3.32Å; T83-Y142 VanDerWaalsContact CA-CE2 3.47Å; T83-Y142 HydrophobicContact CG2-CE2 4.32Å; A140-Y142 VanDerWaalsContact C-N 3.33Å; A140-Y142 PolarHBondContact O-N 2.82Å; Y142-V145 PolarHBondContact O-N 3.27Å; Y142-K146 HydrophobicContact CE1-CD 4.07Å; Y142-K146 VanDerWaalsContact O-CB 3.25Å; Y142-K146 WeakPolarHBondContact O-CB 3.36Å; Y142-K146 PolarHBondContact O-N 2.95Å
143	D	94.1	Very high	93.5	Very high	87 Å²	87	48.1 Å²	48.1	47%	0.465	25%	0.254	S	S	.	.	H	α-helix	trans	-68.3	-40	-176.7	-67.6	-35.3	0	0	0	111.9	A140 V141 K146 N147	A140-D143 PolarHBondContact O-N 2.85Å; V141-D143 PolarHBondContact O-N 3.48Å; D143-K146 PolarHBondContact O-N 2.69Å; D143-N147 WeakPolarHBondContact O-CB 3.29Å; D143-N147 PolarHBondContact O-N 2.91Å; D143-N147 PolarHBondContact O-ND2 2.83Å
144	I	94.4	Very high	93.3	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-45.4	178	-73.6	168.5	0	0	0	110.8	L136 A140 K146 N147 Y148 Y152 A201 L204	L136-I144 HydrophobicContact CD1-CD1 3.29Å; A140-I144 HydrophobicContact CB-CD1 4.09Å; A140-I144 PolarHBondContact O-N 3.44Å; I144-K146 VanDerWaalsContact C-N 3.28Å; I144-K146 PolarHBondContact O-N 3.17Å; I144-N147 PolarHBondContact O-N 3.33Å; I144-Y148 WeakPolarHBondContact O-CA 3.35Å; I144-Y148 WeakPolarHBondContact O-CB 3.42Å; I144-Y148 PolarHBondContact O-N 3.19Å; I144-Y152 HydrophobicContact CG2-CD1 3.79Å; I144-Y152 HydrophobicContact CG2-CD2 4.2Å; I144-Y152 HydrophobicContact CG2-CE1 4.44Å; I144-Y152 HydrophobicContact CG2-CG 3.68Å; I144-A201 HydrophobicContact CD1-CB 4.17Å; I144-A201 HydrophobicContact CG1-CB 4.17Å; I144-L204 HydrophobicContact CD1-CB 4.26Å
145	V	94.4	Very high	93.1	Very high	4 Å²	4	56 Å²	56	2%	0.024	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-32.6	177.6	175.5	0	0	0	0	111.7	V74 Y76 L81 V103 V141 Y142 T149	V74-V145 HydrophobicContact CG1-CG1 4.08Å; V74-V145 HydrophobicContact CG2-CG2 4.4Å; Y76-V145 WeakPolarHBondContact OH-CG1 3.4Å; L81-V145 HydrophobicContact CD1-CG1 4.11Å; L81-V145 HydrophobicContact CD2-CG1 4.22Å; V103-V145 HydrophobicContact CG2-CG2 3.86Å; V141-V145 HydrophobicContact CG1-CG2 4.27Å; V141-V145 WeakPolarHBondContact O-CB 3.36Å; V141-V145 VanDerWaalsContact O-CG2 3.23Å; V141-V145 WeakPolarHBondContact O-CG2 3.27Å; V141-V145 PolarHBondContact O-N 3.45Å; Y142-V145 PolarHBondContact O-N 3.27Å; V145-T149 WeakPolarHBondContact O-CA 3.46Å; V145-T149 PolarHBondContact O-N 2.87Å
146	K	93.5	Very high	93	Very high	126 Å²	126	53.5 Å²	53.5	55%	0.548	29%	0.285	S	S	.	.	H	α-helix	trans	-67.5	-43.7	176	-175.9	179.5	176.9	-178.1	0	112.3	L81 Y142 D143 I144	L81-K146 HydrophobicContact CD2-CB 3.79Å; L81-K146 HydrophobicContact CD2-CG 4.43Å; Y142-K146 HydrophobicContact CE1-CD 4.07Å; Y142-K146 VanDerWaalsContact O-CB 3.25Å; Y142-K146 WeakPolarHBondContact O-CB 3.36Å; Y142-K146 PolarHBondContact O-N 2.95Å; D143-K146 PolarHBondContact O-N 2.69Å; I144-K146 VanDerWaalsContact C-N 3.28Å; I144-K146 PolarHBondContact O-N 3.17Å
147	N	93.5	Very high	93	Very high	107 Å²	107	53.6 Å²	53.6	57%	0.572	29%	0.285	S	S	*	.	H	α-helix	trans	-85.5	-35	-174.8	-66.6	-19.5	0	0	0	112.9	D143 I144	D143-N147 WeakPolarHBondContact O-CB 3.29Å; D143-N147 PolarHBondContact O-N 2.91Å; D143-N147 PolarHBondContact O-ND2 2.83Å; I144-N147 PolarHBondContact O-N 3.33Å
148	Y	92.5	Very high	92.9	Very high	58 Å²	58	54.9 Å²	54.9	23%	0.227	29%	0.287	C	S	.	.	H	α-helix	trans	-122.3	3.7	-170.6	-60.5	-74.5	0	0	0	114.3	I144 L156 M200 A201	I144-Y148 WeakPolarHBondContact O-CA 3.35Å; I144-Y148 WeakPolarHBondContact O-CB 3.42Å; I144-Y148 PolarHBondContact O-N 3.19Å; Y148-L156 HydrophobicContact CD1-CD1 4.41Å; Y148-L156 HydrophobicContact CD1-CD2 3.8Å; Y148-L156 HydrophobicContact CD1-CG 4.09Å; Y148-L156 HydrophobicContact CD2-CD1 3.94Å; Y148-L156 HydrophobicContact CD2-CD2 4.39Å; Y148-L156 HydrophobicContact CD2-CG 4.49Å; Y148-L156 HydrophobicContact CE1-CD2 3.59Å; Y148-L156 HydrophobicContact CE1-CG 4.38Å; Y148-L156 HydrophobicContact CE2-CD1 4.31Å; Y148-L156 HydrophobicContact CE2-CD2 4.2Å; Y148-L156 HydrophobicContact CG-CD1 3.99Å; Y148-L156 HydrophobicContact CG-CD2 4.21Å; Y148-L156 HydrophobicContact CG-CG 4.15Å; Y148-M200 HydrophobicContact CE1-CE 4.14Å; Y148-M200 PolarHBondContact OH-O 2.84Å; Y148-A201 HydrophobicContact CE2-CB 4.24Å
149	T	92.3	Very high	92.9	Very high	83 Å²	83	56.4 Å²	56.4	51%	0.509	29%	0.291	S	S	.	.			trans	66.7	178.1	-174.3	80.7	0	0	0	0	113.5	V145 D151	V145-T149 WeakPolarHBondContact O-CA 3.46Å; V145-T149 PolarHBondContact O-N 2.87Å; T149-D151 PolarHBondContact O-N 2.92Å; T149-D151 PolarHBondContact OG1-N 3.4Å
150	A	89.1	Confident	92.9	Very high	14 Å²	14	51.1 Å²	51.1	12%	0.116	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.6	178.9	0	0	0	0	0	113.7	K101 Y152	K101-A150 HydrophobicContact CB-CB 4.3Å; K101-A150 HydrophobicContact CD-CB 3.31Å; K101-A150 HydrophobicContact CG-CB 4.43Å; A150-Y152 VanDerWaalsContact C-N 3.31Å; A150-Y152 PolarHBondContact O-N 3.22Å
151	D	91	Very high	92.9	Very high	80 Å²	80	50.6 Å²	50.6	43%	0.428	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	44.2	-179.6	-55.9	-8.9	0	0	0	110.1	K101 T149 D153 K154	K101-D151 IonicContact NZ-OD1 2.75Å; K101-D151 PolarHBondContact NZ-OD1 3.03Å; T149-D151 PolarHBondContact O-N 2.92Å; T149-D151 PolarHBondContact OG1-N 3.4Å; D151-D153 PolarHBondContact O-N 3.15Å; D151-K154 PolarHBondContact O-N 3.44Å
152	Y	92.1	Very high	92.9	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-28.4	-172.5	63.6	-95.9	0	0	0	112.8	V103 L136 I144 A150 K154 A155 L156 L204	V103-Y152 HydrophobicContact CG1-CE1 3.9Å; L136-Y152 HydrophobicContact CD2-CE1 3.89Å; I144-Y152 HydrophobicContact CG2-CD1 3.79Å; I144-Y152 HydrophobicContact CG2-CD2 4.2Å; I144-Y152 HydrophobicContact CG2-CE1 4.44Å; I144-Y152 HydrophobicContact CG2-CG 3.68Å; A150-Y152 VanDerWaalsContact C-N 3.31Å; A150-Y152 PolarHBondContact O-N 3.22Å; Y152-K154 PolarHBondContact O-N 3.41Å; Y152-A155 PolarHBondContact O-N 2.92Å; Y152-A155 VanDerWaalsContact O-N 3.13Å; Y152-L156 HydrophobicContact CD2-CD1 4.29Å; Y152-L156 WeakPolarHBondContact O-CB 3.42Å; Y152-L156 PolarHBondContact O-N 3.45Å; Y152-L204 HydrophobicContact CD2-CD2 4.02Å; Y152-L204 HydrophobicContact CE2-CD1 3.9Å; Y152-L204 HydrophobicContact CE2-CD2 3.93Å
153	D	92.3	Very high	92.9	Very high	39 Å²	39	55.3 Å²	55.3	21%	0.209	28%	0.28	C	S	.	.	H	α-helix	trans	-56.3	-37.5	-179.5	-52	-50.3	0	0	0	112.2	D151 I157 F158	D151-D153 PolarHBondContact O-N 3.15Å; D153-I157 WeakPolarHBondContact O-CA 3.41Å; D153-I157 VanDerWaalsContact O-CB 3.31Å; D153-I157 WeakPolarHBondContact O-CB 3.34Å; D153-I157 PolarHBondContact O-N 2.86Å; D153-F158 PolarHBondContact O-N 3.31Å
154	K	91.4	Very high	92.9	Very high	139 Å²	139	53 Å²	53	60%	0.604	27%	0.267	S	S	*	.	I	π-helix	trans	-66.1	-43.4	179.5	-70.7	179.2	-178.3	170.2	0	112.1	D151 Y152 F158 N159	D151-K154 PolarHBondContact O-N 3.44Å; Y152-K154 PolarHBondContact O-N 3.41Å; K154-F158 WeakPolarHBondContact O-CB 3.45Å; K154-N159 VanDerWaalsContact O-CG 3.24Å; K154-N159 PolarHBondContact O-N 3.49Å; K154-N159 VanDerWaalsContact O-N 3.1Å; K154-N159 PolarHBondContact O-ND2 3.13Å
155	A	90.5	Very high	92.9	Very high	48 Å²	48	53 Å²	53	40%	0.397	27%	0.267	S	S	.	.	I	π-helix	trans	-78.2	-44	-175.8	0	0	0	0	0	111.9	Y152	Y152-A155 PolarHBondContact O-N 2.92Å; Y152-A155 VanDerWaalsContact O-N 3.13Å
156	L	92.9	Very high	92.9	Very high	11 Å²	11	55.8 Å²	55.8	6%	0.058	28%	0.281	C	S	.	.	I	π-helix	trans	-87.9	-37.4	-172	-67.2	178.3	0	0	0	113.3	Y148 Y152 K160 L197 M200 A201 L204	Y148-L156 HydrophobicContact CD1-CD1 4.41Å; Y148-L156 HydrophobicContact CD1-CD2 3.8Å; Y148-L156 HydrophobicContact CD1-CG 4.09Å; Y148-L156 HydrophobicContact CD2-CD1 3.94Å; Y148-L156 HydrophobicContact CD2-CD2 4.39Å; Y148-L156 HydrophobicContact CD2-CG 4.49Å; Y148-L156 HydrophobicContact CE1-CD2 3.59Å; Y148-L156 HydrophobicContact CE1-CG 4.38Å; Y148-L156 HydrophobicContact CE2-CD1 4.31Å; Y148-L156 HydrophobicContact CE2-CD2 4.2Å; Y148-L156 HydrophobicContact CG-CD1 3.99Å; Y148-L156 HydrophobicContact CG-CD2 4.21Å; Y148-L156 HydrophobicContact CG-CG 4.15Å; Y152-L156 HydrophobicContact CD2-CD1 4.29Å; Y152-L156 WeakPolarHBondContact O-CB 3.42Å; Y152-L156 PolarHBondContact O-N 3.45Å; L156-K160 VanDerWaalsContact O-CB 3.24Å; L156-K160 WeakPolarHBondContact O-CB 3.31Å; L156-L197 HydrophobicContact CB-CD2 4.01Å; L156-L197 HydrophobicContact CD1-CD2 4.33Å; L156-L197 HydrophobicContact CD2-CD2 4.47Å; L156-M200 HydrophobicContact CD2-CE 3.95Å; L156-A201 HydrophobicContact CD1-CB 3.7Å; L156-L204 HydrophobicContact CD1-CD2 4.16Å
157	I	94.1	Very high	92.9	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	28%	0.279	C	S	.	.	I	π-helix	trans	-102.9	-61.9	-174.3	-59.5	173.1	0	0	0	110	D110 V132 N134 D153 N159 K160 I161 L204	D110-I157 WeakPolarHBondContact OD2-CD1 3.23Å; V132-I157 HydrophobicContact CB-CG2 4.24Å; V132-I157 HydrophobicContact CG1-CG2 4.23Å; V132-I157 HydrophobicContact CG2-CG2 4.18Å; N134-I157 HydrophobicContact CB-CD1 4.46Å; N134-I157 WeakPolarHBondContact ND2-CD1 3.36Å; D153-I157 WeakPolarHBondContact O-CA 3.41Å; D153-I157 VanDerWaalsContact O-CB 3.31Å; D153-I157 WeakPolarHBondContact O-CB 3.34Å; D153-I157 PolarHBondContact O-N 2.86Å; I157-N159 PolarHBondContact O-N 3.04Å; I157-K160 PolarHBondContact O-N 3.27Å; I157-I161 HydrophobicContact CG2-CD1 3.58Å; I157-I161 HydrophobicContact CG2-CG1 4.38Å; I157-I161 VanDerWaalsContact O-CG1 3.3Å; I157-I161 WeakPolarHBondContact O-CG1 3.44Å; I157-I161 PolarHBondContact O-N 2.95Å; I157-L204 HydrophobicContact CD1-CD2 4.29Å; I157-L204 HydrophobicContact CG1-CD2 4.5Å
158	F	93.2	Very high	92.9	Very high	77 Å²	77	51.3 Å²	51.3	34%	0.338	26%	0.259	S	S	.	.	I	π-helix	trans	-57.9	-54.9	-173.4	177.6	-86	0	0	0	112.2	V112 D153 K154 K160 I161 H162	V112-F158 HydrophobicContact CB-CD2 4.18Å; V112-F158 HydrophobicContact CG1-CD2 3.55Å; V112-F158 HydrophobicContact CG1-CE2 3.58Å; V112-F158 HydrophobicContact CG2-CB 4.45Å; V112-F158 HydrophobicContact CG2-CD2 3.76Å; D153-F158 PolarHBondContact O-N 3.31Å; K154-F158 WeakPolarHBondContact O-CB 3.45Å; F158-K160 PolarHBondContact O-N 2.91Å; F158-I161 PolarHBondContact O-N 3.47Å; F158-H162 AromaticContact CD1-CD2 3.7Å; F158-H162 AromaticContact CE1-CD2 3.4Å; F158-H162 VanDerWaalsContact CE1-CD2 3.4Å; F158-H162 WeakPolarHBondContact CE1-CD2 3.42Å; F158-H162 AromaticContact CE1-NE2 3.35Å; F158-H162 WeakPolarHBondContact CE1-NE2 3.25Å; F158-H162 AromaticContact CE2-NE2 3.54Å; F158-H162 AromaticContact CZ-CD2 3.6Å; F158-H162 AromaticContact CZ-NE2 3.04Å; F158-H162 WeakPolarHBondContact CZ-NE2 3.28Å; F158-H162 PolarHBondContact O-CD2 3.23Å; F158-H162 VanDerWaalsContact O-CD2 3.25Å; F158-H162 PolarHBondContact O-N 2.86Å; F158-H162 VanDerWaalsContact O-N 3.14Å
159	N	92.7	Very high	93.1	Very high	94 Å²	94	48.6 Å²	48.6	50%	0.503	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-35.7	-179.6	-71.8	-19.1	0	0	0	112.2	K154 I157 H162 H163	K154-N159 VanDerWaalsContact O-CG 3.24Å; K154-N159 PolarHBondContact O-N 3.49Å; K154-N159 VanDerWaalsContact O-N 3.1Å; K154-N159 PolarHBondContact O-ND2 3.13Å; I157-N159 PolarHBondContact O-N 3.04Å; N159-H162 PolarHBondContact O-N 3.14Å; N159-H163 PolarHBondContact O-N 2.68Å; N159-H163 VanDerWaalsContact O-N 3.14Å
160	K	93.5	Very high	93.2	Very high	38 Å²	38	47.7 Å²	47.7	17%	0.165	25%	0.245	C	C	.	.	H	α-helix	trans	-71.4	-41.7	-179.3	-173.7	62.9	-174.6	-178.8	0	111.9	L156 I157 F158 H162 H163 E164 L193 D196	L156-K160 VanDerWaalsContact O-CB 3.24Å; L156-K160 WeakPolarHBondContact O-CB 3.31Å; I157-K160 PolarHBondContact O-N 3.27Å; F158-K160 PolarHBondContact O-N 2.91Å; K160-H162 VanDerWaalsContact C-N 3.31Å; K160-H162 PolarHBondContact O-N 3.43Å; K160-H163 PolarHBondContact O-N 2.98Å; K160-H163 VanDerWaalsContact O-N 3.12Å; K160-E164 HydrophobicContact CD-CG 4.14Å; K160-E164 VanDerWaalsContact CE-CG 3.47Å; K160-E164 WeakPolarHBondContact CE-OE1 3.34Å; K160-E164 HydrophobicContact CG-CG 4.29Å; K160-E164 IonicContact NZ-OE1 3.86Å; K160-E164 PolarHBondContact NZ-OE1 3.38Å; K160-E164 WeakPolarHBondContact O-CG 3.42Å; K160-E164 PolarHBondContact O-N 2.86Å; K160-L193 HydrophobicContact CB-CD2 3.76Å; K160-L193 HydrophobicContact CG-CD2 3.43Å; K160-L193 VanDerWaalsContact CG-CD2 3.43Å; K160-D196 WeakPolarHBondContact CE-OD2 3.29Å; K160-D196 IonicContact NZ-OD2 2.68Å; K160-D196 PolarHBondContact NZ-OD2 3.3Å
161	I	95.6	Very high	93.5	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-55.7	-47.9	172.5	-70.6	165.7	0	0	0	110.5	V112 I130 V132 I157 F158 H163 E164 L165 L189 L193	V112-I161 HydrophobicContact CG2-CD1 3.81Å; I130-I161 HydrophobicContact CD1-CG2 3.63Å; I130-I161 HydrophobicContact CG2-CD1 4.42Å; I130-I161 HydrophobicContact CG2-CG2 4.48Å; V132-I161 HydrophobicContact CG2-CD1 3.57Å; I157-I161 HydrophobicContact CG2-CD1 3.58Å; I157-I161 HydrophobicContact CG2-CG1 4.38Å; I157-I161 VanDerWaalsContact O-CG1 3.3Å; I157-I161 WeakPolarHBondContact O-CG1 3.44Å; I157-I161 PolarHBondContact O-N 2.95Å; F158-I161 PolarHBondContact O-N 3.47Å; I161-H163 VanDerWaalsContact C-N 3.28Å; I161-H163 PolarHBondContact O-N 2.87Å; I161-E164 PolarHBondContact O-N 2.95Å; I161-L165 HydrophobicContact CG2-CD1 3.86Å; I161-L165 WeakPolarHBondContact O-CB 3.32Å; I161-L165 PolarHBondContact O-N 2.89Å; I161-L189 HydrophobicContact CG1-CD1 4.45Å; I161-L189 HydrophobicContact CG1-CD2 4.48Å; I161-L189 HydrophobicContact CG2-CD2 4.36Å; I161-L193 HydrophobicContact CG1-CD1 3.96Å; I161-L193 HydrophobicContact CG1-CD2 4.13Å
162	H	94.3	Very high	93.7	Very high	38 Å²	38	50.2 Å²	50.2	18%	0.176	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-40.1	177.4	-85.5	-83	0	0	0	112.6	F158 N159 K160 N166	F158-H162 AromaticContact CD1-CD2 3.7Å; F158-H162 AromaticContact CE1-CD2 3.4Å; F158-H162 VanDerWaalsContact CE1-CD2 3.4Å; F158-H162 WeakPolarHBondContact CE1-CD2 3.42Å; F158-H162 AromaticContact CE1-NE2 3.35Å; F158-H162 WeakPolarHBondContact CE1-NE2 3.25Å; F158-H162 AromaticContact CE2-NE2 3.54Å; F158-H162 AromaticContact CZ-CD2 3.6Å; F158-H162 AromaticContact CZ-NE2 3.04Å; F158-H162 WeakPolarHBondContact CZ-NE2 3.28Å; F158-H162 PolarHBondContact O-CD2 3.23Å; F158-H162 VanDerWaalsContact O-CD2 3.25Å; F158-H162 PolarHBondContact O-N 2.86Å; F158-H162 VanDerWaalsContact O-N 3.14Å; N159-H162 PolarHBondContact O-N 3.14Å; K160-H162 VanDerWaalsContact C-N 3.31Å; K160-H162 PolarHBondContact O-N 3.43Å; H162-N166 WeakPolarHBondContact O-CB 3.44Å; H162-N166 PolarHBondContact O-N 3.46Å; H162-N166 PolarHBondContact O-ND2 2.9Å
163	H	93.8	Very high	93.9	Very high	108 Å²	108	52.6 Å²	52.6	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-69.5	-51.2	178.6	-179.4	66.4	0	0	0	112.1	N159 K160 I161 N166 Q167	N159-H163 PolarHBondContact O-N 2.68Å; N159-H163 VanDerWaalsContact O-N 3.14Å; K160-H163 PolarHBondContact O-N 2.98Å; K160-H163 VanDerWaalsContact O-N 3.12Å; I161-H163 VanDerWaalsContact C-N 3.28Å; I161-H163 PolarHBondContact O-N 2.87Å; H163-N166 PolarHBondContact O-N 3.44Å; H163-Q167 PolarHBondContact O-N 3.35Å
164	E	94.8	Very high	94	Very high	40 Å²	40	51.3 Å²	51.3	19%	0.187	27%	0.267	C	S	.	.	H	α-helix	trans	-65	-42	-176.8	-72.1	-58.8	149	0	0	112.6	K160 I161 Q167 F168 L189 A192	K160-E164 HydrophobicContact CD-CG 4.14Å; K160-E164 VanDerWaalsContact CE-CG 3.47Å; K160-E164 WeakPolarHBondContact CE-OE1 3.34Å; K160-E164 HydrophobicContact CG-CG 4.29Å; K160-E164 IonicContact NZ-OE1 3.86Å; K160-E164 PolarHBondContact NZ-OE1 3.38Å; K160-E164 WeakPolarHBondContact O-CG 3.42Å; K160-E164 PolarHBondContact O-N 2.86Å; I161-E164 PolarHBondContact O-N 2.95Å; E164-Q167 PolarHBondContact O-N 3.4Å; E164-F168 WeakPolarHBondContact O-CB 3.46Å; E164-F168 PolarHBondContact O-N 3.31Å; E164-L189 HydrophobicContact CB-CD1 3.81Å; E164-A192 HydrophobicContact CG-CB 4.26Å
165	L	94.6	Very high	94	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-45.4	175.9	-99.9	161.5	0	0	0	111.7	V115 C117 F127 I130 I161 Q167 F168 C169 I185	V115-L165 HydrophobicContact CG1-CD1 4.22Å; C117-L165 PolarHBondContact SG-O 3.24Å; F127-L165 HydrophobicContact CD2-CD1 4.34Å; F127-L165 HydrophobicContact CD2-CD2 4.02Å; F127-L165 HydrophobicContact CE1-CD2 4.35Å; F127-L165 HydrophobicContact CE2-CD2 3.53Å; F127-L165 HydrophobicContact CZ-CD2 3.7Å; I130-L165 HydrophobicContact CD1-CD1 3.23Å; I130-L165 HydrophobicContact CG1-CD1 4.43Å; I161-L165 HydrophobicContact CG2-CD1 3.86Å; I161-L165 WeakPolarHBondContact O-CB 3.32Å; I161-L165 PolarHBondContact O-N 2.89Å; L165-Q167 VanDerWaalsContact C-N 3.28Å; L165-Q167 PolarHBondContact O-N 3.35Å; L165-F168 PolarHBondContact O-N 3.1Å; L165-C169 PolarHBondContact O-N 3.26Å; L165-C169 PolarHBondContact O-SG 3.38Å; L165-I185 HydrophobicContact CD2-CG2 4.31Å
166	N	93.3	Very high	94.1	Very high	62 Å²	62	46.7 Å²	46.7	33%	0.332	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-38.8	177.9	-83.3	-50.7	0	0	0	111.8	P116 C117 H162 H163 S170	P116-N166 PolarHBondContact O-OD1 2.93Å; C117-N166 WeakPolarHBondContact CA-OD1 3.4Å; H162-N166 WeakPolarHBondContact O-CB 3.44Å; H162-N166 PolarHBondContact O-N 3.46Å; H162-N166 PolarHBondContact O-ND2 2.9Å; H163-N166 PolarHBondContact O-N 3.44Å; N166-S170 VanDerWaalsContact O-CB 3.28Å; N166-S170 WeakPolarHBondContact O-CB 3.48Å; N166-S170 PolarHBondContact O-N 2.86Å; N166-S170 PolarHBondContact O-OG 3.09Å
167	Q	93.8	Very high	94.2	Very high	105 Å²	105	46.1 Å²	46.1	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-46.8	173.7	-177.6	168	-17	0	0	111.2	H163 E164 L165 S170	H163-Q167 PolarHBondContact O-N 3.35Å; E164-Q167 PolarHBondContact O-N 3.4Å; L165-Q167 VanDerWaalsContact C-N 3.28Å; L165-Q167 PolarHBondContact O-N 3.35Å; Q167-S170 PolarHBondContact O-N 2.93Å; Q167-S170 PolarHBondContact O-OG 3.5Å
168	F	94.3	Very high	94.1	Very high	35 Å²	35	48.9 Å²	48.9	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-49.9	176.9	-175.8	-93.6	0	0	0	112.2	E164 L165 S170 V171 H172 V177 L181 I185	E164-F168 WeakPolarHBondContact O-CB 3.46Å; E164-F168 PolarHBondContact O-N 3.31Å; L165-F168 PolarHBondContact O-N 3.1Å; F168-S170 VanDerWaalsContact C-N 3.31Å; F168-S170 PolarHBondContact O-N 2.89Å; F168-V171 PolarHBondContact O-N 2.96Å; F168-H172 AromaticContact CD2-CE1 3.87Å; F168-H172 AromaticContact CD2-ND1 3.95Å; F168-H172 AromaticContact CE2-CE1 3.55Å; F168-H172 AromaticContact CE2-ND1 3.82Å; F168-H172 AromaticContact CZ-CE1 3.88Å; F168-H172 AromaticContact CZ-ND1 3.86Å; F168-H172 PolarHBondContact O-N 3.32Å; F168-H172 PolarHBondContact O-ND1 2.81Å; F168-V177 HydrophobicContact CD1-CG2 4.44Å; F168-V177 HydrophobicContact CE1-CG2 4.07Å; F168-L181 HydrophobicContact CZ-CB 4.25Å; F168-L181 HydrophobicContact CZ-CD1 4.49Å; F168-I185 HydrophobicContact CD1-CD1 4.37Å; F168-I185 HydrophobicContact CD1-CG1 4.16Å; F168-I185 HydrophobicContact CE1-CD1 3.78Å; F168-I185 HydrophobicContact CE1-CG1 3.51Å; F168-I185 HydrophobicContact CZ-CD1 4.47Å; F168-I185 HydrophobicContact CZ-CG1 3.77Å
169	C	95.2	Very high	93.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66	-32	179.8	-61.5	0	0	0	0	112.7	C117 G118 T119 S120 L165 V171 H172	C117-C169 HydrophobicContact CB-CB 3.93Å; C117-C169 WeakPolarHBondContact CB-SG 3.45Å; C117-C169 WeakPolarHBondContact SG-CB 3.39Å; C117-C169 CovalentContact SG-SG 2.03Å; C117-C169 PolarHBondContact SG-SG 2.95Å; G118-C169 CarbonylContact O-C 3.56Å; G118-C169 VanDerWaalsContact O-C 3.26Å; G118-C169 VanDerWaalsContact O-CB 3.26Å; G118-C169 WeakPolarHBondContact O-CB 3.35Å; T119-C169 CarbonylContact C-O 3.52Å; T119-C169 VanDerWaalsContact CA-O 3.29Å; T119-C169 WeakPolarHBondContact CA-O 3.25Å; S120-C169 PolarHBondContact N-O 2.93Å; S120-C169 VanDerWaalsContact N-O 3.14Å; L165-C169 PolarHBondContact O-N 3.26Å; L165-C169 PolarHBondContact O-SG 3.38Å; C169-V171 PolarHBondContact O-N 3.47Å; C169-H172 PolarHBondContact O-N 3.41Å
170	S	95.5	Very high	93.8	Very high	65 Å²	65	49.8 Å²	49.8	46%	0.455	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-27.1	-178.2	70.8	0	0	0	0	113.4	G118 S120 N166 Q167 F168	G118-S170 PolarHBondContact O-N 3.3Å; S120-S170 VanDerWaalsContact CB-O 3.31Å; S120-S170 WeakPolarHBondContact CB-O 3.45Å; N166-S170 VanDerWaalsContact O-CB 3.28Å; N166-S170 WeakPolarHBondContact O-CB 3.48Å; N166-S170 PolarHBondContact O-N 2.86Å; N166-S170 PolarHBondContact O-OG 3.09Å; Q167-S170 PolarHBondContact O-N 2.93Å; Q167-S170 PolarHBondContact O-OG 3.5Å; F168-S170 VanDerWaalsContact C-N 3.31Å; F168-S170 PolarHBondContact O-N 2.89Å
171	V	95.6	Very high	93.8	Very high	104 Å²	104	49.6 Å²	49.6	63%	0.63	25%	0.251	S	S	*	.	H	α-helix	trans	-90.6	-27.7	179.8	-175.5	0	0	0	0	111.6	F168 C169	F168-V171 PolarHBondContact O-N 2.96Å; C169-V171 PolarHBondContact O-N 3.47Å
172	H	95.6	Very high	93.6	Very high	42 Å²	42	51.5 Å²	51.5	19%	0.194	26%	0.26	C	S	.	.	S	Bend	trans	-105.2	149.9	-172.4	-62.8	91.7	0	0	0	113.4	S120 F168 C169 E176 V177 L181	S120-H172 PolarHBondContact N-O 2.83Å; S120-H172 PolarHBondContact OG-O 3.25Å; S120-H172 VanDerWaalsContact OG-O 3.05Å; F168-H172 AromaticContact CD2-CE1 3.87Å; F168-H172 AromaticContact CD2-ND1 3.95Å; F168-H172 AromaticContact CE2-CE1 3.55Å; F168-H172 AromaticContact CE2-ND1 3.82Å; F168-H172 AromaticContact CZ-CE1 3.88Å; F168-H172 AromaticContact CZ-ND1 3.86Å; F168-H172 PolarHBondContact O-N 3.32Å; F168-H172 PolarHBondContact O-ND1 2.81Å; C169-H172 PolarHBondContact O-N 3.41Å; H172-E176 WeakPolarHBondContact CA-OE2 3.32Å; H172-E176 HydrophobicContact CB-CB 4.29Å; H172-E176 IonicContact CD2-OE2 3.95Å; H172-E176 IonicContact CG-OE2 4Å; H172-V177 HydrophobicContact CB-CG2 3.58Å; H172-L181 WeakPolarHBondContact CD2-CD1 3.4Å; H172-L181 WeakPolarHBondContact NE2-CD1 3.38Å
173	T	95.8	Very high	93.4	Very high	55 Å²	55	54.9 Å²	54.9	34%	0.337	28%	0.279	S	S	.	.			trans	-76.9	163.6	175.6	70.4	0	0	0	0	111.5	S120 Q175 E176 V177	S120-T173 WeakPolarHBondContact OG-CA 3.48Å; S120-T173 PolarHBondContact OG-N 2.92Å; T173-Q175 VanDerWaalsContact C-N 3.25Å; T173-Q175 PolarHBondContact O-N 3.5Å; T173-E176 PolarHBondContact N-OE2 2.99Å; T173-E176 PolarHBondContact O-N 2.75Å; T173-E176 WeakPolarHBondContact OG1-CG 3.32Å; T173-E176 PolarHBondContact OG1-N 3.43Å; T173-E176 PolarHBondContact OG1-OE2 3.41Å; T173-V177 WeakPolarHBondContact O-CG2 3.39Å; T173-V177 PolarHBondContact O-N 2.69Å
174	L	93.8	Very high	93.4	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-55.8	-40.1	175.6	-179.5	66.9	0	0	0	112.8	T119 V123 I125 Y178 I216 I220 Y224	T119-L174 HydrophobicContact CG2-CB 4.27Å; T119-L174 HydrophobicContact CG2-CD1 4.18Å; V123-L174 HydrophobicContact CG1-CD2 4.34Å; I125-L174 HydrophobicContact CG2-CD1 3.34Å; L174-Y178 WeakPolarHBondContact O-CB 3.31Å; L174-Y178 PolarHBondContact O-N 2.9Å; L174-I216 HydrophobicContact CD1-CD1 3.87Å; L174-I216 HydrophobicContact CD1-CG1 4.1Å; L174-I216 HydrophobicContact CD2-CD1 4.39Å; L174-I216 HydrophobicContact CD2-CG2 4.25Å; L174-I216 HydrophobicContact CG-CD1 4.29Å; L174-I220 HydrophobicContact CD2-CG2 3.75Å; L174-Y224 HydrophobicContact CD2-CE2 3.6Å; L174-Y224 HydrophobicContact CG-CE2 4.42Å
175	Q	91.4	Very high	93.3	Very high	30 Å²	30	52.4 Å²	52.4	14%	0.14	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-44.5	-179.5	175.4	64.8	5.9	0	0	111.5	T173 Y178 I179 Y224	T173-Q175 VanDerWaalsContact C-N 3.25Å; T173-Q175 PolarHBondContact O-N 3.5Å; Q175-Y178 PolarHBondContact O-N 3.14Å; Q175-I179 PolarHBondContact O-N 3.02Å; Q175-Y224 HydrophobicContact CB-CE1 4.36Å
176	E	93.4	Very high	93.3	Very high	60 Å²	60	54.1 Å²	54.1	28%	0.28	28%	0.277	S	S	.	.	I	π-helix	trans	-62.3	-49.3	178.4	-72.9	164.7	176	0	0	110.8	H172 T173 Y178 E180 L181	H172-E176 WeakPolarHBondContact CA-OE2 3.32Å; H172-E176 HydrophobicContact CB-CB 4.29Å; H172-E176 IonicContact CD2-OE2 3.95Å; H172-E176 IonicContact CG-OE2 4Å; T173-E176 PolarHBondContact N-OE2 2.99Å; T173-E176 PolarHBondContact O-N 2.75Å; T173-E176 WeakPolarHBondContact OG1-CG 3.32Å; T173-E176 PolarHBondContact OG1-N 3.43Å; T173-E176 PolarHBondContact OG1-OE2 3.41Å; E176-Y178 VanDerWaalsContact C-N 3.33Å; E176-Y178 PolarHBondContact O-N 3.48Å; E176-E180 PolarHBondContact O-N 3.46Å; E176-E180 VanDerWaalsContact O-N 3.11Å; E176-L181 HydrophobicContact CB-CD1 4.1Å; E176-L181 PolarHBondContact O-N 3.03Å
177	V	93.9	Very high	93.3	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-65.3	-35.3	-179.5	177.8	0	0	0	0	112.3	I125 F127 F168 H172 T173 I185	I125-V177 HydrophobicContact CD1-CG1 4.01Å; F127-V177 HydrophobicContact CZ-CG1 4.05Å; F168-V177 HydrophobicContact CD1-CG2 4.44Å; F168-V177 HydrophobicContact CE1-CG2 4.07Å; H172-V177 HydrophobicContact CB-CG2 3.58Å; T173-V177 WeakPolarHBondContact O-CG2 3.39Å; T173-V177 PolarHBondContact O-N 2.69Å; V177-I185 HydrophobicContact CG1-CD1 4.02Å
178	Y	92.3	Very high	93.3	Very high	60 Å²	60	54.5 Å²	54.5	24%	0.235	28%	0.279	C	S	.	.	I	π-helix	trans	-86.5	-32.4	-174.2	-170.9	-107.7	0	0	0	114.2	L174 Q175 E176 K213 P214 I216	L174-Y178 WeakPolarHBondContact O-CB 3.31Å; L174-Y178 PolarHBondContact O-N 2.9Å; Q175-Y178 PolarHBondContact O-N 3.14Å; E176-Y178 VanDerWaalsContact C-N 3.33Å; E176-Y178 PolarHBondContact O-N 3.48Å; Y178-K213 HydrophobicContact CE2-CB 4.42Å; Y178-K213 HydrophobicContact CE2-CD 4.41Å; Y178-P214 HydrophobicContact CD2-CG 4.01Å; Y178-I216 HydrophobicContact CD1-CD1 4.22Å; Y178-I216 HydrophobicContact CD2-CD1 3.57Å; Y178-I216 HydrophobicContact CD2-CG1 4.34Å; Y178-I216 HydrophobicContact CE1-CD1 4.44Å; Y178-I216 HydrophobicContact CE2-CD1 3.8Å; Y178-I216 HydrophobicContact CE2-CG1 4.43Å; Y178-I216 HydrophobicContact CG-CD1 3.79Å
179	I	89.7	Confident	93.3	Very high	78 Å²	78	53.2 Å²	53.2	40%	0.4	27%	0.274	S	S	.	.	I	π-helix	trans	-120.7	-53.4	-172.6	-52.6	-163.7	0	0	0	112.1	Q175	Q175-I179 PolarHBondContact O-N 3.02Å
180	E	91.1	Very high	93.3	Very high	112 Å²	112	56.1 Å²	56.1	52%	0.523	29%	0.287	S	S	.	.	I	π-helix	trans	-85.4	-37	-163.1	-56.5	-176.8	172.8	0	0	114.2	E176	E176-E180 PolarHBondContact O-N 3.46Å; E176-E180 VanDerWaalsContact O-N 3.11Å
181	L	93.3	Very high	93.3	Very high	33 Å²	33	58.2 Å²	58.2	17%	0.173	29%	0.292	C	S	.	.	S	Bend	trans	-116.7	8.7	-173.4	-63.7	172	0	0	0	112.9	F168 H172 E176 D183 Q184 I185	F168-L181 HydrophobicContact CZ-CB 4.25Å; F168-L181 HydrophobicContact CZ-CD1 4.49Å; H172-L181 WeakPolarHBondContact CD2-CD1 3.4Å; H172-L181 WeakPolarHBondContact NE2-CD1 3.38Å; E176-L181 HydrophobicContact CB-CD1 4.1Å; E176-L181 PolarHBondContact O-N 3.03Å; L181-D183 VanDerWaalsContact C-N 3.27Å; L181-D183 PolarHBondContact O-N 2.76Å; L181-Q184 PolarHBondContact O-N 3.02Å; L181-I185 WeakPolarHBondContact O-CG1 3.43Å; L181-I185 PolarHBondContact O-N 2.86Å
182	F	91.2	Very high	93.3	Very high	40 Å²	40	54.2 Å²	54.2	18%	0.175	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-39.1	-175.3	176	-102.2	0	0	0	112.5	Q184 I185 V211 K213	F182-Q184 VanDerWaalsContact C-N 3.28Å; F182-Q184 PolarHBondContact O-N 2.91Å; F182-I185 HydrophobicContact CD2-CD1 4.3Å; F182-I185 PolarHBondContact O-N 3.41Å; F182-V211 VanDerWaalsContact CZ-O 3.27Å; F182-V211 WeakPolarHBondContact CZ-O 3.26Å; F182-K213 HydrophobicContact CD1-CG 4.48Å; F182-K213 HydrophobicContact CD2-CG 4.33Å; F182-K213 HydrophobicContact CE1-CG 3.97Å; F182-K213 HydrophobicContact CE2-CB 4.32Å; F182-K213 HydrophobicContact CE2-CG 3.82Å; F182-K213 HydrophobicContact CZ-CB 4.4Å; F182-K213 HydrophobicContact CZ-CG 3.61Å
183	D	90	Very high	93.3	Very high	110 Å²	110	52.3 Å²	52.3	59%	0.588	26%	0.261	S	S	*	.	H	α-helix	trans	-65.8	-28.4	176.8	61.5	-31.8	0	0	0	113.2	L181	L181-D183 VanDerWaalsContact C-N 3.27Å; L181-D183 PolarHBondContact O-N 2.76Å
184	Q	92.5	Very high	93.3	Very high	92 Å²	92	52 Å²	52	43%	0.43	26%	0.256	S	S	.	.	H	α-helix	trans	-81.9	-19.5	-179.8	-59.9	-178.1	19.7	0	0	113.1	L181 F182 D186 E187 N188	L181-Q184 PolarHBondContact O-N 3.02Å; F182-Q184 VanDerWaalsContact C-N 3.28Å; F182-Q184 PolarHBondContact O-N 2.91Å; Q184-D186 VanDerWaalsContact C-N 3.31Å; Q184-D186 PolarHBondContact O-N 2.88Å; Q184-E187 PolarHBondContact O-N 3.41Å; Q184-N188 VanDerWaalsContact O-CB 3.3Å; Q184-N188 WeakPolarHBondContact O-CB 3.25Å; Q184-N188 PolarHBondContact O-N 2.91Å; Q184-N188 PolarHBondContact O-ND2 3.19Å
185	I	93.8	Very high	93.3	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-43.5	-179.2	-63	173.1	0	0	0	110.5	L165 F168 V177 L181 F182 E187 N188 L189 V211	L165-I185 HydrophobicContact CD2-CG2 4.31Å; F168-I185 HydrophobicContact CD1-CD1 4.37Å; F168-I185 HydrophobicContact CD1-CG1 4.16Å; F168-I185 HydrophobicContact CE1-CD1 3.78Å; F168-I185 HydrophobicContact CE1-CG1 3.51Å; F168-I185 HydrophobicContact CZ-CD1 4.47Å; F168-I185 HydrophobicContact CZ-CG1 3.77Å; V177-I185 HydrophobicContact CG1-CD1 4.02Å; L181-I185 WeakPolarHBondContact O-CG1 3.43Å; L181-I185 PolarHBondContact O-N 2.86Å; F182-I185 HydrophobicContact CD2-CD1 4.3Å; F182-I185 PolarHBondContact O-N 3.41Å; I185-E187 PolarHBondContact O-N 3.47Å; I185-N188 PolarHBondContact O-N 3.48Å; I185-L189 WeakPolarHBondContact O-CB 3.42Å; I185-L189 PolarHBondContact O-N 3.25Å; I185-V211 HydrophobicContact CG2-CB 4.45Å; I185-V211 HydrophobicContact CG2-CG1 4.44Å; I185-V211 HydrophobicContact CG2-CG2 4.04Å
186	D	94.1	Very high	93.5	Very high	38 Å²	38	59.2 Å²	59.2	20%	0.203	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-50.2	-177.9	-73.3	-12.9	0	0	0	111.7	Q184 K190 V211	Q184-D186 VanDerWaalsContact C-N 3.31Å; Q184-D186 PolarHBondContact O-N 2.88Å; D186-K190 WeakPolarHBondContact O-CB 3.46Å; D186-K190 PolarHBondContact O-N 2.89Å; D186-V211 WeakPolarHBondContact OD1-CB 3.33Å; D186-V211 VanDerWaalsContact OD1-CG2 3.26Å; D186-V211 WeakPolarHBondContact OD1-CG2 3.37Å; D186-V211 PolarHBondContact OD1-N 2.77Å
187	E	93.3	Very high	93.5	Very high	103 Å²	103	56.6 Å²	56.6	48%	0.481	28%	0.279	S	S	.	.	H	α-helix	trans	-72.1	-41.4	-178.9	-71.5	-60	148.4	0	0	112.2	Q184 I185 L189 K190 L191	Q184-E187 PolarHBondContact O-N 3.41Å; I185-E187 PolarHBondContact O-N 3.47Å; E187-L189 VanDerWaalsContact C-N 3.33Å; E187-L189 PolarHBondContact O-N 3.16Å; E187-K190 PolarHBondContact O-N 3.4Å; E187-K190 IonicContact OE2-NZ 3.13Å; E187-L191 WeakPolarHBondContact O-CB 3.47Å; E187-L191 VanDerWaalsContact O-CG 3.29Å; E187-L191 WeakPolarHBondContact O-CG 3.22Å; E187-L191 PolarHBondContact O-N 3.22Å
188	N	93.6	Very high	93.5	Very high	73 Å²	73	61.1 Å²	61.1	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-43.8	177	-73.2	-25.7	0	0	0	111.4	Q184 I185 L191 A192	Q184-N188 VanDerWaalsContact O-CB 3.3Å; Q184-N188 WeakPolarHBondContact O-CB 3.25Å; Q184-N188 PolarHBondContact O-N 2.91Å; Q184-N188 PolarHBondContact O-ND2 3.19Å; I185-N188 PolarHBondContact O-N 3.48Å; N188-L191 PolarHBondContact O-N 3.48Å; N188-A192 WeakPolarHBondContact O-CB 3.38Å; N188-A192 PolarHBondContact O-N 2.87Å
189	L	95	Very high	93.6	Very high	8 Å²	8	62.7 Å²	62.7	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-66.7	-42.1	178.9	-174.5	57.1	0	0	0	111.3	I130 I161 E164 I185 E187 L191 L193 V209 V211	I130-L189 HydrophobicContact CG2-CD2 4.39Å; I161-L189 HydrophobicContact CG1-CD1 4.45Å; I161-L189 HydrophobicContact CG1-CD2 4.48Å; I161-L189 HydrophobicContact CG2-CD2 4.36Å; E164-L189 HydrophobicContact CB-CD1 3.81Å; I185-L189 WeakPolarHBondContact O-CB 3.42Å; I185-L189 PolarHBondContact O-N 3.25Å; E187-L189 VanDerWaalsContact C-N 3.33Å; E187-L189 PolarHBondContact O-N 3.16Å; L189-L191 PolarHBondContact O-N 3.45Å; L189-L193 HydrophobicContact CD1-CD1 4.05Å; L189-L193 HydrophobicContact CD1-CG 4.07Å; L189-L193 HydrophobicContact CG-CD1 3.9Å; L189-L193 HydrophobicContact CG-CG 4.38Å; L189-L193 WeakPolarHBondContact O-CB 3.31Å; L189-L193 WeakPolarHBondContact O-CD1 3.26Å; L189-L193 WeakPolarHBondContact O-CG 3.37Å; L189-L193 PolarHBondContact O-N 3.33Å; L189-V209 HydrophobicContact CB-CG1 4.45Å; L189-V209 HydrophobicContact CD2-CG1 3.77Å; L189-V209 HydrophobicContact CG-CG1 4.16Å; L189-V211 HydrophobicContact CD2-CG2 4.08Å
190	K	95.3	Very high	93.7	Very high	60 Å²	60	63.2 Å²	63.2	26%	0.261	33%	0.328	S	S	.	.	H	α-helix	trans	-58.4	-48.1	174	175.7	-173.1	166.5	-164.3	0	111.9	D186 E187 Q194 I206 V209	D186-K190 WeakPolarHBondContact O-CB 3.46Å; D186-K190 PolarHBondContact O-N 2.89Å; E187-K190 PolarHBondContact O-N 3.4Å; E187-K190 IonicContact OE2-NZ 3.13Å; K190-Q194 VanDerWaalsContact O-CB 3.3Å; K190-Q194 WeakPolarHBondContact O-CB 3.34Å; K190-Q194 PolarHBondContact O-N 2.93Å; K190-I206 HydrophobicContact CG-CG2 4.3Å; K190-V209 HydrophobicContact CB-CB 4.33Å; K190-V209 HydrophobicContact CB-CG2 3.87Å
191	L	95.8	Very high	93.8	Very high	110 Å²	110	57.9 Å²	57.9	58%	0.576	30%	0.303	S	S	*	.	H	α-helix	trans	-64.6	-46.7	-179.4	-71	173.9	0	0	0	111.6	E187 N188 L189 Q194 Q195	E187-L191 WeakPolarHBondContact O-CB 3.47Å; E187-L191 VanDerWaalsContact O-CG 3.29Å; E187-L191 WeakPolarHBondContact O-CG 3.22Å; E187-L191 PolarHBondContact O-N 3.22Å; N188-L191 PolarHBondContact O-N 3.48Å; L189-L191 PolarHBondContact O-N 3.45Å; L191-Q194 PolarHBondContact O-N 3.41Å; L191-Q195 WeakPolarHBondContact O-CB 3.32Å; L191-Q195 PolarHBondContact O-N 2.9Å
192	A	94.9	Very high	93.8	Very high	19 Å²	19	60.8 Å²	60.8	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-45.8	178.9	0	0	0	0	0	111.8	E164 N188 Q195 D196	E164-A192 HydrophobicContact CG-CB 4.26Å; N188-A192 WeakPolarHBondContact O-CB 3.38Å; N188-A192 PolarHBondContact O-N 2.87Å; A192-Q195 PolarHBondContact O-N 2.99Å; A192-D196 PolarHBondContact O-N 3.28Å
193	L	95.3	Very high	93.8	Very high	2 Å²	2	60 Å²	60	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-63.6	-45.1	177	-68.3	169.1	0	0	0	111.4	K160 I161 L189 Q195 D196 L197 I206 V209	K160-L193 HydrophobicContact CB-CD2 3.76Å; K160-L193 HydrophobicContact CG-CD2 3.43Å; K160-L193 VanDerWaalsContact CG-CD2 3.43Å; I161-L193 HydrophobicContact CG1-CD1 3.96Å; I161-L193 HydrophobicContact CG1-CD2 4.13Å; L189-L193 HydrophobicContact CD1-CD1 4.05Å; L189-L193 HydrophobicContact CD1-CG 4.07Å; L189-L193 HydrophobicContact CG-CD1 3.9Å; L189-L193 HydrophobicContact CG-CG 4.38Å; L189-L193 WeakPolarHBondContact O-CB 3.31Å; L189-L193 WeakPolarHBondContact O-CD1 3.26Å; L189-L193 WeakPolarHBondContact O-CG 3.37Å; L189-L193 PolarHBondContact O-N 3.33Å; L193-Q195 PolarHBondContact O-N 3.28Å; L193-D196 PolarHBondContact O-N 3.48Å; L193-L197 WeakPolarHBondContact O-CB 3.35Å; L193-L197 VanDerWaalsContact O-CG 3.24Å; L193-L197 WeakPolarHBondContact O-CG 3.48Å; L193-L197 PolarHBondContact O-N 3.32Å; L193-I206 HydrophobicContact CB-CD1 3.2Å; L193-I206 HydrophobicContact CD1-CD1 3.88Å; L193-I206 HydrophobicContact CG-CD1 4.12Å; L193-V209 HydrophobicContact CD1-CG2 4.2Å
194	Q	95.3	Very high	94	Very high	49 Å²	49	54.8 Å²	54.8	23%	0.229	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-38.2	-179.3	-173.9	58.8	57.9	0	0	112.1	K190 L191 D196 L197 T198	K190-Q194 VanDerWaalsContact O-CB 3.3Å; K190-Q194 WeakPolarHBondContact O-CB 3.34Å; K190-Q194 PolarHBondContact O-N 2.93Å; L191-Q194 PolarHBondContact O-N 3.41Å; Q194-D196 VanDerWaalsContact C-N 3.35Å; Q194-D196 PolarHBondContact O-N 2.8Å; Q194-L197 PolarHBondContact O-N 3.32Å; Q194-T198 PolarHBondContact NE2-OG1 3.02Å; Q194-T198 WeakPolarHBondContact O-CB 3.48Å; Q194-T198 PolarHBondContact O-N 2.93Å; Q194-T198 PolarHBondContact O-OG1 3.05Å
195	Q	95.3	Very high	94.1	Very high	145 Å²	145	52.6 Å²	52.6	68%	0.678	29%	0.292	S	S	*	.	H	α-helix	trans	-59.7	-46.5	177.3	-179.6	174.2	-11.9	0	0	111.2	L191 A192 L193 T198	L191-Q195 WeakPolarHBondContact O-CB 3.32Å; L191-Q195 PolarHBondContact O-N 2.9Å; A192-Q195 PolarHBondContact O-N 2.99Å; L193-Q195 PolarHBondContact O-N 3.28Å; Q195-T198 PolarHBondContact O-N 2.89Å
196	D	93.9	Very high	94.3	Very high	48 Å²	48	52.8 Å²	52.8	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-45.2	179.2	-84.2	18.9	0	0	0	112	K160 A192 L193 Q194 T198 S199 M200	K160-D196 WeakPolarHBondContact CE-OD2 3.29Å; K160-D196 IonicContact NZ-OD2 2.68Å; K160-D196 PolarHBondContact NZ-OD2 3.3Å; A192-D196 PolarHBondContact O-N 3.28Å; L193-D196 PolarHBondContact O-N 3.48Å; Q194-D196 VanDerWaalsContact C-N 3.35Å; Q194-D196 PolarHBondContact O-N 2.8Å; D196-T198 PolarHBondContact O-N 3.18Å; D196-S199 PolarHBondContact O-N 3.29Å; D196-S199 PolarHBondContact O-OG 3.36Å; D196-M200 PolarHBondContact O-N 3.39Å
197	L	94.4	Very high	94.3	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-33.1	178.1	-71.4	-179.5	0	0	0	112.7	L156 L193 Q194 S199 M200 A201 L204 I206	L156-L197 HydrophobicContact CB-CD2 4.01Å; L156-L197 HydrophobicContact CD1-CD2 4.33Å; L156-L197 HydrophobicContact CD2-CD2 4.47Å; L193-L197 WeakPolarHBondContact O-CB 3.35Å; L193-L197 VanDerWaalsContact O-CG 3.24Å; L193-L197 WeakPolarHBondContact O-CG 3.48Å; L193-L197 PolarHBondContact O-N 3.32Å; Q194-L197 PolarHBondContact O-N 3.32Å; L197-S199 PolarHBondContact O-N 3.25Å; L197-M200 PolarHBondContact O-N 2.86Å; L197-A201 HydrophobicContact CD2-CB 4.32Å; L197-A201 CarbonylContact O-C 3.52Å; L197-A201 WeakPolarHBondContact O-CA 3.46Å; L197-A201 PolarHBondContact O-N 3.38Å; L197-L204 HydrophobicContact CD1-CB 4.48Å; L197-L204 HydrophobicContact CD1-CD2 3.99Å; L197-L204 HydrophobicContact CD1-CG 4.03Å; L197-L204 HydrophobicContact CD2-CD2 3.86Å; L197-I206 HydrophobicContact CD1-CD1 3.49Å; L197-I206 VanDerWaalsContact CD1-CD1 3.49Å; L197-I206 HydrophobicContact CD1-CG1 3.73Å
198	T	94.2	Very high	94.4	Very high	94 Å²	94	52.8 Å²	52.8	58%	0.577	30%	0.297	S	S	*	.	H	α-helix	trans	-61.1	-31.5	176.2	-56.4	0	0	0	0	111.9	Q194 Q195 D196	Q194-T198 PolarHBondContact NE2-OG1 3.02Å; Q194-T198 WeakPolarHBondContact O-CB 3.48Å; Q194-T198 PolarHBondContact O-N 2.93Å; Q194-T198 PolarHBondContact O-OG1 3.05Å; Q195-T198 PolarHBondContact O-N 2.89Å; D196-T198 PolarHBondContact O-N 3.18Å
199	S	93.1	Very high	94.5	Very high	94 Å²	94	49.7 Å²	49.7	66%	0.657	28%	0.281	S	S	*	.	H	α-helix	trans	-90.7	-37	177.8	73.2	0	0	0	0	113.7	D196 L197	D196-S199 PolarHBondContact O-N 3.29Å; D196-S199 PolarHBondContact O-OG 3.36Å; L197-S199 PolarHBondContact O-N 3.25Å
200	M	91.9	Very high	94.5	Very high	88 Å²	88	56.5 Å²	56.5	43%	0.433	31%	0.306	S	S	.	.	H	α-helix	trans	-90.1	-43.4	-172	-69	-175.2	68	0	0	113.5	Y148 L156 D196 L197	Y148-M200 HydrophobicContact CE1-CE 4.14Å; Y148-M200 PolarHBondContact OH-O 2.84Å; L156-M200 HydrophobicContact CD2-CE 3.95Å; D196-M200 PolarHBondContact O-N 3.39Å; L197-M200 PolarHBondContact O-N 2.86Å
201	A	93.3	Very high	94.5	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	30%	0.297	C	S	.	.	S	Bend	trans	-139.1	73	-170.6	0	0	0	0	0	110.4	I144 Y148 L156 L197 G203 L204	I144-A201 HydrophobicContact CD1-CB 4.17Å; I144-A201 HydrophobicContact CG1-CB 4.17Å; Y148-A201 HydrophobicContact CE2-CB 4.24Å; L156-A201 HydrophobicContact CD1-CB 3.7Å; L197-A201 HydrophobicContact CD2-CB 4.32Å; L197-A201 CarbonylContact O-C 3.52Å; L197-A201 WeakPolarHBondContact O-CA 3.46Å; L197-A201 PolarHBondContact O-N 3.38Å; A201-G203 PolarHBondContact O-N 3.38Å; A201-L204 HydrophobicContact CB-CB 4.49Å; A201-L204 PolarHBondContact O-N 3.27Å
202	P	93.6	Very high	94.5	Very high	94 Å²	94	51.5 Å²	51.5	61%	0.61	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	122.6	179.6	26.4	-34	0	0	0	109.9	A140	A140-P202 VanDerWaalsContact CB-O 3.29Å; A140-P202 WeakPolarHBondContact CB-O 3.44Å
203	G	91.6	Very high	94.4	Very high	23 Å²	23	56 Å²	56	24%	0.237	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	110.7	-9.7	-177.7	0	0	0	0	0	114.9	V137 A201	V137-G203 WeakPolarHBondContact CG2-O 3.23Å; V137-G203 PolarHBondContact N-O 2.77Å; A201-G203 PolarHBondContact O-N 3.38Å
204	L	94.8	Very high	94.3	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.3	164.2	-173.6	60.9	0	0	0	109.2	N134 L136 I144 Y152 L156 I157 L197 A201	N134-L204 HydrophobicContact CB-CD1 4.37Å; L136-L204 HydrophobicContact CB-CD1 4.23Å; I144-L204 HydrophobicContact CD1-CB 4.26Å; Y152-L204 HydrophobicContact CD2-CD2 4.02Å; Y152-L204 HydrophobicContact CE2-CD1 3.9Å; Y152-L204 HydrophobicContact CE2-CD2 3.93Å; L156-L204 HydrophobicContact CD1-CD2 4.16Å; I157-L204 HydrophobicContact CD1-CD2 4.29Å; I157-L204 HydrophobicContact CG1-CD2 4.5Å; L197-L204 HydrophobicContact CD1-CB 4.48Å; L197-L204 HydrophobicContact CD1-CD2 3.99Å; L197-L204 HydrophobicContact CD1-CG 4.03Å; L197-L204 HydrophobicContact CD2-CD2 3.86Å; A201-L204 HydrophobicContact CB-CB 4.49Å; A201-L204 PolarHBondContact O-N 3.27Å
205	V	94.8	Very high	94.3	Very high	45 Å²	45	57 Å²	57	27%	0.273	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.8	-175.1	-178.6	0	0	0	0	109.8	N134 F135	N134-V205 CarbonylContact C-O 3.58Å; N134-V205 VanDerWaalsContact CA-O 3.26Å; N134-V205 WeakPolarHBondContact CA-O 3.28Å; F135-V205 HydrophobicContact CD1-CB 4.11Å; F135-V205 HydrophobicContact CD1-CG1 4.45Å; F135-V205 HydrophobicContact CE1-CB 3.56Å; F135-V205 HydrophobicContact CE1-CG1 3.61Å; F135-V205 HydrophobicContact CE1-CG2 4.36Å; F135-V205 HydrophobicContact CE2-CB 4.31Å; F135-V205 HydrophobicContact CE2-CG2 4.38Å; F135-V205 HydrophobicContact CZ-CB 3.67Å; F135-V205 HydrophobicContact CZ-CG1 3.93Å; F135-V205 HydrophobicContact CZ-CG2 3.96Å; F135-V205 PolarHBondContact N-O 3.48Å; F135-V205 PolarHBondContact O-N 3.41Å
206	I	96.1	Very high	94.2	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.041	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119.3	174.2	-64.2	172.4	0	0	0	108.6	V132 K190 L193 L197 V209	V132-I206 HydrophobicContact CG1-CD1 4.4Å; V132-I206 HydrophobicContact CG1-CG1 4.26Å; V132-I206 HydrophobicContact CG1-CG2 4.01Å; K190-I206 HydrophobicContact CG-CG2 4.3Å; L193-I206 HydrophobicContact CB-CD1 3.2Å; L193-I206 HydrophobicContact CD1-CD1 3.88Å; L193-I206 HydrophobicContact CG-CD1 4.12Å; L197-I206 HydrophobicContact CD1-CD1 3.49Å; L197-I206 VanDerWaalsContact CD1-CD1 3.49Å; L197-I206 HydrophobicContact CD1-CG1 3.73Å; I206-V209 HydrophobicContact CG2-CG2 3.8Å
207	Q	94.4	Very high	94.2	Very high	109 Å²	109	51.1 Å²	51.1	51%	0.509	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-49	178.8	-174.6	62	44.8	0	0	111.2	L107 V133	L107-Q207 HydrophobicContact CD2-CB 4.29Å; L107-Q207 HydrophobicContact CD2-CG 4.46Å; V133-Q207 HydrophobicContact CB-CB 4.37Å; V133-Q207 HydrophobicContact CG1-CB 4.06Å; V133-Q207 PolarHBondContact O-N 3.41Å
208	A	95.6	Very high	94.1	Very high	32 Å²	32	57.7 Å²	57.7	26%	0.264	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	151.7	-176.9	0	0	0	0	0	110.8	V133	V133-A208 HydrophobicContact CB-CB 4.42Å; V133-A208 PolarHBondContact N-O 3.33Å; V133-A208 PolarHBondContact O-N 2.94Å
209	V	96.3	Very high	93.9	Very high	9 Å²	9	56.1 Å²	56.1	6%	0.055	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.6	171.5	-179.6	0	0	0	0	107.2	I130 E131 V132 L189 K190 L193 I206 V211	I130-V209 HydrophobicContact CG2-CG1 4.18Å; E131-V209 CarbonylContact O-C 3.57Å; E131-V209 WeakPolarHBondContact O-CA 3.29Å; V132-V209 HydrophobicContact CG1-CG2 4.3Å; V132-V209 HydrophobicContact CG2-CG1 4.15Å; V132-V209 HydrophobicContact CG2-CG2 4.14Å; L189-V209 HydrophobicContact CB-CG1 4.45Å; L189-V209 HydrophobicContact CD2-CG1 3.77Å; L189-V209 HydrophobicContact CG-CG1 4.16Å; K190-V209 HydrophobicContact CB-CB 4.33Å; K190-V209 HydrophobicContact CB-CG2 3.87Å; L193-V209 HydrophobicContact CD1-CG2 4.2Å; I206-V209 HydrophobicContact CG2-CG2 3.8Å; V209-V211 HydrophobicContact CG1-CG2 4.23Å
210	R	95.4	Very high	93.8	Very high	151 Å²	151	53.9 Å²	53.9	57%	0.57	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.1	175.4	-63	177.4	-179.5	169.6	-0.1	109.1	I130 E131	I130-R210 WeakPolarHBondContact CA-O 2.94Å; E131-R210 HydrophobicContact CB-CB 4.38Å; E131-R210 PolarHBondContact N-O 3.12Å; E131-R210 PolarHBondContact O-N 2.92Å
211	V	95.4	Very high	93.8	Very high	10 Å²	10	53.8 Å²	53.8	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.9	177.2	-179	0	0	0	0	109	F127 I130 F182 I185 D186 L189 V209	F127-V211 HydrophobicContact CD1-CG1 3.35Å; F127-V211 HydrophobicContact CE1-CG1 3.55Å; F127-V211 HydrophobicContact CG-CG1 4.36Å; I130-V211 HydrophobicContact CG1-CG1 4.17Å; I130-V211 HydrophobicContact CG1-CG2 4.25Å; I130-V211 HydrophobicContact CG2-CG2 4.08Å; F182-V211 VanDerWaalsContact CZ-O 3.27Å; F182-V211 WeakPolarHBondContact CZ-O 3.26Å; I185-V211 HydrophobicContact CG2-CB 4.45Å; I185-V211 HydrophobicContact CG2-CG1 4.44Å; I185-V211 HydrophobicContact CG2-CG2 4.04Å; D186-V211 WeakPolarHBondContact OD1-CB 3.33Å; D186-V211 VanDerWaalsContact OD1-CG2 3.26Å; D186-V211 WeakPolarHBondContact OD1-CG2 3.37Å; D186-V211 PolarHBondContact OD1-N 2.77Å; L189-V211 HydrophobicContact CD2-CG2 4.08Å; V209-V211 HydrophobicContact CG1-CG2 4.23Å
212	T	94.3	Very high	93.7	Very high	54 Å²	54	60.7 Å²	60.7	33%	0.331	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-80.2	154.2	170.1	62.8	0	0	0	0	110.8	F127 R129	F127-T212 WeakPolarHBondContact CD1-O 3.37Å; R129-T212 HydrophobicContact CB-CG2 3.92Å; R129-T212 PolarHBondContact N-OG1 2.76Å; R129-T212 VanDerWaalsContact N-OG1 3.1Å; R129-T212 WeakPolarHBondContact O-CB 3.37Å; R129-T212 WeakPolarHBondContact O-CG2 3.49Å; R129-T212 PolarHBondContact O-N 3.5Å; R129-T212 PolarHBondContact O-OG1 3.14Å
213	K	93.6	Very high	93.6	Very high	115 Å²	115	61.1 Å²	61.1	50%	0.5	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-54.5	138.5	175.9	-71.3	-165.4	174.8	-162	0	111.7	Y178 F182	Y178-K213 HydrophobicContact CE2-CB 4.42Å; Y178-K213 HydrophobicContact CE2-CD 4.41Å; F182-K213 HydrophobicContact CD1-CG 4.48Å; F182-K213 HydrophobicContact CD2-CG 4.33Å; F182-K213 HydrophobicContact CE1-CG 3.97Å; F182-K213 HydrophobicContact CE2-CB 4.32Å; F182-K213 HydrophobicContact CE2-CG 3.82Å; F182-K213 HydrophobicContact CZ-CB 4.4Å; F182-K213 HydrophobicContact CZ-CG 3.61Å
214	P	93.7	Very high	93.5	Very high	4 Å²	4	62.7 Å²	62.7	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	146.5	-179.4	29.2	-33	0	0	0	111.1	I125 Y126 F127 Y178	I125-P214 HydrophobicContact CB-CB 4.23Å; I125-P214 HydrophobicContact CD1-CB 3.96Å; I125-P214 HydrophobicContact CD1-CG 4.05Å; I125-P214 HydrophobicContact CG1-CB 4.39Å; Y126-P214 CarbonylContact O-C 3.58Å; Y126-P214 VanDerWaalsContact O-CA 3.23Å; Y126-P214 WeakPolarHBondContact O-CA 3.17Å; F127-P214 HydrophobicContact CD1-CB 3.92Å; F127-P214 HydrophobicContact CD1-CG 4.45Å; F127-P214 HydrophobicContact CD2-CB 4.31Å; F127-P214 HydrophobicContact CE1-CB 3.8Å; F127-P214 HydrophobicContact CE1-CG 3.9Å; F127-P214 HydrophobicContact CE2-CB 4.18Å; F127-P214 HydrophobicContact CG-CB 4.19Å; F127-P214 HydrophobicContact CZ-CB 3.94Å; F127-P214 HydrophobicContact CZ-CG 4.03Å; Y178-P214 HydrophobicContact CD2-CG 4.01Å
215	N	94	Very high	93.3	Very high	68 Å²	68	68.3 Å²	68.3	36%	0.364	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	120.4	174	-164.6	-18.7	0	0	0	110.2	Y126 D128 R221	Y126-N215 PolarHBondContact N-O 2.82Å; Y126-N215 PolarHBondContact O-N 3.41Å; D128-N215 WeakPolarHBondContact OD1-CB 3.4Å; N215-R221 PolarHBondContact OD1-NH2 3.47Å
216	I	94.3	Very high	93.2	Very high	6 Å²	6	71.3 Å²	71.3	3%	0.031	35%	0.349	C	S	.	.			trans	-104.6	139.9	179.6	-54.1	173.3	0	0	0	109	I125 L174 Y178 I220 R221	I125-I216 HydrophobicContact CG2-CG1 4.2Å; L174-I216 HydrophobicContact CD1-CD1 3.87Å; L174-I216 HydrophobicContact CD1-CG1 4.1Å; L174-I216 HydrophobicContact CD2-CD1 4.39Å; L174-I216 HydrophobicContact CD2-CG2 4.25Å; L174-I216 HydrophobicContact CG-CD1 4.29Å; Y178-I216 HydrophobicContact CD1-CD1 4.22Å; Y178-I216 HydrophobicContact CD2-CD1 3.57Å; Y178-I216 HydrophobicContact CD2-CG1 4.34Å; Y178-I216 HydrophobicContact CE1-CD1 4.44Å; Y178-I216 HydrophobicContact CE2-CD1 3.8Å; Y178-I216 HydrophobicContact CE2-CG1 4.43Å; Y178-I216 HydrophobicContact CG-CD1 3.79Å; I216-I220 HydrophobicContact CG2-CB 3.95Å; I216-I220 HydrophobicContact CG2-CG2 3.89Å; I216-R221 PolarHBondContact O-NE 3.46Å; I216-R221 PolarHBondContact O-NH2 3.07Å
217	P	93.3	Very high	92.9	Very high	63 Å²	63	75.1 Å²	75.1	41%	0.409	37%	0.368	S	S	.	.			trans	-50.5	139	172.6	-27.4	34.5	0	0	0	113.3	A219 I220 R221	P217-A219 VanDerWaalsContact C-N 3.26Å; P217-A219 PolarHBondContact O-N 3.19Å; P217-A219 VanDerWaalsContact O-N 3.15Å; P217-I220 PolarHBondContact O-N 3.48Å; P217-I220 VanDerWaalsContact O-N 3.09Å; P217-R221 PolarHBondContact O-N 2.84Å; P217-R221 VanDerWaalsContact O-N 3.09Å
218	E	91.7	Very high	92.7	Very high	143 Å²	143	72.9 Å²	72.9	67%	0.668	36%	0.357	S	S	*	.	H	α-helix	trans	-58.5	-32.8	-172.7	-68.5	-172.6	172.3	0	0	114.5	I220 R221 R222	E218-I220 VanDerWaalsContact C-N 3.3Å; E218-I220 PolarHBondContact O-N 3.22Å; E218-R221 PolarHBondContact O-N 2.96Å; E218-R222 PolarHBondContact O-N 2.9Å; E218-R222 VanDerWaalsContact O-N 3.13Å
219	A	90.5	Very high	92.6	Very high	60 Å²	60	73.5 Å²	73.5	50%	0.496	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-40.2	179.1	0	0	0	0	0	112	P217 N223	P217-A219 VanDerWaalsContact C-N 3.26Å; P217-A219 PolarHBondContact O-N 3.19Å; P217-A219 VanDerWaalsContact O-N 3.15Å; A219-N223 PolarHBondContact O-ND2 3.06Å
220	I	91.3	Very high	92.5	Very high	47 Å²	47	78 Å²	78	24%	0.241	38%	0.38	C	S	.	.	H	α-helix	trans	-79.5	-40.2	179.5	-64	175.8	0	0	0	109.8	V123 L174 I216 P217 E218 R222 N223 Y224	V123-I220 HydrophobicContact CB-CD1 4.37Å; V123-I220 HydrophobicContact CG1-CD1 3.58Å; V123-I220 HydrophobicContact CG2-CD1 3.8Å; L174-I220 HydrophobicContact CD2-CG2 3.75Å; I216-I220 HydrophobicContact CG2-CB 3.95Å; I216-I220 HydrophobicContact CG2-CG2 3.89Å; P217-I220 PolarHBondContact O-N 3.48Å; P217-I220 VanDerWaalsContact O-N 3.09Å; E218-I220 VanDerWaalsContact C-N 3.3Å; E218-I220 PolarHBondContact O-N 3.22Å; I220-R222 VanDerWaalsContact C-N 3.32Å; I220-R222 PolarHBondContact O-N 2.99Å; I220-N223 WeakPolarHBondContact O-CB 3.46Å; I220-N223 PolarHBondContact O-N 2.67Å; I220-Y224 HydrophobicContact CG2-CD2 3.57Å; I220-Y224 HydrophobicContact CG2-CE2 3.45Å; I220-Y224 VanDerWaalsContact CG2-CE2 3.45Å; I220-Y224 WeakPolarHBondContact O-CD2 3.43Å; I220-Y224 PolarHBondContact O-N 3.31Å
221	R	91.8	Very high	92.4	Very high	86 Å²	86	75.7 Å²	75.7	33%	0.325	37%	0.374	S	S	.	.	H	α-helix	trans	-53.7	-47.1	178.3	-170.7	-178.9	-55.6	-138.8	0.9	112.6	N215 I216 P217 E218 N223 Y224 E225	N215-R221 PolarHBondContact OD1-NH2 3.47Å; I216-R221 PolarHBondContact O-NE 3.46Å; I216-R221 PolarHBondContact O-NH2 3.07Å; P217-R221 PolarHBondContact O-N 2.84Å; P217-R221 VanDerWaalsContact O-N 3.09Å; E218-R221 PolarHBondContact O-N 2.96Å; R221-N223 VanDerWaalsContact C-N 3.28Å; R221-N223 PolarHBondContact O-N 2.7Å; R221-Y224 PolarHBondContact O-N 2.87Å; R221-Y224 VanDerWaalsContact O-N 3.16Å; R221-E225 WeakPolarHBondContact CG-OE1 3.44Å; R221-E225 WeakPolarHBondContact O-CG 3.38Å; R221-E225 PolarHBondContact O-N 3.38Å
222	R	92.1	Very high	92.2	Very high	146 Å²	146	78.5 Å²	78.5	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-58.8	-38.7	176.7	-76.6	-175.6	-95.4	135.9	-10.9	112.6	E218 I220 E225 L226	E218-R222 PolarHBondContact O-N 2.9Å; E218-R222 VanDerWaalsContact O-N 3.13Å; I220-R222 VanDerWaalsContact C-N 3.32Å; I220-R222 PolarHBondContact O-N 2.99Å; R222-E225 PolarHBondContact O-N 3.34Å; R222-L226 VanDerWaalsContact O-CG 3.32Å; R222-L226 WeakPolarHBondContact O-CG 3.33Å; R222-L226 PolarHBondContact O-N 2.8Å; R222-L226 VanDerWaalsContact O-N 3.08Å
223	N	90.7	Very high	92.3	Very high	104 Å²	104	81.3 Å²	81.3	56%	0.556	40%	0.399	S	S	*	.	H	α-helix	trans	-68.1	-38.3	177.8	-66.7	-22	0	0	0	112	A219 I220 R221 L226 M227	A219-N223 PolarHBondContact O-ND2 3.06Å; I220-N223 WeakPolarHBondContact O-CB 3.46Å; I220-N223 PolarHBondContact O-N 2.67Å; R221-N223 VanDerWaalsContact C-N 3.28Å; R221-N223 PolarHBondContact O-N 2.7Å; N223-L226 PolarHBondContact O-N 3.18Å; N223-M227 WeakPolarHBondContact O-CB 3.29Å; N223-M227 PolarHBondContact O-N 3.36Å
224	Y	89.8	Confident	92.4	Very high	56 Å²	56	81.4 Å²	81.4	22%	0.22	41%	0.405	C	S	.	.	H	α-helix	trans	-67.2	-42.1	175.2	-87.1	-82.4	0	0	0	112.5	L174 Q175 I220 R221 L226 M227 E228	L174-Y224 HydrophobicContact CD2-CE2 3.6Å; L174-Y224 HydrophobicContact CG-CE2 4.42Å; Q175-Y224 HydrophobicContact CB-CE1 4.36Å; I220-Y224 HydrophobicContact CG2-CD2 3.57Å; I220-Y224 HydrophobicContact CG2-CE2 3.45Å; I220-Y224 VanDerWaalsContact CG2-CE2 3.45Å; I220-Y224 WeakPolarHBondContact O-CD2 3.43Å; I220-Y224 PolarHBondContact O-N 3.31Å; R221-Y224 PolarHBondContact O-N 2.87Å; R221-Y224 VanDerWaalsContact O-N 3.16Å; Y224-L226 VanDerWaalsContact C-N 3.31Å; Y224-L226 PolarHBondContact O-N 3.18Å; Y224-M227 HydrophobicContact CD1-CE 3.62Å; Y224-M227 HydrophobicContact CE1-CE 3.77Å; Y224-M227 PolarHBondContact O-N 2.73Å; Y224-E228 WeakPolarHBondContact O-CB 3.46Å; Y224-E228 PolarHBondContact O-N 3.4Å
225	E	90.4	Very high	92.5	Very high	119 Å²	119	86 Å²	86	56%	0.556	43%	0.428	S	S	*	.	H	α-helix	trans	-59.5	-43.7	175.6	-71.5	169.6	-175.4	0	0	111.2	R221 R222 S229	R221-E225 WeakPolarHBondContact CG-OE1 3.44Å; R221-E225 WeakPolarHBondContact O-CG 3.38Å; R221-E225 PolarHBondContact O-N 3.38Å; R222-E225 PolarHBondContact O-N 3.34Å; E225-S229 WeakPolarHBondContact O-CB 3.42Å; E225-S229 PolarHBondContact O-N 3.11Å; E225-S229 VanDerWaalsContact O-N 3.07Å
226	L	92.9	Very high	92.6	Very high	108 Å²	108	87.4 Å²	87.4	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-64.1	-47.8	174.5	-70.1	173.4	0	0	0	111.7	R222 N223 Y224 E228 S229 E230	R222-L226 VanDerWaalsContact O-CG 3.32Å; R222-L226 WeakPolarHBondContact O-CG 3.33Å; R222-L226 PolarHBondContact O-N 2.8Å; R222-L226 VanDerWaalsContact O-N 3.08Å; N223-L226 PolarHBondContact O-N 3.18Å; Y224-L226 VanDerWaalsContact C-N 3.31Å; Y224-L226 PolarHBondContact O-N 3.18Å; L226-E228 PolarHBondContact O-N 2.8Å; L226-S229 WeakPolarHBondContact O-CB 3Å; L226-S229 PolarHBondContact O-N 3.4Å; L226-S229 PolarHBondContact O-OG 3.39Å; L226-E230 WeakPolarHBondContact O-CG 3.32Å; L226-E230 PolarHBondContact O-N 2.96Å
227	M	89.4	Confident	92.7	Very high	88 Å²	88	89.3 Å²	89.3	43%	0.433	45%	0.452	S	S	.	.	H	α-helix	trans	-62	-43.9	-179.6	-175.6	-170.8	69.8	0	0	112.3	N223 Y224 S229 E230 K231	N223-M227 WeakPolarHBondContact O-CB 3.29Å; N223-M227 PolarHBondContact O-N 3.36Å; Y224-M227 HydrophobicContact CD1-CE 3.62Å; Y224-M227 HydrophobicContact CE1-CE 3.77Å; Y224-M227 PolarHBondContact O-N 2.73Å; M227-S229 VanDerWaalsContact C-N 3.3Å; M227-S229 PolarHBondContact O-N 3.43Å; M227-E230 PolarHBondContact O-N 3.41Å; M227-K231 WeakPolarHBondContact O-CB 3.3Å; M227-K231 PolarHBondContact O-N 3.14Å
228	E	90.1	Very high	92.9	Very high	61 Å²	61	88 Å²	88	29%	0.285	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-36.8	176	-79.8	-65.9	131.4	0	0	111.3	Y224 L226 K231 T232	Y224-E228 WeakPolarHBondContact O-CB 3.46Å; Y224-E228 PolarHBondContact O-N 3.4Å; L226-E228 PolarHBondContact O-N 2.8Å; E228-K231 PolarHBondContact O-N 2.83Å; E228-T232 WeakPolarHBondContact O-CB 3.16Å; E228-T232 PolarHBondContact O-N 3.29Å; E228-T232 PolarHBondContact O-OG1 3.05Å
229	S	93	Very high	93.1	Very high	45 Å²	45	87.5 Å²	87.5	32%	0.315	44%	0.444	S	S	.	.	H	α-helix	trans	-63.5	-42.1	173.3	84.8	0	0	0	0	112	E225 L226 M227 T232 K233	E225-S229 WeakPolarHBondContact O-CB 3.42Å; E225-S229 PolarHBondContact O-N 3.11Å; E225-S229 VanDerWaalsContact O-N 3.07Å; L226-S229 WeakPolarHBondContact O-CB 3Å; L226-S229 PolarHBondContact O-N 3.4Å; L226-S229 PolarHBondContact O-OG 3.39Å; M227-S229 VanDerWaalsContact C-N 3.3Å; M227-S229 PolarHBondContact O-N 3.43Å; S229-T232 PolarHBondContact O-N 2.95Å; S229-K233 VanDerWaalsContact O-CG 3.29Å; S229-K233 WeakPolarHBondContact O-CG 3.33Å; S229-K233 PolarHBondContact O-N 2.84Å
230	E	94.5	Very high	93.4	Very high	103 Å²	103	91.4 Å²	91.4	48%	0.481	45%	0.45	S	S	.	.	H	α-helix	trans	-70.4	-41.1	177.8	-68.6	-56	141.7	0	0	112.1	L226 M227 T232 K233 L234	L226-E230 WeakPolarHBondContact O-CG 3.32Å; L226-E230 PolarHBondContact O-N 2.96Å; M227-E230 PolarHBondContact O-N 3.41Å; E230-T232 VanDerWaalsContact C-N 3.3Å; E230-T232 PolarHBondContact O-N 3.46Å; E230-K233 WeakPolarHBondContact O-CB 3.49Å; E230-K233 PolarHBondContact O-N 3.42Å; E230-K233 IonicContact OE1-NZ 2.76Å; E230-K233 PolarHBondContact OE1-NZ 3.26Å; E230-K233 IonicContact OE2-NZ 3.03Å; E230-L234 PolarHBondContact O-N 3.43Å
231	K	92.8	Very high	93.5	Very high	103 Å²	103	95.2 Å²	95.2	45%	0.448	47%	0.467	S	S	.	.	H	α-helix	trans	-59.4	-43.4	174.3	-172.5	178.5	-179.3	-177.5	0	110.9	M227 E228 L234 L235	M227-K231 WeakPolarHBondContact O-CB 3.3Å; M227-K231 PolarHBondContact O-N 3.14Å; E228-K231 PolarHBondContact O-N 2.83Å; K231-L234 PolarHBondContact O-N 3.06Å; K231-L235 WeakPolarHBondContact O-CG 3.42Å; K231-L235 PolarHBondContact O-N 3.42Å
232	T	92.8	Very high	93.7	Very high	69 Å²	69	97.9 Å²	97.9	42%	0.423	48%	0.481	S	S	.	.	H	α-helix	trans	-62.9	-44.8	175.3	-57.5	0	0	0	0	111.3	E228 S229 E230 L234 L235 I236	E228-T232 WeakPolarHBondContact O-CB 3.16Å; E228-T232 PolarHBondContact O-N 3.29Å; E228-T232 PolarHBondContact O-OG1 3.05Å; S229-T232 PolarHBondContact O-N 2.95Å; E230-T232 VanDerWaalsContact C-N 3.3Å; E230-T232 PolarHBondContact O-N 3.46Å; T232-L234 VanDerWaalsContact C-N 3.32Å; T232-L234 PolarHBondContact O-N 3.02Å; T232-L235 PolarHBondContact O-N 3.16Å; T232-I236 HydrophobicContact CG2-CD1 3.86Å; T232-I236 HydrophobicContact CG2-CG1 4.46Å; T232-I236 VanDerWaalsContact O-CG1 3.26Å; T232-I236 WeakPolarHBondContact O-CG1 3.35Å; T232-I236 PolarHBondContact O-N 3.07Å
233	K	95.7	Very high	93.9	Very high	113 Å²	113	94.5 Å²	94.5	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-59.1	-42	175.2	-72.2	170.8	-165.8	171.2	0	112.2	S229 E230 I236 A237	S229-K233 VanDerWaalsContact O-CG 3.29Å; S229-K233 WeakPolarHBondContact O-CG 3.33Å; S229-K233 PolarHBondContact O-N 2.84Å; E230-K233 WeakPolarHBondContact O-CB 3.49Å; E230-K233 PolarHBondContact O-N 3.42Å; E230-K233 IonicContact OE1-NZ 2.76Å; E230-K233 PolarHBondContact OE1-NZ 3.26Å; E230-K233 IonicContact OE2-NZ 3.03Å; K233-I236 PolarHBondContact O-N 3.33Å; K233-A237 WeakPolarHBondContact O-CB 3.1Å; K233-A237 PolarHBondContact O-N 3.02Å
234	L	96.3	Very high	94.2	Very high	118 Å²	118	93.2 Å²	93.2	62%	0.618	47%	0.472	S	S	*	.	H	α-helix	trans	-63.6	-44.9	177.6	-174.8	152.2	0	0	0	111.4	E230 K231 T232 I236 A237 A238	E230-L234 PolarHBondContact O-N 3.43Å; K231-L234 PolarHBondContact O-N 3.06Å; T232-L234 VanDerWaalsContact C-N 3.32Å; T232-L234 PolarHBondContact O-N 3.02Å; L234-I236 VanDerWaalsContact C-N 3.34Å; L234-I236 PolarHBondContact O-N 3.27Å; L234-A237 PolarHBondContact O-N 3.09Å; L234-A238 WeakPolarHBondContact O-CB 3.34Å; L234-A238 PolarHBondContact O-N 3.32Å
235	L	94.3	Very high	94.4	Very high	99 Å²	99	96.4 Å²	96.4	52%	0.518	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-41.8	176.5	-69.7	172.8	0	0	0	111.7	K231 T232 A238 Q239	K231-L235 WeakPolarHBondContact O-CG 3.42Å; K231-L235 PolarHBondContact O-N 3.42Å; T232-L235 PolarHBondContact O-N 3.16Å; L235-A238 PolarHBondContact O-N 3.08Å; L235-Q239 WeakPolarHBondContact O-CG 3.44Å; L235-Q239 PolarHBondContact O-N 2.9Å
236	I	97.3	Very high	94.6	Very high	98 Å²	98	96.4 Å²	96.4	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-45.4	175.2	-68	165.9	0	0	0	110.6	T232 K233 L234 A238 Q239 K240	T232-I236 HydrophobicContact CG2-CD1 3.86Å; T232-I236 HydrophobicContact CG2-CG1 4.46Å; T232-I236 VanDerWaalsContact O-CG1 3.26Å; T232-I236 WeakPolarHBondContact O-CG1 3.35Å; T232-I236 PolarHBondContact O-N 3.07Å; K233-I236 PolarHBondContact O-N 3.33Å; L234-I236 VanDerWaalsContact C-N 3.34Å; L234-I236 PolarHBondContact O-N 3.27Å; I236-A238 VanDerWaalsContact C-N 3.33Å; I236-A238 PolarHBondContact O-N 3.5Å; I236-Q239 PolarHBondContact O-N 3.34Å; I236-K240 VanDerWaalsContact O-CB 3.25Å; I236-K240 WeakPolarHBondContact O-CB 3.36Å; I236-K240 PolarHBondContact O-N 2.98Å
237	A	96.7	Very high	94.6	Very high	46 Å²	46	96.5 Å²	96.5	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-61.3	-42.6	178.1	0	0	0	0	0	111.5	K233 L234 K240 Q241	K233-A237 WeakPolarHBondContact O-CB 3.1Å; K233-A237 PolarHBondContact O-N 3.02Å; L234-A237 PolarHBondContact O-N 3.09Å; A237-K240 PolarHBondContact O-N 2.93Å; A237-Q241 VanDerWaalsContact O-CG 3.31Å; A237-Q241 WeakPolarHBondContact O-CG 3.24Å; A237-Q241 PolarHBondContact O-N 2.97Å
238	A	97.1	Very high	94.9	Very high	36 Å²	36	94.1 Å²	94.1	30%	0.298	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176.6	0	0	0	0	0	112.5	L234 L235 I236 Q241 K242	L234-A238 WeakPolarHBondContact O-CB 3.34Å; L234-A238 PolarHBondContact O-N 3.32Å; L235-A238 PolarHBondContact O-N 3.08Å; I236-A238 VanDerWaalsContact C-N 3.33Å; I236-A238 PolarHBondContact O-N 3.5Å; A238-Q241 PolarHBondContact O-N 3.41Å; A238-K242 WeakPolarHBondContact O-CG 3.32Å; A238-K242 PolarHBondContact O-N 2.94Å; A238-K242 VanDerWaalsContact O-N 3.16Å
239	Q	95.5	Very high	95	Very high	132 Å²	132	95.2 Å²	95.2	62%	0.617	48%	0.484	S	S	*	.	H	α-helix	trans	-65.8	-41	173.6	-74.4	-175.6	-8.5	0	0	111.5	L235 I236 Q241 K242 V243	L235-Q239 WeakPolarHBondContact O-CG 3.44Å; L235-Q239 PolarHBondContact O-N 2.9Å; I236-Q239 PolarHBondContact O-N 3.34Å; Q239-Q241 VanDerWaalsContact C-N 3.35Å; Q239-Q241 PolarHBondContact O-N 3.48Å; Q239-K242 WeakPolarHBondContact O-CB 3.43Å; Q239-K242 PolarHBondContact O-N 3.48Å; Q239-V243 WeakPolarHBondContact O-CG2 3.49Å; Q239-V243 PolarHBondContact O-N 2.63Å
240	K	96.5	Very high	95	Very high	143 Å²	143	97.3 Å²	97.3	62%	0.622	50%	0.495	S	S	*	.	H	α-helix	trans	-62.8	-40.9	176.4	-173.9	174.9	-179.6	177.9	0	111.7	I236 A237 K242 V243 V244	I236-K240 VanDerWaalsContact O-CB 3.25Å; I236-K240 WeakPolarHBondContact O-CB 3.36Å; I236-K240 PolarHBondContact O-N 2.98Å; A237-K240 PolarHBondContact O-N 2.93Å; K240-K242 VanDerWaalsContact C-N 3.33Å; K240-K242 PolarHBondContact O-N 3.48Å; K240-V243 PolarHBondContact O-N 2.62Å; K240-V244 HydrophobicContact CG-CG2 4.49Å; K240-V244 WeakPolarHBondContact O-CG2 3.3Å; K240-V244 PolarHBondContact O-N 3.35Å
241	Q	94	Very high	95	Very high	127 Å²	127	99 Å²	99	59%	0.593	50%	0.503	S	S	*	.	H	α-helix	trans	-57.6	-46.9	172.8	-76	170.8	-7.4	0	0	111.1	A237 A238 Q239 V243 V244 E245	A237-Q241 VanDerWaalsContact O-CG 3.31Å; A237-Q241 WeakPolarHBondContact O-CG 3.24Å; A237-Q241 PolarHBondContact O-N 2.97Å; A238-Q241 PolarHBondContact O-N 3.41Å; Q239-Q241 VanDerWaalsContact C-N 3.35Å; Q239-Q241 PolarHBondContact O-N 3.48Å; Q241-V243 VanDerWaalsContact C-N 3.33Å; Q241-V243 PolarHBondContact O-N 2.9Å; Q241-V244 PolarHBondContact O-N 3.44Å; Q241-E245 WeakPolarHBondContact O-CG 2.84Å; Q241-E245 PolarHBondContact O-N 3.42Å
242	K	96.1	Very high	95	Very high	142 Å²	142	103 Å²	103	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-39	175.7	-70.1	177.4	179.1	-178.7	0	112.9	A238 Q239 K240 K246	A238-K242 WeakPolarHBondContact O-CG 3.32Å; A238-K242 PolarHBondContact O-N 2.94Å; A238-K242 VanDerWaalsContact O-N 3.16Å; Q239-K242 WeakPolarHBondContact O-CB 3.43Å; Q239-K242 PolarHBondContact O-N 3.48Å; K240-K242 VanDerWaalsContact C-N 3.33Å; K240-K242 PolarHBondContact O-N 3.48Å; K242-K246 WeakPolarHBondContact O-CB 3.24Å; K242-K246 VanDerWaalsContact O-CG 3.25Å; K242-K246 WeakPolarHBondContact O-CG 3.16Å; K242-K246 PolarHBondContact O-N 2.94Å
243	V	96.6	Very high	95	Very high	74 Å²	74	106 Å²	106	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-64.2	-47.5	175.9	171.5	0	0	0	0	110.3	Q239 K240 Q241 E245 K246 E247	Q239-V243 WeakPolarHBondContact O-CG2 3.49Å; Q239-V243 PolarHBondContact O-N 2.63Å; K240-V243 PolarHBondContact O-N 2.62Å; Q241-V243 VanDerWaalsContact C-N 3.33Å; Q241-V243 PolarHBondContact O-N 2.9Å; V243-E245 VanDerWaalsContact C-N 3.34Å; V243-E245 PolarHBondContact O-N 3.39Å; V243-K246 CarbonylContact O-C 3.57Å; V243-K246 PolarHBondContact O-N 3.3Å; V243-K246 VanDerWaalsContact O-N 3.14Å; V243-E247 HydrophobicContact CG1-CG 4.14Å; V243-E247 WeakPolarHBondContact CG1-OE1 3.23Å; V243-E247 WeakPolarHBondContact O-CB 3.33Å; V243-E247 WeakPolarHBondContact O-CG 3.27Å; V243-E247 PolarHBondContact O-N 3.32Å
244	V	95.9	Very high	95	Very high	78 Å²	78	107.4 Å²	107.4	47%	0.473	53%	0.528	S	S	.	.	H	α-helix	trans	-61.5	-41.1	178.1	172.2	0	0	0	0	111.6	K240 Q241 E247 A248	K240-V244 HydrophobicContact CG-CG2 4.49Å; K240-V244 WeakPolarHBondContact O-CG2 3.3Å; K240-V244 PolarHBondContact O-N 3.35Å; Q241-V244 PolarHBondContact O-N 3.44Å; V244-E247 PolarHBondContact O-N 3.38Å; V244-A248 WeakPolarHBondContact O-CB 3.35Å; V244-A248 PolarHBondContact O-N 3.15Å
245	E	94.4	Very high	94.8	Very high	123 Å²	123	104.5 Å²	104.5	58%	0.575	52%	0.521	S	S	*	.	H	α-helix	trans	-60.6	-44.8	174.1	-74.6	174	-178.7	0	0	111.7	Q241 V243 A248 E249	Q241-E245 WeakPolarHBondContact O-CG 2.84Å; Q241-E245 PolarHBondContact O-N 3.42Å; V243-E245 VanDerWaalsContact C-N 3.34Å; V243-E245 PolarHBondContact O-N 3.39Å; E245-A248 PolarHBondContact O-N 3.43Å; E245-E249 WeakPolarHBondContact O-CG 3.26Å; E245-E249 PolarHBondContact O-N 2.78Å
246	K	95.2	Very high	94.9	Very high	118 Å²	118	105.2 Å²	105.2	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-70.2	-35.3	178.4	-69.7	-72.2	156.3	-152.2	0	112.8	K242 V243 E249 T250	K242-K246 WeakPolarHBondContact O-CB 3.24Å; K242-K246 VanDerWaalsContact O-CG 3.25Å; K242-K246 WeakPolarHBondContact O-CG 3.16Å; K242-K246 PolarHBondContact O-N 2.94Å; V243-K246 CarbonylContact O-C 3.57Å; V243-K246 PolarHBondContact O-N 3.3Å; V243-K246 VanDerWaalsContact O-N 3.14Å; K246-E249 IonicContact NZ-OE1 3.54Å; K246-E249 IonicContact NZ-OE2 2.78Å; K246-E249 PolarHBondContact NZ-OE2 2.97Å; K246-E249 PolarHBondContact O-N 3.33Å; K246-T250 WeakPolarHBondContact O-CB 3.49Å; K246-T250 PolarHBondContact O-N 3.43Å; K246-T250 PolarHBondContact O-OG1 2.89Å
247	E	92.4	Very high	94.7	Very high	110 Å²	110	105.7 Å²	105.7	51%	0.514	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-46.3	173.4	-76.7	175.2	169.6	0	0	110.4	V243 V244 E249 T250 E251	V243-E247 HydrophobicContact CG1-CG 4.14Å; V243-E247 WeakPolarHBondContact CG1-OE1 3.23Å; V243-E247 WeakPolarHBondContact O-CB 3.33Å; V243-E247 WeakPolarHBondContact O-CG 3.27Å; V243-E247 PolarHBondContact O-N 3.32Å; V244-E247 PolarHBondContact O-N 3.38Å; E247-E249 VanDerWaalsContact C-N 3.35Å; E247-E249 PolarHBondContact O-N 3.27Å; E247-T250 CarbonylContact O-C 3.6Å; E247-T250 WeakPolarHBondContact O-CA 3.35Å; E247-T250 WeakPolarHBondContact O-CB 3.26Å; E247-T250 PolarHBondContact O-N 2.03Å; E247-E251 WeakPolarHBondContact O-CG 3.19Å; E247-E251 PolarHBondContact O-N 3.12Å
248	A	95	Very high	94.6	Very high	38 Å²	38	109.1 Å²	109.1	31%	0.314	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-39.9	175.7	0	0	0	0	0	112.4	V244 E245 T250 R252	V244-A248 WeakPolarHBondContact O-CB 3.35Å; V244-A248 PolarHBondContact O-N 3.15Å; E245-A248 PolarHBondContact O-N 3.43Å; A248-T250 VanDerWaalsContact C-N 3.31Å; A248-R252 VanDerWaalsContact O-CG 3.31Å; A248-R252 WeakPolarHBondContact O-CG 3.48Å; A248-R252 PolarHBondContact O-N 2.8Å
249	E	93.9	Very high	94.4	Very high	84 Å²	84	110.3 Å²	110.3	39%	0.393	55%	0.546	S	S	.	.	H	α-helix	trans	-61.6	-40	170.9	-76.4	179.1	177	0	0	112	E245 K246 E247 K253	E245-E249 WeakPolarHBondContact O-CG 3.26Å; E245-E249 PolarHBondContact O-N 2.78Å; K246-E249 IonicContact NZ-OE1 3.54Å; K246-E249 IonicContact NZ-OE2 2.78Å; K246-E249 PolarHBondContact NZ-OE2 2.97Å; K246-E249 PolarHBondContact O-N 3.33Å; E247-E249 VanDerWaalsContact C-N 3.35Å; E247-E249 PolarHBondContact O-N 3.27Å; E249-K253 WeakPolarHBondContact O-CG 3.44Å; E249-K253 PolarHBondContact O-N 3.15Å; E249-K253 VanDerWaalsContact O-N 3.09Å
250	T	91.6	Very high	94.4	Very high	89 Å²	89	109.7 Å²	109.7	55%	0.546	54%	0.542	S	S	.	.	H	α-helix	trans	-69.4	-41.7	179.6	-57.9	0	0	0	0	111.2	K246 E247 A248 K253 K254	K246-T250 WeakPolarHBondContact O-CB 3.49Å; K246-T250 PolarHBondContact O-N 3.43Å; K246-T250 PolarHBondContact O-OG1 2.89Å; E247-T250 CarbonylContact O-C 3.6Å; E247-T250 WeakPolarHBondContact O-CA 3.35Å; E247-T250 WeakPolarHBondContact O-CB 3.26Å; E247-T250 PolarHBondContact O-N 2.03Å; A248-T250 VanDerWaalsContact C-N 3.31Å; T250-K253 PolarHBondContact O-N 3.09Å; T250-K254 WeakPolarHBondContact O-CB 3.45Å; T250-K254 PolarHBondContact O-N 3.13Å
251	E	94.3	Very high	94.4	Very high	140 Å²	140	109.6 Å²	109.6	65%	0.654	54%	0.542	S	S	*	.	H	α-helix	trans	-62.4	-42.7	174.8	-75.6	-174.7	167	0	0	111.6	E247 K253 K254 A255	E247-E251 WeakPolarHBondContact O-CG 3.19Å; E247-E251 PolarHBondContact O-N 3.12Å; E251-K253 PolarHBondContact O-N 2.88Å; E251-K254 PolarHBondContact O-N 3.4Å; E251-A255 WeakPolarHBondContact O-CB 3.4Å; E251-A255 PolarHBondContact O-N 3.01Å
252	R	93.2	Very high	94.4	Very high	186 Å²	186	108 Å²	108	70%	0.702	54%	0.541	S	S	*	.	H	α-helix	trans	-59.2	-46.4	174	-74.6	176.3	-177.1	178.2	2.6	111.9	A248 A255 L256	A248-R252 VanDerWaalsContact O-CG 3.31Å; A248-R252 WeakPolarHBondContact O-CG 3.48Å; A248-R252 PolarHBondContact O-N 2.8Å; R252-A255 PolarHBondContact O-N 2.88Å; R252-L256 WeakPolarHBondContact O-CG 3.47Å; R252-L256 PolarHBondContact O-N 2.65Å; R252-L256 VanDerWaalsContact O-N 3.1Å
253	K	93.7	Very high	94.3	Very high	133 Å²	133	104 Å²	104	58%	0.578	54%	0.535	S	S	*	.	H	α-helix	trans	-64.2	-41.2	176.5	-73.1	176.8	-178.9	177.1	0	111.8	E249 T250 E251 A255 L256 I257	E249-K253 WeakPolarHBondContact O-CG 3.44Å; E249-K253 PolarHBondContact O-N 3.15Å; E249-K253 VanDerWaalsContact O-N 3.09Å; T250-K253 PolarHBondContact O-N 3.09Å; E251-K253 PolarHBondContact O-N 2.88Å; K253-A255 PolarHBondContact O-N 3.48Å; K253-L256 PolarHBondContact O-N 3.4Å; K253-I257 VanDerWaalsContact O-CG1 3.25Å; K253-I257 WeakPolarHBondContact O-CG1 3.3Å; K253-I257 PolarHBondContact O-N 3.44Å
254	K	94.4	Very high	94.2	Very high	141 Å²	141	106.1 Å²	106.1	61%	0.613	54%	0.54	S	S	*	.	H	α-helix	trans	-61.9	-43.5	177.4	-172.5	-178.1	176.8	-172	0	111.3	T250 E251 L256 I257 E258	T250-K254 WeakPolarHBondContact O-CB 3.45Å; T250-K254 PolarHBondContact O-N 3.13Å; E251-K254 PolarHBondContact O-N 3.4Å; K254-L256 PolarHBondContact O-N 2.98Å; K254-I257 PolarHBondContact O-N 3.48Å; K254-E258 VanDerWaalsContact O-CB 3.28Å; K254-E258 WeakPolarHBondContact O-CB 3.31Å; K254-E258 PolarHBondContact O-N 3.26Å
255	A	93.8	Very high	94.1	Very high	58 Å²	58	106.1 Å²	106.1	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-63.3	-40	176.8	0	0	0	0	0	112.3	E251 R252 K253 E258 A259	E251-A255 WeakPolarHBondContact O-CB 3.4Å; E251-A255 PolarHBondContact O-N 3.01Å; R252-A255 PolarHBondContact O-N 2.88Å; K253-A255 PolarHBondContact O-N 3.48Å; A255-E258 PolarHBondContact O-N 3.5Å; A255-A259 WeakPolarHBondContact O-CB 3.43Å; A255-A259 PolarHBondContact O-N 2.83Å
256	L	94.8	Very high	94.1	Very high	113 Å²	113	102.7 Å²	102.7	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-64	-47.7	174	-70.3	172.8	0	0	0	111.8	R252 K253 K254 E258 A259 E260	R252-L256 WeakPolarHBondContact O-CG 3.47Å; R252-L256 PolarHBondContact O-N 2.65Å; R252-L256 VanDerWaalsContact O-N 3.1Å; K253-L256 PolarHBondContact O-N 3.4Å; K254-L256 PolarHBondContact O-N 2.98Å; L256-E258 VanDerWaalsContact C-N 3.27Å; L256-E258 PolarHBondContact O-N 3.27Å; L256-A259 PolarHBondContact O-N 2.99Å; L256-E260 WeakPolarHBondContact O-CG 3.48Å; L256-E260 PolarHBondContact O-N 3.46Å
257	I	93.8	Very high	94.1	Very high	108 Å²	108	104.1 Å²	104.1	55%	0.554	54%	0.541	S	S	*	.	H	α-helix	trans	-61.7	-38.3	177.5	-67.9	165.3	0	0	0	110.7	K253 K254 K261	K253-I257 VanDerWaalsContact O-CG1 3.25Å; K253-I257 WeakPolarHBondContact O-CG1 3.3Å; K253-I257 PolarHBondContact O-N 3.44Å; K254-I257 PolarHBondContact O-N 3.48Å; I257-K261 VanDerWaalsContact O-CB 3.23Å; I257-K261 WeakPolarHBondContact O-CB 3.45Å; I257-K261 PolarHBondContact O-N 2.95Å
258	E	94.7	Very high	94.1	Very high	119 Å²	119	103.9 Å²	103.9	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-68.1	-42.6	177.4	-174.2	164.2	-161.8	0	0	111.8	K254 A255 L256 K261 V262	K254-E258 VanDerWaalsContact O-CB 3.28Å; K254-E258 WeakPolarHBondContact O-CB 3.31Å; K254-E258 PolarHBondContact O-N 3.26Å; A255-E258 PolarHBondContact O-N 3.5Å; L256-E258 VanDerWaalsContact C-N 3.27Å; L256-E258 PolarHBondContact O-N 3.27Å; E258-K261 PolarHBondContact O-N 3.5Å; E258-V262 WeakPolarHBondContact O-CG2 3.47Å; E258-V262 PolarHBondContact O-N 2.93Å
259	A	93.5	Very high	94	Very high	61 Å²	61	104.9 Å²	104.9	50%	0.504	54%	0.544	S	S	.	.	H	α-helix	trans	-62.4	-44.9	173.9	0	0	0	0	0	112.1	A255 L256 V262 A263	A255-A259 WeakPolarHBondContact O-CB 3.43Å; A255-A259 PolarHBondContact O-N 2.83Å; L256-A259 PolarHBondContact O-N 2.99Å; A259-V262 PolarHBondContact O-N 3.39Å; A259-A263 PolarHBondContact O-N 3.24Å
260	E	94.1	Very high	94	Very high	118 Å²	118	108.7 Å²	108.7	55%	0.551	56%	0.556	S	S	*	*	H	α-helix	trans	-62	-42.7	174.9	-76.4	-179.6	178.2	0	0	111.9	L256 V262 A263 Q264	L256-E260 WeakPolarHBondContact O-CG 3.48Å; L256-E260 PolarHBondContact O-N 3.46Å; E260-V262 VanDerWaalsContact C-N 3.35Å; E260-V262 PolarHBondContact O-N 3.47Å; E260-A263 PolarHBondContact O-N 2.95Å; E260-Q264 WeakPolarHBondContact O-CG 3.35Å; E260-Q264 PolarHBondContact O-N 2.83Å
261	K	96	Very high	94.1	Very high	141 Å²	141	106.2 Å²	106.2	61%	0.613	55%	0.548	S	S	*	.	H	α-helix	trans	-59.5	-46.1	175.9	-179.4	-173	175.6	-172.2	0	111	I257 E258 A263 Q264 V265	I257-K261 VanDerWaalsContact O-CB 3.23Å; I257-K261 WeakPolarHBondContact O-CB 3.45Å; I257-K261 PolarHBondContact O-N 2.95Å; E258-K261 PolarHBondContact O-N 3.5Å; K261-A263 VanDerWaalsContact C-N 3.33Å; K261-Q264 PolarHBondContact O-N 3.28Å; K261-V265 VanDerWaalsContact O-CG2 3.27Å; K261-V265 WeakPolarHBondContact O-CG2 3.5Å; K261-V265 PolarHBondContact O-N 3.18Å
262	V	95.4	Very high	94	Very high	94 Å²	94	104.7 Å²	104.7	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-63.6	-40.8	177.9	172.6	0	0	0	0	110.8	E258 A259 E260 V265 A266	E258-V262 WeakPolarHBondContact O-CG2 3.47Å; E258-V262 PolarHBondContact O-N 2.93Å; A259-V262 PolarHBondContact O-N 3.39Å; E260-V262 VanDerWaalsContact C-N 3.35Å; E260-V262 PolarHBondContact O-N 3.47Å; V262-V265 PolarHBondContact O-N 3.14Å; V262-A266 WeakPolarHBondContact O-CB 3.27Å; V262-A266 PolarHBondContact O-N 3.12Å
263	A	94.3	Very high	94	Very high	59 Å²	59	102 Å²	102	49%	0.488	54%	0.535	S	S	.	.	H	α-helix	trans	-61.4	-45.7	175.7	0	0	0	0	0	112.2	A259 E260 K261 A266 E267	A259-A263 PolarHBondContact O-N 3.24Å; E260-A263 PolarHBondContact O-N 2.95Å; K261-A263 VanDerWaalsContact C-N 3.33Å; A263-A266 WeakPolarHBondContact O-CB 3.04Å; A263-A266 PolarHBondContact O-N 3.4Å; A263-E267 PolarHBondContact O-N 3.02Å
264	Q	93.3	Very high	94	Very high	118 Å²	118	98.4 Å²	98.4	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-64.6	-41.1	177	-71.3	177.1	26.5	0	0	112.3	E260 K261 A266 E267 I268	E260-Q264 WeakPolarHBondContact O-CG 3.35Å; E260-Q264 PolarHBondContact O-N 2.83Å; K261-Q264 PolarHBondContact O-N 3.28Å; Q264-A266 VanDerWaalsContact C-N 3.33Å; Q264-E267 PolarHBondContact O-N 2.89Å; Q264-I268 WeakPolarHBondContact O-CG1 3.29Å; Q264-I268 PolarHBondContact O-N 3.25Å
265	V	94.4	Very high	93.9	Very high	77 Å²	77	97.5 Å²	97.5	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-65.3	-39.4	175.6	172.9	0	0	0	0	110.7	K261 V262 I268 T269	K261-V265 VanDerWaalsContact O-CG2 3.27Å; K261-V265 WeakPolarHBondContact O-CG2 3.5Å; K261-V265 PolarHBondContact O-N 3.18Å; V262-V265 PolarHBondContact O-N 3.14Å; V265-I268 PolarHBondContact O-N 2.71Å; V265-T269 HydrophobicContact CG1-CG2 4.32Å; V265-T269 WeakPolarHBondContact O-CB 3.4Å; V265-T269 VanDerWaalsContact O-CG2 3.29Å; V265-T269 WeakPolarHBondContact O-CG2 3.41Å; V265-T269 PolarHBondContact O-N 3.47Å; V265-T269 PolarHBondContact O-OG1 3.34Å
266	A	93.4	Very high	93.9	Very high	52 Å²	52	100 Å²	100	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-41.5	174.3	0	0	0	0	0	111.7	V262 A263 Q264 T269 Y270	V262-A266 WeakPolarHBondContact O-CB 3.27Å; V262-A266 PolarHBondContact O-N 3.12Å; A263-A266 WeakPolarHBondContact O-CB 3.04Å; A263-A266 PolarHBondContact O-N 3.4Å; Q264-A266 VanDerWaalsContact C-N 3.33Å; A266-T269 WeakPolarHBondContact CA-OG1 3.34Å; A266-T269 PolarHBondContact O-N 3.41Å; A266-T269 PolarHBondContact O-OG1 3.14Å; A266-Y270 VanDerWaalsContact O-CB 3.23Å; A266-Y270 WeakPolarHBondContact O-CB 3.41Å; A266-Y270 PolarHBondContact O-N 3.32Å
267	E	95.3	Very high	93.8	Very high	148 Å²	148	100.6 Å²	100.6	69%	0.692	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-46.1	176	-172.6	178.1	-176	0	0	112	A263 Q264 Y270 G271	A263-E267 PolarHBondContact O-N 3.02Å; Q264-E267 PolarHBondContact O-N 2.89Å; E267-Y270 PolarHBondContact O-N 2.99Å; E267-G271 PolarHBondContact O-N 2.88Å
268	I	92.7	Very high	93.8	Very high	105 Å²	105	100.6 Å²	100.6	54%	0.538	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-47	177.2	-67.2	166.7	0	0	0	110.9	Q264 V265 Y270 G271 Q272	Q264-I268 WeakPolarHBondContact O-CG1 3.29Å; Q264-I268 PolarHBondContact O-N 3.25Å; V265-I268 PolarHBondContact O-N 2.71Å; I268-Y270 VanDerWaalsContact C-N 3.3Å; I268-Y270 PolarHBondContact O-N 2.83Å; I268-G271 PolarHBondContact O-N 3.43Å; I268-Q272 WeakPolarHBondContact O-CG 3.26Å; I268-Q272 PolarHBondContact O-N 2.79Å
269	T	92.7	Very high	93.6	Very high	58 Å²	58	98 Å²	98	36%	0.356	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-34.4	179.4	53.4	0	0	0	0	111.9	V265 A266 K273	V265-T269 HydrophobicContact CG1-CG2 4.32Å; V265-T269 WeakPolarHBondContact O-CB 3.4Å; V265-T269 VanDerWaalsContact O-CG2 3.29Å; V265-T269 WeakPolarHBondContact O-CG2 3.41Å; V265-T269 PolarHBondContact O-N 3.47Å; V265-T269 PolarHBondContact O-OG1 3.34Å; A266-T269 WeakPolarHBondContact CA-OG1 3.34Å; A266-T269 PolarHBondContact O-N 3.41Å; A266-T269 PolarHBondContact O-OG1 3.14Å; T269-K273 WeakPolarHBondContact O-CG 3.42Å; T269-K273 PolarHBondContact O-N 3.4Å; T269-K273 VanDerWaalsContact O-N 3.14Å
270	Y	95.1	Very high	93.6	Very high	165 Å²	165	99.5 Å²	99.5	65%	0.647	51%	0.509	S	S	*	.	H	α-helix	trans	-66.2	-44.9	171.8	-170.7	-99.1	0	0	0	111.3	A266 E267 I268 Q272 K273 V274	A266-Y270 VanDerWaalsContact O-CB 3.23Å; A266-Y270 WeakPolarHBondContact O-CB 3.41Å; A266-Y270 PolarHBondContact O-N 3.32Å; E267-Y270 PolarHBondContact O-N 2.99Å; I268-Y270 VanDerWaalsContact C-N 3.3Å; I268-Y270 PolarHBondContact O-N 2.83Å; Y270-Q272 VanDerWaalsContact C-N 3.34Å; Y270-Q272 PolarHBondContact O-N 3.18Å; Y270-K273 PolarHBondContact O-N 3.17Å; Y270-K273 VanDerWaalsContact O-N 3.15Å; Y270-V274 HydrophobicContact CD1-CG2 3.98Å; Y270-V274 HydrophobicContact CE1-CG2 3.63Å; Y270-V274 WeakPolarHBondContact O-CG2 3.24Å; Y270-V274 PolarHBondContact O-N 2.88Å
271	G	93.8	Very high	93.6	Very high	36 Å²	36	100.4 Å²	100.4	37%	0.371	51%	0.511	S	S	.	.	H	α-helix	trans	-59	-41.3	175	0	0	0	0	0	113.1	E267 I268 V274 M275	E267-G271 PolarHBondContact O-N 2.88Å; I268-G271 PolarHBondContact O-N 3.43Å; G271-V274 PolarHBondContact O-N 3.24Å; G271-M275 WeakPolarHBondContact O-CB 3.45Å; G271-M275 PolarHBondContact O-N 2.81Å
272	Q	91.2	Very high	93.5	Very high	109 Å²	109	99.4 Å²	99.4	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-59.7	-46.4	173	-74.8	176.5	-17.1	0	0	111.7	I268 Y270 V274 M275 E276	I268-Q272 WeakPolarHBondContact O-CG 3.26Å; I268-Q272 PolarHBondContact O-N 2.79Å; Y270-Q272 VanDerWaalsContact C-N 3.34Å; Y270-Q272 PolarHBondContact O-N 3.18Å; Q272-V274 PolarHBondContact O-N 2.91Å; Q272-M275 PolarHBondContact O-N 3.38Å; Q272-E276 WeakPolarHBondContact O-CG 3.44Å; Q272-E276 PolarHBondContact O-N 2.84Å
273	K	93.7	Very high	93.3	Very high	130 Å²	130	99.3 Å²	99.3	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-64.4	-39.9	178.1	-72.6	174.5	-179.3	177.7	0	113.1	T269 Y270 E276 K277	T269-K273 WeakPolarHBondContact O-CG 3.42Å; T269-K273 PolarHBondContact O-N 3.4Å; T269-K273 VanDerWaalsContact O-N 3.14Å; Y270-K273 PolarHBondContact O-N 3.17Å; Y270-K273 VanDerWaalsContact O-N 3.15Å; K273-E276 PolarHBondContact O-N 2.86Å; K273-K277 WeakPolarHBondContact O-CG 3.22Å; K273-K277 PolarHBondContact O-N 2.96Å
274	V	94	Very high	93.2	Very high	56 Å²	56	99.3 Å²	99.3	34%	0.339	50%	0.499	S	S	.	.	H	α-helix	trans	-64.2	-46.2	175.7	173.3	0	0	0	0	109.8	Y270 G271 Q272 E276 K277 E278	Y270-V274 HydrophobicContact CD1-CG2 3.98Å; Y270-V274 HydrophobicContact CE1-CG2 3.63Å; Y270-V274 WeakPolarHBondContact O-CG2 3.24Å; Y270-V274 PolarHBondContact O-N 2.88Å; G271-V274 PolarHBondContact O-N 3.24Å; Q272-V274 PolarHBondContact O-N 2.91Å; V274-E276 VanDerWaalsContact C-N 3.35Å; V274-E276 PolarHBondContact O-N 2.84Å; V274-K277 PolarHBondContact O-N 2.84Å; V274-E278 HydrophobicContact CG1-CG 4.39Å; V274-E278 WeakPolarHBondContact O-CG 3.38Å; V274-E278 PolarHBondContact O-N 2.81Å
275	M	92.6	Very high	93.2	Very high	122 Å²	122	98.7 Å²	98.7	60%	0.601	50%	0.495	S	S	*	.	H	α-helix	trans	-58.7	-45.7	176.1	-173.4	-167.6	-60.5	0	0	111.4	G271 Q272 K277 E278 T279	G271-M275 WeakPolarHBondContact O-CB 3.45Å; G271-M275 PolarHBondContact O-N 2.81Å; Q272-M275 PolarHBondContact O-N 3.38Å; M275-K277 PolarHBondContact O-N 3.1Å; M275-E278 PolarHBondContact O-N 3.45Å; M275-T279 HydrophobicContact CG-CG2 4.44Å; M275-T279 VanDerWaalsContact O-CG2 3.31Å; M275-T279 WeakPolarHBondContact O-CG2 3.38Å; M275-T279 PolarHBondContact O-N 3.25Å; M275-T279 PolarHBondContact O-OG1 2.95Å
276	E	92.8	Very high	93.1	Very high	110 Å²	110	100.5 Å²	100.5	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-55.8	-49.3	175.6	-77.6	172.5	-179.2	0	0	111.2	Q272 K273 V274 E278 T279 E280	Q272-E276 WeakPolarHBondContact O-CG 3.44Å; Q272-E276 PolarHBondContact O-N 2.84Å; K273-E276 PolarHBondContact O-N 2.86Å; V274-E276 VanDerWaalsContact C-N 3.35Å; V274-E276 PolarHBondContact O-N 2.84Å; E276-E278 PolarHBondContact O-N 3.1Å; E276-T279 WeakPolarHBondContact CA-OG1 3.28Å; E276-T279 PolarHBondContact O-N 3.26Å; E276-T279 PolarHBondContact O-OG1 2.98Å; E276-E280 WeakPolarHBondContact O-CG 3.4Å; E276-E280 PolarHBondContact O-N 3.1Å
277	K	93.4	Very high	93	Very high	127 Å²	127	103.7 Å²	103.7	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-65.1	-37.8	178.7	-69	-72	157.3	-148.3	0	113.1	K273 V274 M275 E280 K281	K273-K277 WeakPolarHBondContact O-CG 3.22Å; K273-K277 PolarHBondContact O-N 2.96Å; V274-K277 PolarHBondContact O-N 2.84Å; M275-K277 PolarHBondContact O-N 3.1Å; K277-E280 WeakPolarHBondContact CD-OE2 3.04Å; K277-E280 VanDerWaalsContact NZ-CD 3.32Å; K277-E280 IonicContact NZ-OE1 2.62Å; K277-E280 PolarHBondContact NZ-OE1 3.02Å; K277-E280 VanDerWaalsContact NZ-OE1 3.13Å; K277-E280 IonicContact NZ-OE2 2.63Å; K277-E280 PolarHBondContact NZ-OE2 3.4Å; K277-E280 PolarHBondContact O-N 2.89Å; K277-K281 PolarHBondContact O-N 2.99Å
278	E	92.6	Very high	92.9	Very high	107 Å²	107	101.8 Å²	101.8	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-38.8	173.3	-74.2	-175.3	176.9	0	0	112	V274 M275 E276 K281 K282	V274-E278 HydrophobicContact CG1-CG 4.39Å; V274-E278 WeakPolarHBondContact O-CG 3.38Å; V274-E278 PolarHBondContact O-N 2.81Å; M275-E278 PolarHBondContact O-N 3.45Å; E276-E278 PolarHBondContact O-N 3.1Å; E278-K281 PolarHBondContact O-N 3.34Å; E278-K282 WeakPolarHBondContact O-CG 3.25Å; E278-K282 PolarHBondContact O-N 3.31Å
279	T	92.1	Very high	93	Very high	65 Å²	65	99.5 Å²	99.5	40%	0.399	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-41.5	175.2	55.9	0	0	0	0	111.7	M275 E276 K281 K282 I283	M275-T279 HydrophobicContact CG-CG2 4.44Å; M275-T279 VanDerWaalsContact O-CG2 3.31Å; M275-T279 WeakPolarHBondContact O-CG2 3.38Å; M275-T279 PolarHBondContact O-N 3.25Å; M275-T279 PolarHBondContact O-OG1 2.95Å; E276-T279 WeakPolarHBondContact CA-OG1 3.28Å; E276-T279 PolarHBondContact O-N 3.26Å; E276-T279 PolarHBondContact O-OG1 2.98Å; T279-K281 VanDerWaalsContact C-N 3.35Å; T279-K281 PolarHBondContact O-N 3.36Å; T279-K282 PolarHBondContact O-N 3.36Å; T279-I283 VanDerWaalsContact O-CG1 3.26Å; T279-I283 WeakPolarHBondContact O-CG1 3.43Å; T279-I283 PolarHBondContact O-N 3Å
280	E	92.8	Very high	92.9	Very high	93 Å²	93	99.5 Å²	99.5	44%	0.435	51%	0.505	S	S	.	.	H	α-helix	trans	-57.1	-48.3	172.7	-75.7	175.1	-171.4	0	0	110.8	E276 K277 K282 I283 S284	E276-E280 WeakPolarHBondContact O-CG 3.4Å; E276-E280 PolarHBondContact O-N 3.1Å; K277-E280 WeakPolarHBondContact CD-OE2 3.04Å; K277-E280 VanDerWaalsContact NZ-CD 3.32Å; K277-E280 IonicContact NZ-OE1 2.62Å; K277-E280 PolarHBondContact NZ-OE1 3.02Å; K277-E280 VanDerWaalsContact NZ-OE1 3.13Å; K277-E280 IonicContact NZ-OE2 2.63Å; K277-E280 PolarHBondContact NZ-OE2 3.4Å; K277-E280 PolarHBondContact O-N 2.89Å; E280-K282 VanDerWaalsContact C-N 3.35Å; E280-K282 PolarHBondContact O-N 2.85Å; E280-I283 PolarHBondContact O-N 3.25Å; E280-S284 PolarHBondContact O-N 3.13Å; E280-S284 PolarHBondContact O-OG 3.22Å
281	K	93.6	Very high	92.9	Very high	137 Å²	137	97.6 Å²	97.6	60%	0.596	50%	0.5	S	S	*	.	H	α-helix	trans	-58	-45.6	177.1	-173.8	-177	176.2	-168.6	0	112	K277 E278 T279 I283 S284 E285	K277-K281 PolarHBondContact O-N 2.99Å; E278-K281 PolarHBondContact O-N 3.34Å; T279-K281 VanDerWaalsContact C-N 3.35Å; T279-K281 PolarHBondContact O-N 3.36Å; K281-I283 VanDerWaalsContact C-N 3.34Å; K281-I283 PolarHBondContact O-N 3Å; K281-S284 PolarHBondContact O-N 2.95Å; K281-E285 WeakPolarHBondContact CE-OE1 3.07Å; K281-E285 IonicContact NZ-OE1 3.66Å; K281-E285 WeakPolarHBondContact O-CG 3.46Å; K281-E285 PolarHBondContact O-N 2.81Å
282	K	93.5	Very high	92.9	Very high	120 Å²	120	101 Å²	101	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-38.7	177.3	-74.3	172.8	-175.7	167.8	0	112.3	E278 T279 E280 E285 I286	E278-K282 WeakPolarHBondContact O-CG 3.25Å; E278-K282 PolarHBondContact O-N 3.31Å; T279-K282 PolarHBondContact O-N 3.36Å; E280-K282 VanDerWaalsContact C-N 3.35Å; E280-K282 PolarHBondContact O-N 2.85Å; K282-E285 PolarHBondContact O-N 2.87Å; K282-I286 WeakPolarHBondContact O-CD1 3.16Å; K282-I286 VanDerWaalsContact O-CG1 3.24Å; K282-I286 WeakPolarHBondContact O-CG1 3.27Å; K282-I286 PolarHBondContact O-N 3.03Å
283	I	91.9	Very high	92.9	Very high	91 Å²	91	98.8 Å²	98.8	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-47.4	175.8	-68.9	163.3	0	0	0	109.6	T279 E280 K281 E285 I286 E287	T279-I283 VanDerWaalsContact O-CG1 3.26Å; T279-I283 WeakPolarHBondContact O-CG1 3.43Å; T279-I283 PolarHBondContact O-N 3Å; E280-I283 PolarHBondContact O-N 3.25Å; K281-I283 VanDerWaalsContact C-N 3.34Å; K281-I283 PolarHBondContact O-N 3Å; I283-E285 PolarHBondContact O-N 3.35Å; I283-I286 PolarHBondContact O-N 2.82Å; I283-I286 VanDerWaalsContact O-N 3.17Å; I283-E287 HydrophobicContact CG2-CG 4.29Å; I283-E287 WeakPolarHBondContact O-CB 3.23Å; I283-E287 WeakPolarHBondContact O-CG 3.4Å; I283-E287 PolarHBondContact O-N 3.28Å
284	S	91.9	Very high	92.8	Very high	60 Å²	60	100.6 Å²	100.6	42%	0.42	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-43.2	176.4	-59.4	0	0	0	0	112.6	E280 K281 I286 E287 D288	E280-S284 PolarHBondContact O-N 3.13Å; E280-S284 PolarHBondContact O-OG 3.22Å; K281-S284 PolarHBondContact O-N 2.95Å; S284-I286 VanDerWaalsContact C-N 3.33Å; S284-I286 PolarHBondContact O-N 3.07Å; S284-E287 PolarHBondContact O-N 3.5Å; S284-D288 WeakPolarHBondContact O-CB 3.3Å; S284-D288 VanDerWaalsContact O-CG 3.31Å; S284-D288 PolarHBondContact O-N 3.33Å
285	E	94	Very high	92.8	Very high	104 Å²	104	101.6 Å²	101.6	49%	0.486	51%	0.514	S	S	.	.	H	α-helix	trans	-61.3	-39.9	175.7	-73.2	173.3	-175.7	0	0	112.3	K281 K282 I283 A289	K281-E285 WeakPolarHBondContact CE-OE1 3.07Å; K281-E285 IonicContact NZ-OE1 3.66Å; K281-E285 WeakPolarHBondContact O-CG 3.46Å; K281-E285 PolarHBondContact O-N 2.81Å; K282-E285 PolarHBondContact O-N 2.87Å; I283-E285 PolarHBondContact O-N 3.35Å; E285-A289 WeakPolarHBondContact O-CB 3.34Å; E285-A289 PolarHBondContact O-N 3.4Å
286	I	93.1	Very high	92.8	Very high	115 Å²	115	102.6 Å²	102.6	59%	0.59	51%	0.514	S	S	*	.	H	α-helix	trans	-68.3	-41.7	176	-68.7	165.3	0	0	0	110.8	K282 I283 S284 A289 A290	K282-I286 WeakPolarHBondContact O-CD1 3.16Å; K282-I286 VanDerWaalsContact O-CG1 3.24Å; K282-I286 WeakPolarHBondContact O-CG1 3.27Å; K282-I286 PolarHBondContact O-N 3.03Å; I283-I286 PolarHBondContact O-N 2.82Å; I283-I286 VanDerWaalsContact O-N 3.17Å; S284-I286 VanDerWaalsContact C-N 3.33Å; S284-I286 PolarHBondContact O-N 3.07Å; I286-A289 PolarHBondContact O-N 3.04Å; I286-A290 VanDerWaalsContact O-CB 3.23Å; I286-A290 WeakPolarHBondContact O-CB 2.98Å; I286-A290 PolarHBondContact O-N 3.34Å
287	E	91.1	Very high	92.8	Very high	120 Å²	120	100.1 Å²	100.1	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-63.1	-44.5	177.2	-75.2	178.2	171.2	0	0	111.6	I283 S284 A290 F291	I283-E287 HydrophobicContact CG2-CG 4.29Å; I283-E287 WeakPolarHBondContact O-CB 3.23Å; I283-E287 WeakPolarHBondContact O-CG 3.4Å; I283-E287 PolarHBondContact O-N 3.28Å; S284-E287 PolarHBondContact O-N 3.5Å; E287-A290 PolarHBondContact O-N 2.98Å; E287-F291 WeakPolarHBondContact O-CB 3.46Å; E287-F291 PolarHBondContact O-N 3.5Å
288	D	93.3	Very high	92.8	Very high	107 Å²	107	98.5 Å²	98.5	57%	0.572	51%	0.506	S	S	*	.	H	α-helix	trans	-61.8	-45.6	175.5	-73.6	-22	0	0	0	111.2	S284 A290 F291 L292	S284-D288 WeakPolarHBondContact O-CB 3.3Å; S284-D288 VanDerWaalsContact O-CG 3.31Å; S284-D288 PolarHBondContact O-N 3.33Å; D288-A290 PolarHBondContact O-N 2.95Å; D288-F291 PolarHBondContact O-N 3Å; D288-L292 WeakPolarHBondContact O-CB 3.47Å; D288-L292 WeakPolarHBondContact O-CG 3.31Å; D288-L292 PolarHBondContact O-N 2.81Å
289	A	93.4	Very high	92.8	Very high	58 Å²	58	95.9 Å²	95.9	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-41.6	176.3	0	0	0	0	0	111.9	E285 I286 A293	E285-A289 WeakPolarHBondContact O-CB 3.34Å; E285-A289 PolarHBondContact O-N 3.4Å; I286-A289 PolarHBondContact O-N 3.04Å; A289-A293 WeakPolarHBondContact O-CB 3.5Å; A289-A293 PolarHBondContact O-N 3.44Å
290	A	91.8	Very high	92.8	Very high	57 Å²	57	98.1 Å²	98.1	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-66.3	-39	176.7	0	0	0	0	0	111.8	I286 E287 D288 A293 R294	I286-A290 VanDerWaalsContact O-CB 3.23Å; I286-A290 WeakPolarHBondContact O-CB 2.98Å; I286-A290 PolarHBondContact O-N 3.34Å; E287-A290 PolarHBondContact O-N 2.98Å; D288-A290 PolarHBondContact O-N 2.95Å; A290-A293 PolarHBondContact O-N 3.22Å; A290-R294 VanDerWaalsContact O-CB 3.29Å; A290-R294 WeakPolarHBondContact O-CB 3.3Å; A290-R294 PolarHBondContact O-N 3.38Å
291	F	93.6	Very high	92.7	Very high	126 Å²	126	96.2 Å²	96.2	55%	0.553	51%	0.513	S	S	*	.	H	α-helix	trans	-64.4	-48.8	175.6	-176.9	-97.1	0	0	0	111.2	E287 D288 A293 R294 E295	E287-F291 WeakPolarHBondContact O-CB 3.46Å; E287-F291 PolarHBondContact O-N 3.5Å; D288-F291 PolarHBondContact O-N 3Å; F291-A293 VanDerWaalsContact C-N 3.33Å; F291-A293 PolarHBondContact O-N 2.99Å; F291-R294 PolarHBondContact O-N 3.37Å; F291-R294 VanDerWaalsContact O-N 3.14Å; F291-E295 HydrophobicContact CD1-CG 4.27Å; F291-E295 HydrophobicContact CE1-CG 3.79Å; F291-E295 HydrophobicContact CE2-CG 4.21Å; F291-E295 HydrophobicContact CZ-CG 3.75Å; F291-E295 PolarHBondContact O-N 3.43Å
292	L	93.9	Very high	92.6	Very high	108 Å²	108	96 Å²	96	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-59	-43.3	175.4	-73.4	174.4	0	0	0	112.1	D288 R294 K296	D288-L292 WeakPolarHBondContact O-CB 3.47Å; D288-L292 WeakPolarHBondContact O-CG 3.31Å; D288-L292 PolarHBondContact O-N 2.81Å; L292-R294 VanDerWaalsContact C-N 3.33Å; L292-K296 WeakPolarHBondContact O-CB 3.17Å; L292-K296 WeakPolarHBondContact O-CG 3.27Å; L292-K296 PolarHBondContact O-N 3.46Å
293	A	92.5	Very high	92.5	Very high	61 Å²	61	93.6 Å²	93.6	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-63.4	-40	176.2	0	0	0	0	0	111.8	A289 A290 F291 A297	A289-A293 WeakPolarHBondContact O-CB 3.5Å; A289-A293 PolarHBondContact O-N 3.44Å; A290-A293 PolarHBondContact O-N 3.22Å; F291-A293 VanDerWaalsContact C-N 3.33Å; F291-A293 PolarHBondContact O-N 2.99Å; A293-A297 WeakPolarHBondContact O-CB 3.41Å; A293-A297 PolarHBondContact O-N 2.85Å
294	R	91.4	Very high	92.5	Very high	168 Å²	168	96.2 Å²	96.2	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-67.1	-44.3	178.6	-171.7	177.8	-173.9	-179.6	0.6	112.4	A290 F291 L292 A297 K298	A290-R294 VanDerWaalsContact O-CB 3.29Å; A290-R294 WeakPolarHBondContact O-CB 3.3Å; A290-R294 PolarHBondContact O-N 3.38Å; F291-R294 PolarHBondContact O-N 3.37Å; F291-R294 VanDerWaalsContact O-N 3.14Å; L292-R294 VanDerWaalsContact C-N 3.33Å; R294-A297 PolarHBondContact O-N 2.88Å; R294-K298 WeakPolarHBondContact O-CG 3.24Å; R294-K298 PolarHBondContact O-N 3.46Å
295	E	92.8	Very high	92.5	Very high	78 Å²	78	97 Å²	97	36%	0.364	52%	0.519	S	S	.	.	H	α-helix	trans	-67.7	-39.5	178.2	-71.6	-58.3	123	0	0	111.7	F291 K298 A299	F291-E295 HydrophobicContact CD1-CG 4.27Å; F291-E295 HydrophobicContact CE1-CG 3.79Å; F291-E295 HydrophobicContact CE2-CG 4.21Å; F291-E295 HydrophobicContact CZ-CG 3.75Å; F291-E295 PolarHBondContact O-N 3.43Å; E295-K298 PolarHBondContact O-N 2.97Å; E295-K298 IonicContact OE1-NZ 2.7Å; E295-K298 PolarHBondContact OE1-NZ 2.74Å; E295-A299 WeakPolarHBondContact O-CB 3.49Å; E295-A299 PolarHBondContact O-N 3.41Å
296	K	93.8	Very high	92.3	Very high	142 Å²	142	94.7 Å²	94.7	62%	0.617	52%	0.518	S	S	*	.	H	α-helix	trans	-60	-48.3	170.8	-76.1	179.5	-179.7	179	0	112.1	L292 K298 A299 D300	L292-K296 WeakPolarHBondContact O-CB 3.17Å; L292-K296 WeakPolarHBondContact O-CG 3.27Å; L292-K296 PolarHBondContact O-N 3.46Å; K296-K298 VanDerWaalsContact C-N 3.29Å; K296-K298 PolarHBondContact O-N 3.27Å; K296-A299 PolarHBondContact O-N 2.77Å; K296-D300 WeakPolarHBondContact O-CB 3.46Å; K296-D300 VanDerWaalsContact O-CG 3.25Å; K296-D300 PolarHBondContact O-N 2.96Å
297	A	92.4	Very high	92.1	Very high	59 Å²	59	94.3 Å²	94.3	49%	0.488	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-36.6	179.3	0	0	0	0	0	112.7	A293 R294 A301	A293-A297 WeakPolarHBondContact O-CB 3.41Å; A293-A297 PolarHBondContact O-N 2.85Å; R294-A297 PolarHBondContact O-N 2.88Å; A297-A301 VanDerWaalsContact O-CB 3.3Å; A297-A301 WeakPolarHBondContact O-CB 3.3Å; A297-A301 PolarHBondContact O-N 3.22Å
298	K	94.1	Very high	92	Very high	92 Å²	92	93 Å²	93	40%	0.4	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-49.7	172.2	-75	178.9	-171.6	165.6	0	111.7	R294 E295 K296 D300 A301 E302	R294-K298 WeakPolarHBondContact O-CG 3.24Å; R294-K298 PolarHBondContact O-N 3.46Å; E295-K298 PolarHBondContact O-N 2.97Å; E295-K298 IonicContact OE1-NZ 2.7Å; E295-K298 PolarHBondContact OE1-NZ 2.74Å; K296-K298 VanDerWaalsContact C-N 3.29Å; K296-K298 PolarHBondContact O-N 3.27Å; K298-D300 VanDerWaalsContact C-N 3.31Å; K298-D300 PolarHBondContact O-N 2.85Å; K298-A301 PolarHBondContact O-N 3.37Å; K298-E302 WeakPolarHBondContact O-CG 3.5Å; K298-E302 PolarHBondContact O-N 2.89Å
299	A	91.8	Very high	91.7	Very high	53 Å²	53	92.6 Å²	92.6	44%	0.438	50%	0.504	S	S	.	.	H	α-helix	trans	-60.1	-41.2	179.3	0	0	0	0	0	111.9	E295 K296 E302 C303	E295-A299 WeakPolarHBondContact O-CB 3.49Å; E295-A299 PolarHBondContact O-N 3.41Å; K296-A299 PolarHBondContact O-N 2.77Å; A299-E302 PolarHBondContact O-N 3.46Å; A299-C303 WeakPolarHBondContact O-CB 3.43Å; A299-C303 PolarHBondContact O-N 2.83Å
300	D	93.1	Very high	91.3	Very high	111 Å²	111	92.3 Å²	92.3	59%	0.594	50%	0.501	S	S	*	.	H	α-helix	trans	-65.3	-41	175.7	-69.5	-21.6	0	0	0	111.6	K296 K298 C303 Y304	K296-D300 WeakPolarHBondContact O-CB 3.46Å; K296-D300 VanDerWaalsContact O-CG 3.25Å; K296-D300 PolarHBondContact O-N 2.96Å; K298-D300 VanDerWaalsContact C-N 3.31Å; K298-D300 PolarHBondContact O-N 2.85Å; D300-C303 PolarHBondContact O-N 3.06Å; D300-Y304 WeakPolarHBondContact O-CB 3.46Å; D300-Y304 PolarHBondContact O-N 2.79Å
301	A	89.9	Confident	91	Very high	54 Å²	54	93.8 Å²	93.8	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-41.7	175.1	0	0	0	0	0	112.1	A297 K298 Y304 T305	A297-A301 VanDerWaalsContact O-CB 3.3Å; A297-A301 WeakPolarHBondContact O-CB 3.3Å; A297-A301 PolarHBondContact O-N 3.22Å; K298-A301 PolarHBondContact O-N 3.37Å; A301-Y304 PolarHBondContact O-N 3.43Å; A301-T305 WeakPolarHBondContact O-CB 3.41Å; A301-T305 VanDerWaalsContact O-CG2 3.28Å; A301-T305 WeakPolarHBondContact O-CG2 3.5Å; A301-T305 PolarHBondContact O-N 2.87Å; A301-T305 PolarHBondContact O-OG1 2.84Å
302	E	91.8	Very high	90.5	Very high	131 Å²	131	89.6 Å²	89.6	61%	0.612	49%	0.488	S	S	*	.	H	α-helix	trans	-64	-42.8	174.4	-73.8	178.1	-173.2	0	0	111.7	K298 A299 T305 A306	K298-E302 WeakPolarHBondContact O-CG 3.5Å; K298-E302 PolarHBondContact O-N 2.89Å; A299-E302 PolarHBondContact O-N 3.46Å; E302-T305 WeakPolarHBondContact CA-OG1 3.47Å; E302-T305 PolarHBondContact O-N 3.03Å; E302-T305 PolarHBondContact O-OG1 2.89Å; E302-A306 VanDerWaalsContact O-CB 3.3Å; E302-A306 WeakPolarHBondContact O-CB 3.37Å; E302-A306 PolarHBondContact O-N 3.27Å
303	C	91.9	Very high	89.8	Confident	71 Å²	71	88.1 Å²	88.1	48%	0.48	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-47.1	174.9	-171.1	0	0	0	0	111.5	A299 D300 T305 A306 M307	A299-C303 WeakPolarHBondContact O-CB 3.43Å; A299-C303 PolarHBondContact O-N 2.83Å; D300-C303 PolarHBondContact O-N 3.06Å; C303-T305 PolarHBondContact O-N 3.16Å; C303-A306 PolarHBondContact O-N 2.8Å; C303-M307 WeakPolarHBondContact O-CB 3.22Å; C303-M307 WeakPolarHBondContact O-CG 3.26Å; C303-M307 PolarHBondContact O-N 2.91Å
304	Y	91.9	Very high	89.3	Confident	145 Å²	145	93 Å²	93	57%	0.569	49%	0.49	S	S	*	.	H	α-helix	trans	-62.7	-43.5	179	-177.6	-101.6	0	0	0	112.2	D300 A301 M307 K308	D300-Y304 WeakPolarHBondContact O-CB 3.46Å; D300-Y304 PolarHBondContact O-N 2.79Å; A301-Y304 PolarHBondContact O-N 3.43Å; Y304-M307 PolarHBondContact O-N 3Å; Y304-K308 HydrophobicContact CD1-CG 4.35Å; Y304-K308 HydrophobicContact CE1-CG 3.97Å; Y304-K308 HydrophobicContact CE2-CG 4.32Å; Y304-K308 WeakPolarHBondContact O-CG 3.19Å; Y304-K308 PolarHBondContact O-N 2.85Å; Y304-K308 WeakPolarHBondContact OH-CE 3.42Å
305	T	90.8	Very high	88.7	Confident	76 Å²	76	91.8 Å²	91.8	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-44.5	176.3	53.5	0	0	0	0	111.5	A301 E302 C303 M307 K308 I309	A301-T305 WeakPolarHBondContact O-CB 3.41Å; A301-T305 VanDerWaalsContact O-CG2 3.28Å; A301-T305 WeakPolarHBondContact O-CG2 3.5Å; A301-T305 PolarHBondContact O-N 2.87Å; A301-T305 PolarHBondContact O-OG1 2.84Å; E302-T305 WeakPolarHBondContact CA-OG1 3.47Å; E302-T305 PolarHBondContact O-N 3.03Å; E302-T305 PolarHBondContact O-OG1 2.89Å; C303-T305 PolarHBondContact O-N 3.16Å; T305-M307 PolarHBondContact O-N 2.77Å; T305-K308 PolarHBondContact O-N 2.76Å; T305-I309 WeakPolarHBondContact O-CB 3.41Å; T305-I309 WeakPolarHBondContact O-CD1 3.35Å; T305-I309 VanDerWaalsContact O-CG1 3.23Å; T305-I309 WeakPolarHBondContact O-CG1 3.26Å; T305-I309 PolarHBondContact O-N 2.83Å
306	A	89.2	Confident	87.6	Confident	57 Å²	57	92.9 Å²	92.9	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-42.9	175.9	0	0	0	0	0	112.3	E302 C303 I309 A310	E302-A306 VanDerWaalsContact O-CB 3.3Å; E302-A306 WeakPolarHBondContact O-CB 3.37Å; E302-A306 PolarHBondContact O-N 3.27Å; C303-A306 PolarHBondContact O-N 2.8Å; A306-I309 PolarHBondContact O-N 3.13Å; A306-A310 WeakPolarHBondContact O-CB 3.38Å; A306-A310 PolarHBondContact O-N 3.47Å
307	M	89.6	Confident	86.5	Confident	106 Å²	106	91.7 Å²	91.7	52%	0.522	50%	0.499	S	S	.	.	H	α-helix	trans	-60	-46.6	174.5	-76.3	-174.6	69.2	0	0	111.8	C303 Y304 T305 I309 A310 E311	C303-M307 WeakPolarHBondContact O-CB 3.22Å; C303-M307 WeakPolarHBondContact O-CG 3.26Å; C303-M307 PolarHBondContact O-N 2.91Å; Y304-M307 PolarHBondContact O-N 3Å; T305-M307 PolarHBondContact O-N 2.77Å; M307-I309 VanDerWaalsContact C-N 3.34Å; M307-I309 PolarHBondContact O-N 3.18Å; M307-A310 PolarHBondContact O-N 2.93Å; M307-E311 WeakPolarHBondContact O-CG 3.25Å; M307-E311 PolarHBondContact O-N 3.5Å
308	K	89.7	Confident	85.7	Confident	92 Å²	92	91.8 Å²	91.8	40%	0.4	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-37.2	178.3	-71.5	-71.1	160.1	-151.6	0	112.5	Y304 T305 E311 A312	Y304-K308 HydrophobicContact CD1-CG 4.35Å; Y304-K308 HydrophobicContact CE1-CG 3.97Å; Y304-K308 HydrophobicContact CE2-CG 4.32Å; Y304-K308 WeakPolarHBondContact O-CG 3.19Å; Y304-K308 PolarHBondContact O-N 2.85Å; Y304-K308 WeakPolarHBondContact OH-CE 3.42Å; T305-K308 PolarHBondContact O-N 2.76Å; K308-E311 IonicContact NZ-OE1 3.99Å; K308-E311 IonicContact NZ-OE2 3.93Å; K308-E311 PolarHBondContact NZ-OE2 3.48Å; K308-A312 WeakPolarHBondContact O-CB 3.34Å; K308-A312 PolarHBondContact O-N 3.4Å
309	I	87.3	Confident	84.7	Confident	100 Å²	100	92 Å²	92	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-65	-43.3	173.4	-68.7	164.2	0	0	0	110.5	T305 A306 M307 A312 N313	T305-I309 WeakPolarHBondContact O-CB 3.41Å; T305-I309 WeakPolarHBondContact O-CD1 3.35Å; T305-I309 VanDerWaalsContact O-CG1 3.23Å; T305-I309 WeakPolarHBondContact O-CG1 3.26Å; T305-I309 PolarHBondContact O-N 2.83Å; A306-I309 PolarHBondContact O-N 3.13Å; M307-I309 VanDerWaalsContact C-N 3.34Å; M307-I309 PolarHBondContact O-N 3.18Å; I309-A312 PolarHBondContact O-N 2.98Å; I309-N313 WeakPolarHBondContact O-CB 3.44Å; I309-N313 PolarHBondContact O-N 2.79Å; I309-N313 PolarHBondContact O-ND2 3.06Å
310	A	83.8	Confident	83.9	Confident	51 Å²	51	96.5 Å²	96.5	42%	0.421	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-42.6	177.3	0	0	0	0	0	112.3	A306 M307 N313 K314	A306-A310 WeakPolarHBondContact O-CB 3.38Å; A306-A310 PolarHBondContact O-N 3.47Å; M307-A310 PolarHBondContact O-N 2.93Å; A310-N313 PolarHBondContact O-N 3.01Å; A310-K314 PolarHBondContact O-N 3.06Å
311	E	86.1	Confident	83.2	Confident	88 Å²	88	95.7 Å²	95.7	41%	0.411	51%	0.505	S	S	.	.	H	α-helix	trans	-60.3	-47.1	172.2	-74.6	176.4	177.9	0	0	111.8	M307 K308 N313 K314 L315	M307-E311 WeakPolarHBondContact O-CG 3.25Å; M307-E311 PolarHBondContact O-N 3.5Å; K308-E311 IonicContact NZ-OE1 3.99Å; K308-E311 IonicContact NZ-OE2 3.93Å; K308-E311 PolarHBondContact NZ-OE2 3.48Å; E311-N313 VanDerWaalsContact C-N 3.31Å; E311-N313 PolarHBondContact O-N 3.19Å; E311-K314 WeakPolarHBondContact O-CB 3.27Å; E311-K314 PolarHBondContact O-N 3.05Å; E311-L315 PolarHBondContact O-N 3.44Å
312	A	82.5	Confident	82.5	Confident	39 Å²	39	97.5 Å²	97.5	32%	0.322	51%	0.507	S	S	.	.	H	α-helix	trans	-63	-37.8	177.1	0	0	0	0	0	112.2	K308 I309 K314 L315 K316	K308-A312 WeakPolarHBondContact O-CB 3.34Å; K308-A312 PolarHBondContact O-N 3.4Å; I309-A312 PolarHBondContact O-N 2.98Å; A312-K314 VanDerWaalsContact C-N 3.35Å; A312-L315 PolarHBondContact O-N 3.46Å; A312-K316 WeakPolarHBondContact O-CG 3.28Å; A312-K316 PolarHBondContact O-N 3.19Å; A312-K316 VanDerWaalsContact O-N 3.09Å
313	N	80.3	Confident	81.8	Confident	77 Å²	77	96.5 Å²	96.5	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-67.4	-34	177	-73.2	-17.2	0	0	0	112.1	I309 A310 E311 L315 K316 L317	I309-N313 WeakPolarHBondContact O-CB 3.44Å; I309-N313 PolarHBondContact O-N 2.79Å; I309-N313 PolarHBondContact O-ND2 3.06Å; A310-N313 PolarHBondContact O-N 3.01Å; E311-N313 VanDerWaalsContact C-N 3.31Å; E311-N313 PolarHBondContact O-N 3.19Å; N313-L315 VanDerWaalsContact C-N 3.32Å; N313-L315 PolarHBondContact O-N 3.02Å; N313-K316 PolarHBondContact O-N 3.36Å; N313-L317 WeakPolarHBondContact O-CG 3.35Å; N313-L317 PolarHBondContact O-N 2.68Å
314	K	80.3	Confident	81.2	Confident	162 Å²	162	98 Å²	98	70%	0.704	51%	0.505	S	S	*	.	H	α-helix	trans	-60.1	-41.1	172	-73.4	178	-177.7	178.1	0	112.1	A310 E311 A312 L317	A310-K314 PolarHBondContact O-N 3.06Å; E311-K314 WeakPolarHBondContact O-CB 3.27Å; E311-K314 PolarHBondContact O-N 3.05Å; A312-K314 VanDerWaalsContact C-N 3.35Å; K314-L317 PolarHBondContact O-N 3.2Å
315	L	78.9	Confident	80.7	Confident	144 Å²	144	95 Å²	95	75%	0.754	50%	0.497	S	S	*	.	H	α-helix	trans	-71.1	-30.1	177.1	-66.8	173.2	0	0	0	113	E311 A312 N313 L317	E311-L315 PolarHBondContact O-N 3.44Å; A312-L315 PolarHBondContact O-N 3.46Å; N313-L315 VanDerWaalsContact C-N 3.32Å; N313-L315 PolarHBondContact O-N 3.02Å; L315-L317 PolarHBondContact O-N 2.96Å
316	K	71.3	Confident	80.1	Confident	100 Å²	100	98.1 Å²	98.1	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-73.7	-10.1	176.7	-70.8	173.7	-174.9	175.4	0	113.8	A312 N313 T318 Y321	A312-K316 WeakPolarHBondContact O-CG 3.28Å; A312-K316 PolarHBondContact O-N 3.19Å; A312-K316 VanDerWaalsContact O-N 3.09Å; N313-K316 PolarHBondContact O-N 3.36Å; K316-T318 PolarHBondContact O-N 2.86Å; K316-Y321 HydrophobicContact CB-CD1 4.08Å; K316-Y321 HydrophobicContact CB-CE1 4.02Å; K316-Y321 HydrophobicContact CD-CE1 4.35Å; K316-Y321 HydrophobicContact CG-CE1 4.31Å; K316-Y321 WeakPolarHBondContact O-CD1 3.31Å
317	L	69.7	Low	79.6	Confident	118 Å²	118	102.6 Å²	102.6	62%	0.618	51%	0.51	S	S	*	.			trans	-79.2	48.5	177.8	-72.8	165.9	0	0	0	112.5	N313 K314 L315 L322	N313-L317 WeakPolarHBondContact O-CG 3.35Å; N313-L317 PolarHBondContact O-N 2.68Å; K314-L317 PolarHBondContact O-N 3.2Å; L315-L317 PolarHBondContact O-N 2.96Å; L317-L322 HydrophobicContact CD2-CD1 4.34Å; L317-L322 HydrophobicContact CD2-CD2 4.33Å
318	T	76.6	Confident	79.3	Confident	60 Å²	60	104 Å²	104	37%	0.368	51%	0.513	S	S	.	.			trans	-88.5	144.6	166.7	60.6	0	0	0	0	109.7	K316 E320 Y321 L322	K316-T318 PolarHBondContact O-N 2.86Å; T318-E320 PolarHBondContact O-N 2.9Å; T318-Y321 PolarHBondContact O-N 2.9Å; T318-Y321 VanDerWaalsContact O-N 3.16Å; T318-Y321 VanDerWaalsContact OG1-CB 3.27Å; T318-Y321 WeakPolarHBondContact OG1-CB 3.27Å; T318-Y321 PolarHBondContact OG1-N 3.36Å; T318-L322 PolarHBondContact O-N 3.3Å; T318-L322 VanDerWaalsContact O-N 3.09Å
319	P	72.3	Confident	78.8	Confident	96 Å²	96	102 Å²	102	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-59	-33.6	-179.2	23.2	-33	0	0	0	112	Q323	P319-Q323 WeakPolarHBondContact O-CG 3.41Å; P319-Q323 PolarHBondContact O-N 2.84Å; P319-Q323 VanDerWaalsContact O-N 3.08Å
320	E	75.1	Confident	78.2	Confident	149 Å²	149	101.3 Å²	101.3	70%	0.696	51%	0.51	S	S	*	.	H	α-helix	trans	-67.3	-42.3	177.9	-63.9	160.3	-175.8	0	0	112.2	T318 Q323 L324	T318-E320 PolarHBondContact O-N 2.9Å; E320-Q323 PolarHBondContact O-N 2.99Å; E320-L324 PolarHBondContact O-N 2.86Å
321	Y	77.4	Confident	77.7	Confident	93 Å²	93	102.1 Å²	102.1	37%	0.365	52%	0.517	S	S	.	.	H	α-helix	trans	-72.1	-36.5	178.8	-173.9	-101.7	0	0	0	112.1	K316 T318 Q323 L324 M325	K316-Y321 HydrophobicContact CB-CD1 4.08Å; K316-Y321 HydrophobicContact CB-CE1 4.02Å; K316-Y321 HydrophobicContact CD-CE1 4.35Å; K316-Y321 HydrophobicContact CG-CE1 4.31Å; K316-Y321 WeakPolarHBondContact O-CD1 3.31Å; T318-Y321 PolarHBondContact O-N 2.9Å; T318-Y321 VanDerWaalsContact O-N 3.16Å; T318-Y321 VanDerWaalsContact OG1-CB 3.27Å; T318-Y321 WeakPolarHBondContact OG1-CB 3.27Å; T318-Y321 PolarHBondContact OG1-N 3.36Å; Y321-Q323 VanDerWaalsContact C-N 3.33Å; Y321-L324 PolarHBondContact O-N 3.37Å; Y321-M325 HydrophobicContact CD1-CG 3.97Å; Y321-M325 HydrophobicContact CE1-CG 3.57Å; Y321-M325 HydrophobicContact CE1-SD 4.36Å; Y321-M325 HydrophobicContact CE2-CG 4.37Å; Y321-M325 WeakPolarHBondContact O-CB 3.39Å; Y321-M325 WeakPolarHBondContact O-CG 3.48Å; Y321-M325 PolarHBondContact O-N 2.88Å
322	L	76.1	Confident	77.1	Confident	93 Å²	93	102.4 Å²	102.4	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-38.3	173.1	-69.6	176.7	0	0	0	111.8	L317 T318 M325 K326	L317-L322 HydrophobicContact CD2-CD1 4.34Å; L317-L322 HydrophobicContact CD2-CD2 4.33Å; T318-L322 PolarHBondContact O-N 3.3Å; T318-L322 VanDerWaalsContact O-N 3.09Å; L322-M325 PolarHBondContact O-N 3.49Å; L322-K326 VanDerWaalsContact O-CB 3.26Å; L322-K326 WeakPolarHBondContact O-CB 3.27Å; L322-K326 PolarHBondContact O-N 2.94Å
323	Q	76.9	Confident	76.3	Confident	110 Å²	110	107 Å²	107	51%	0.514	55%	0.548	S	S	.	.	H	α-helix	trans	-64.5	-46.5	172	-76	178.7	3.7	0	0	111.5	P319 E320 Y321 M325 K326 Y327	P319-Q323 WeakPolarHBondContact O-CG 3.41Å; P319-Q323 PolarHBondContact O-N 2.84Å; P319-Q323 VanDerWaalsContact O-N 3.08Å; E320-Q323 PolarHBondContact O-N 2.99Å; Y321-Q323 VanDerWaalsContact C-N 3.33Å; Q323-M325 VanDerWaalsContact C-N 3.32Å; Q323-M325 PolarHBondContact O-N 2.97Å; Q323-K326 WeakPolarHBondContact O-CB 3.24Å; Q323-K326 PolarHBondContact O-N 2.76Å; Q323-Y327 HydrophobicContact CB-CD2 4.49Å; Q323-Y327 HydrophobicContact CB-CE2 4.25Å; Q323-Y327 WeakPolarHBondContact O-CD2 3.27Å; Q323-Y327 PolarHBondContact O-N 3.01Å
324	L	80.5	Confident	75.5	Confident	102 Å²	102	107.1 Å²	107.1	53%	0.534	55%	0.554	S	S	.	*	H	α-helix	trans	-58.8	-45.1	176	-168.3	152.9	0	0	0	111.1	E320 Y321 Y327 K328	E320-L324 PolarHBondContact O-N 2.86Å; Y321-L324 PolarHBondContact O-N 3.37Å; L324-Y327 PolarHBondContact O-N 3.13Å; L324-K328 VanDerWaalsContact O-CB 3.28Å; L324-K328 WeakPolarHBondContact O-CB 3.32Å; L324-K328 PolarHBondContact O-N 2.9Å
325	M	80.6	Confident	74.4	Confident	82 Å²	82	107.2 Å²	107.2	40%	0.404	56%	0.555	S	S	.	*	H	α-helix	trans	-66	-38.2	177.2	-76.6	-63.1	-68	0	0	112.2	Y321 L322 Q323 K328 A329	Y321-M325 HydrophobicContact CD1-CG 3.97Å; Y321-M325 HydrophobicContact CE1-CG 3.57Å; Y321-M325 HydrophobicContact CE1-SD 4.36Å; Y321-M325 HydrophobicContact CE2-CG 4.37Å; Y321-M325 WeakPolarHBondContact O-CB 3.39Å; Y321-M325 WeakPolarHBondContact O-CG 3.48Å; Y321-M325 PolarHBondContact O-N 2.88Å; L322-M325 PolarHBondContact O-N 3.49Å; Q323-M325 VanDerWaalsContact C-N 3.32Å; Q323-M325 PolarHBondContact O-N 2.97Å; M325-K328 PolarHBondContact O-N 3.36Å; M325-K328 HydrophobicContact SD-CD 4.48Å; M325-A329 VanDerWaalsContact O-CB 3.28Å; M325-A329 WeakPolarHBondContact O-CB 3.15Å; M325-A329 PolarHBondContact O-N 3.35Å
326	K	76.9	Confident	73.4	Confident	141 Å²	141	106.7 Å²	106.7	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-60.6	-48.8	172.1	-179.1	-179.6	178.6	179.3	0	110.8	L322 Q323 K328 A329 I330	L322-K326 VanDerWaalsContact O-CB 3.26Å; L322-K326 WeakPolarHBondContact O-CB 3.27Å; L322-K326 PolarHBondContact O-N 2.94Å; Q323-K326 WeakPolarHBondContact O-CB 3.24Å; Q323-K326 PolarHBondContact O-N 2.76Å; K326-K328 PolarHBondContact O-N 2.92Å; K326-A329 PolarHBondContact O-N 2.96Å; K326-I330 HydrophobicContact CG-CD1 3.9Å; K326-I330 WeakPolarHBondContact O-CB 3.43Å; K326-I330 WeakPolarHBondContact O-CG1 3.49Å; K326-I330 PolarHBondContact O-N 3.3Å
327	Y	78.9	Confident	72.7	Confident	151 Å²	151	110.9 Å²	110.9	59%	0.592	57%	0.566	S	S	*	*	H	α-helix	trans	-64.4	-39.3	176.9	-69.3	-53.9	0	0	0	112.2	Q323 L324 I330 A331	Q323-Y327 HydrophobicContact CB-CD2 4.49Å; Q323-Y327 HydrophobicContact CB-CE2 4.25Å; Q323-Y327 WeakPolarHBondContact O-CD2 3.27Å; Q323-Y327 PolarHBondContact O-N 3.01Å; L324-Y327 PolarHBondContact O-N 3.13Å; Y327-I330 PolarHBondContact O-N 2.93Å; Y327-A331 VanDerWaalsContact O-CB 3.3Å; Y327-A331 WeakPolarHBondContact O-CB 3.44Å; Y327-A331 PolarHBondContact O-N 3.45Å
328	K	83.9	Confident	71.7	Confident	137 Å²	137	114.5 Å²	114.5	60%	0.596	58%	0.577	S	S	*	*	H	α-helix	trans	-64.4	-41.8	175.8	-168.6	174.4	-178.5	177.3	0	111.6	L324 M325 K326 A331 S332	L324-K328 VanDerWaalsContact O-CB 3.28Å; L324-K328 WeakPolarHBondContact O-CB 3.32Å; L324-K328 PolarHBondContact O-N 2.9Å; M325-K328 PolarHBondContact O-N 3.36Å; M325-K328 HydrophobicContact SD-CD 4.48Å; K326-K328 PolarHBondContact O-N 2.92Å; K328-A331 PolarHBondContact O-N 2.96Å; K328-S332 PolarHBondContact O-N 3.32Å; K328-S332 PolarHBondContact O-OG 2.9Å; K328-S332 VanDerWaalsContact O-OG 3.09Å
329	A	78.6	Confident	70.6	Confident	48 Å²	48	114.1 Å²	114.1	40%	0.397	59%	0.585	S	S	.	*	H	α-helix	trans	-65.2	-42.4	174.8	0	0	0	0	0	111.9	M325 K326 S332 N333	M325-A329 VanDerWaalsContact O-CB 3.28Å; M325-A329 WeakPolarHBondContact O-CB 3.15Å; M325-A329 PolarHBondContact O-N 3.35Å; K326-A329 PolarHBondContact O-N 2.96Å; A329-S332 WeakPolarHBondContact CA-OG 3.4Å; A329-S332 PolarHBondContact O-N 3.49Å; A329-S332 PolarHBondContact O-OG 2.94Å; A329-N333 WeakPolarHBondContact O-CB 3.33Å; A329-N333 PolarHBondContact O-N 3.09Å
330	I	74.8	Confident	69.7	Low	87 Å²	87	119.7 Å²	119.7	45%	0.446	60%	0.599	S	S	.	*	H	α-helix	trans	-61.1	-46.3	173.2	-69.1	165.5	0	0	0	110.5	K326 Y327 S332 N333 S334	K326-I330 HydrophobicContact CG-CD1 3.9Å; K326-I330 WeakPolarHBondContact O-CB 3.43Å; K326-I330 WeakPolarHBondContact O-CG1 3.49Å; K326-I330 PolarHBondContact O-N 3.3Å; Y327-I330 PolarHBondContact O-N 2.93Å; I330-S332 VanDerWaalsContact C-N 3.34Å; I330-S332 PolarHBondContact O-N 2.85Å; I330-N333 CarbonylContact O-C 3.59Å; I330-N333 PolarHBondContact O-N 3.37Å; I330-N333 VanDerWaalsContact O-N 3.1Å; I330-S334 PolarHBondContact O-N 3.35Å
331	A	73.3	Confident	68.8	Low	68 Å²	68	120.1 Å²	120.1	56%	0.562	61%	0.606	S	S	*	*	H	α-helix	trans	-63.4	-37.7	178.6	0	0	0	0	0	112.5	Y327 K328 N333 S334	Y327-A331 VanDerWaalsContact O-CB 3.3Å; Y327-A331 WeakPolarHBondContact O-CB 3.44Å; Y327-A331 PolarHBondContact O-N 3.45Å; K328-A331 PolarHBondContact O-N 2.96Å; A331-N333 VanDerWaalsContact C-N 3.32Å; A331-S334 PolarHBondContact O-OG 3.26Å
332	S	74.6	Confident	67.8	Low	93 Å²	93	122.1 Å²	122.1	65%	0.65	62%	0.622	S	S	*	*	H	α-helix	trans	-72.1	-24	173.9	54.6	0	0	0	0	113.6	K328 A329 I330	K328-S332 PolarHBondContact O-N 3.32Å; K328-S332 PolarHBondContact O-OG 2.9Å; K328-S332 VanDerWaalsContact O-OG 3.09Å; A329-S332 WeakPolarHBondContact CA-OG 3.4Å; A329-S332 PolarHBondContact O-N 3.49Å; A329-S332 PolarHBondContact O-OG 2.94Å; I330-S332 VanDerWaalsContact C-N 3.34Å; I330-S332 PolarHBondContact O-N 2.85Å
333	N	66.3	Low	67	Low	137 Å²	137	123 Å²	123	73%	0.733	63%	0.633	S	S	*	*	H	α-helix	trans	-99.2	-2.9	-179.1	-94.1	-26.6	0	0	0	114.7	A329 I330 A331 K335	A329-N333 WeakPolarHBondContact O-CB 3.33Å; A329-N333 PolarHBondContact O-N 3.09Å; I330-N333 CarbonylContact O-C 3.59Å; I330-N333 PolarHBondContact O-N 3.37Å; I330-N333 VanDerWaalsContact O-N 3.1Å; A331-N333 VanDerWaalsContact C-N 3.32Å; N333-K335 PolarHBondContact O-N 2.95Å
334	S	62.4	Low	65.7	Low	79 Å²	79	126 Å²	126	55%	0.552	65%	0.652	S	S	*	*			trans	-75.7	84.3	177.6	60.3	0	0	0	0	111.4	I330 A331	I330-S334 PolarHBondContact O-N 3.35Å; A331-S334 PolarHBondContact O-OG 3.26Å
335	K	58	Low	64.6	Low	164 Å²	164	128.6 Å²	128.6	71%	0.713	66%	0.664	S	S	*	*			trans	-81.7	116.7	156.6	-74	178.4	179	175.1	0	107.9	N333 Y337	N333-K335 PolarHBondContact O-N 2.95Å; K335-Y337 HydrophobicContact CB-CD2 4.47Å; K335-Y337 HydrophobicContact CB-CE2 3.79Å; K335-Y337 VanDerWaalsContact O-CD2 3.3Å; K335-Y337 WeakPolarHBondContact O-CD2 3.23Å
336	I	57.3	Low	63.3	Low	132 Å²	132	133.7 Å²	133.7	68%	0.677	68%	0.684	S	S	*	*			trans	-80.5	119	179.4	-55.8	168.9	0	0	0	108.5	F338	I336-F338 HydrophobicContact CB-CE2 4.41Å; I336-F338 HydrophobicContact CG2-CD2 3.88Å; I336-F338 HydrophobicContact CG2-CE1 4.35Å; I336-F338 HydrophobicContact CG2-CE2 3.35Å; I336-F338 HydrophobicContact CG2-CZ 3.62Å
337	Y	55.8	Low	61.6	Low	188 Å²	188	135 Å²	135	74%	0.737	69%	0.694	S	S	*	*			trans	-105.4	126.8	172.9	-65	-92.1	0	0	0	109	K335	K335-Y337 HydrophobicContact CB-CD2 4.47Å; K335-Y337 HydrophobicContact CB-CE2 3.79Å; K335-Y337 VanDerWaalsContact O-CD2 3.3Å; K335-Y337 WeakPolarHBondContact O-CD2 3.23Å
338	F	48.5	Very low	59.8	Low	195 Å²	195	134.6 Å²	134.6	86%	0.855	70%	0.703	S	S	*	*			trans	-109.8	122.6	175.5	-70.8	-80.7	0	0	0	110.4	I336	I336-F338 HydrophobicContact CB-CE2 4.41Å; I336-F338 HydrophobicContact CG2-CD2 3.88Å; I336-F338 HydrophobicContact CG2-CE1 4.35Å; I336-F338 HydrophobicContact CG2-CE2 3.35Å; I336-F338 HydrophobicContact CG2-CZ 3.62Å
339	G	53.4	Low	57.3	Low	52 Å²	52	133.7 Å²	133.7	54%	0.536	71%	0.713	S	S	.	*			trans	-178.3	153.6	178.9	0	0	0	0	0	112.5	D341	G339-D341 VanDerWaalsContact C-N 3.27Å; G339-D341 PolarHBondContact O-N 3.43Å; G339-D341 VanDerWaalsContact O-N 3.14Å
340	K	53.6	Low	55.5	Low	213 Å²	213	136.1 Å²	136.1	93%	0.926	73%	0.733	S	S	*	*	S	Bend	trans	-70	-2.6	-164.2	-97.9	175.9	176.9	174.8	0	117.1
341	D	57.3	Low	53.5	Low	157 Å²	157	135.1 Å²	135.1	84%	0.84	75%	0.745	S	S	*	*			trans	-140.2	104.1	172.5	-70.7	-58.2	0	0	0	109.8	G339	G339-D341 VanDerWaalsContact C-N 3.27Å; G339-D341 PolarHBondContact O-N 3.43Å; G339-D341 VanDerWaalsContact O-N 3.14Å
342	I	56.3	Low	51.6	Low	136 Å²	136	137.4 Å²	137.4	70%	0.697	76%	0.757	S	S	*	*			trans	-99.1	121.6	180	-59.4	174.1	0	0	0	108.5
343	P	58.8	Low	49.6	Very low	111 Å²	111	139.9 Å²	139.9	72%	0.721	77%	0.768	S	S	*	*			trans	-69.6	131.8	171.8	-15.3	29.4	0	0	0	111.1	M345	P343-M345 PolarHBondContact O-N 3.42Å
344	N	50.5	Low	48.1	Very low	172 Å²	172	138.8 Å²	138.8	92%	0.92	77%	0.771	S	S	*	*			trans	-62.2	93.1	171	-81.1	-21.9	0	0	0	110.3
345	M	57.6	Low	46.9	Very low	158 Å²	158	144.7 Å²	144.7	78%	0.778	79%	0.786	S	S	*	*			trans	-110.9	78.5	168.4	-167.2	-179.5	83.1	0	0	108.7	P343	P343-M345 PolarHBondContact O-N 3.42Å
346	F	53.3	Low	45.7	Very low	188 Å²	188	146 Å²	146	83%	0.825	80%	0.795	S	S	*	*			trans	179.5	101.1	149.2	-95.2	-67.6	0	0	0	107
347	M	39.5	Very low	44.5	Very low	168 Å²	168	149.7 Å²	149.7	83%	0.828	81%	0.807	S	S	*	*			trans	-173.9	108.5	137.1	-78.9	-140.2	76.4	0	0	109.1
348	D	42.9	Very low	43.4	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	82%	0.816	S	S	*	*			trans	38.8	118.2	144.9	-57.8	-23.5	0	0	0	121.1
349	S	30.7	Very low	42.7	Very low	117 Å²	117	144.5 Å²	144.5	82%	0.818	81%	0.811	S	S	*	*				-172.1	143.2	114.5	-175.4	0	0	0	0	111.2
350	A	39.8	Very low	41.6	Very low	99 Å²	99	150.7 Å²	150.7	82%	0.818	83%	0.831	S	S	*	*			trans	-47.3	143.8	165.4	0	0	0	0	0	112.8
351	G	33.9	Very low	40.6	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	82%	0.823	S	S	*	*			trans	133.7	121.9	164.8	0	0	0	0	0	114.6
352	S	33.2	Very low	39.7	Very low	116 Å²	116	145 Å²	145	81%	0.811	82%	0.824	S	S	*	*			trans	67.6	87.7	160.7	67.6	0	0	0	0	119.6
353	V	32.3	Very low	38.6	Very low	145 Å²	145	148.1 Å²	148.1	88%	0.879	83%	0.832	S	S	*	*			trans	-136.9	87.1	140.6	-175.1	0	0	0	0	108.2
354	S	34.1	Very low	37.1	Very low	114 Å²	114	151.6 Å²	151.6	80%	0.797	84%	0.844	S	S	*	*			trans	-143.1	70.3	165.7	54.6	0	0	0	0	108
355	K	37.8	Very low	36.1	Very low	202 Å²	202	148.6 Å²	148.6	88%	0.878	84%	0.836	S	S	*	*			trans	-174	80.5	161.1	-110.1	178	-179.2	-176.6	0	108.6
356	Q	32.2	Very low	34.7	Very low	192 Å²	192	149.6 Å²	149.6	90%	0.897	84%	0.837	S	S	*	*			trans	-169.7	65.8	158	-107	176.7	-0	0	0	107.9
357	F	32.5	Very low	33.4	Very low	210 Å²	210	144.4 Å²	144.4	92%	0.921	84%	0.836	S	S	*	*			trans	-141.3	70.4	161.2	-166.6	-92.4	0	0	0	107
358	E	34.3	Very low	33.1	Very low	201 Å²	201	142.3 Å²	142.3	94%	0.939	83%	0.827	S	S	*	*			trans	-167.3	97.6	171.9	-112.3	167.5	-175.8	0	0	105.4
359	G	31.8	Very low	32.6	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	84%	0.835	S	S	*	*	S	Bend	trans	148.4	34.8	-173.9	0	0	0	0	0	114.9
360	L	32.3	Very low	32.6	Very low	182 Å²	182	146.1 Å²	146.1	95%	0.953	83%	0.832	S	S	*	*	S	Bend	trans	-153.1	36.1	158.8	-139.8	83	0	0	0	110.7
361	A	32.3	Very low	32.2	Very low	92 Å²	92	149.2 Å²	149.2	76%	0.76	83%	0.83	S	S	*	*			trans	-121	63.7	170.2	0	0	0	0	0	106.7
362	D	37.7	Very low	32.6	Very low	160 Å²	160	151.2 Å²	151.2	86%	0.856	83%	0.831	S	S	*	*			trans	-161.3	86.4	168	-103	-22	0	0	0	109.6
363	K	32.7	Very low	32.6	Very low	200 Å²	200	152.7 Å²	152.7	87%	0.87	83%	0.829	S	S	*	*	S	Bend	trans	156.3	85.5	148.6	-88.7	175.1	-178	-176.4	0	108.9
364	L	28.5	Very low	32.8	Very low	184 Å²	184	154.1 Å²	154.1	96%	0.963	83%	0.826	S	S	*	*			trans	166.7	71.5	130.9	-88.3	153	0	0	0	110.7
365	S	28.9	Very low	32.9	Very low	110 Å²	110	154.2 Å²	154.2	77%	0.769	82%	0.822	S	S	*	*			trans	-154.1	133.6	150.3	56.4	0	0	0	0	103.3
366	F	28.1	Very low	32.6	Very low	179 Å²	179	149.3 Å²	149.3	79%	0.785	82%	0.819	S	S	*	*			cis	-178.3	162.3	39.7	-156.1	-109.8	0	0	0	106.3	L368	F366-L368 HydrophobicContact CD1-CB 4.37Å; F366-L368 HydrophobicContact CD1-CG 4.23Å; F366-L368 HydrophobicContact CE1-CB 3.92Å; F366-L368 HydrophobicContact CE1-CD1 3.42Å; F366-L368 VanDerWaalsContact CE1-CD1 3.42Å; F366-L368 HydrophobicContact CE1-CG 3.44Å; F366-L368 VanDerWaalsContact CE1-CG 3.44Å; F366-L368 HydrophobicContact CZ-CD1 3.69Å; F366-L368 HydrophobicContact CZ-CG 3.92Å
367	G	25.9	Very low	32.8	Very low	79 Å²	79	146.2 Å²	146.2	81%	0.814	81%	0.813	S	S	*	*			trans	-164.9	77.7	169.1	0	0	0	0	0	110.2
368	L	33.8	Very low	32.8	Very low	123 Å²	123	144.2 Å²	144.2	64%	0.644	80%	0.804	S	S	*	*			trans	-85.5	136.1	158.6	-77.4	178.7	0	0	0	108	F366	F366-L368 HydrophobicContact CD1-CB 4.37Å; F366-L368 HydrophobicContact CD1-CG 4.23Å; F366-L368 HydrophobicContact CE1-CB 3.92Å; F366-L368 HydrophobicContact CE1-CD1 3.42Å; F366-L368 VanDerWaalsContact CE1-CD1 3.42Å; F366-L368 HydrophobicContact CE1-CG 3.44Å; F366-L368 VanDerWaalsContact CE1-CG 3.44Å; F366-L368 HydrophobicContact CZ-CD1 3.69Å; F366-L368 HydrophobicContact CZ-CG 3.92Å
369	E	31.5	Very low	33	Very low	199 Å²	199	141.5 Å²	141.5	93%	0.93	79%	0.792	S	S	*	*			trans	-129.3	118.7	145.4	-79.1	-175.1	145	0	0	107.9
370	D	30.5	Very low	33.5	Very low	142 Å²	142	149.6 Å²	149.6	76%	0.759	82%	0.818	S	S	*	*			trans	-54	158.2	155.8	-70.5	-47.4	0	0	0	110.2
371	E	31.8	Very low	33.6	Very low	165 Å²	165	148 Å²	148	77%	0.771	81%	0.811	S	S	*	*			cis	179.7	-177	35.5	-114.1	-110.4	114.8	0	0	106
372	P	42.5	Very low	33.6	Very low	108 Å²	108	150.9 Å²	150.9	70%	0.701	81%	0.814	S	S	*	*			cis	-130.8	174.6	-8.5	29.2	-7	0	0	0	115.5
373	L	33.3	Very low	33.4	Very low	148 Å²	148	150.4 Å²	150.4	78%	0.775	81%	0.811	S	S	*	*			trans	-98.6	144.8	166	-174.8	91.6	0	0	0	110.3
374	E	36.2	Very low	33.4	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	81%	0.808	S	S	*	*			trans	170.5	106.8	140.2	-95.6	-171	169.8	0	0	109.1
375	T	35.8	Very low	33.8	Very low	116 Å²	116	145.2 Å²	145.2	71%	0.712	80%	0.798	S	S	*	*				56.6	118.1	92.7	61.3	0	0	0	0	117.3
376	A	31.1	Very low	34.1	Very low	99 Å²	99	147.5 Å²	147.5	82%	0.818	80%	0.8	S	S	*	*			trans	-156.1	109.4	135.9	0	0	0	0	0	111.3
377	T	36.9	Very low	34.5	Very low	127 Å²	127	145.3 Å²	145.3	78%	0.779	80%	0.801	S	S	*	*			trans	-50	146	145.9	41.7	0	0	0	0	111.8
378	K	33.7	Very low	35.2	Very low	167 Å²	167	150.4 Å²	150.4	73%	0.726	80%	0.8	S	S	*	*				167.9	128.2	115.7	-95.3	-177.7	166.5	-163.1	0	114.3
379	E	37.2	Very low	35.3	Very low	145 Å²	145	152.7 Å²	152.7	68%	0.678	81%	0.813	S	S	*	*				50.7	98	128.5	-61.5	171.1	148	0	0	118.8
380	N	42.9	Very low	35.6	Very low	241 Å²	241	148.5 Å²	148.5	100%	1.289	80%	0.802	S	S	*	*				-174.7	0	96.6	-93.8	-25.4	0	0	0	111

Retrieved 380 of 380 residues in 390.9 ms (Link to these results)

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