A0A087Y410_POEFO Loading...

ATP-binding cassette, sub-family D (ALD), member 1

AlphaFold DB , UniProt , Accession A0A087Y410, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 754 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	37.3	Very low	40	Very low	246 Å²	246	162.1 Å²	162.1	100%	1.212	86%	0.861	S	S	*	*				0	48.1	0	-104	-173.8	174.5	0	0	111.1
2	Q	32.8	Very low	40.7	Very low	194 Å²	194	157.2 Å²	157.2	91%	0.907	83%	0.834	S	S	*	*			trans	-120.3	7	-176.7	-90.1	176.2	-25.3	0	0	113.8
3	L	33.3	Very low	40.9	Very low	182 Å²	182	162.5 Å²	162.5	95%	0.953	84%	0.836	S	S	*	*	S	Bend	trans	-116.9	13	-176	-97.7	150.1	0	0	0	114.5
4	A	37.7	Very low	41.3	Very low	87 Å²	87	168.6 Å²	168.6	72%	0.719	84%	0.843	S	S	*	*	S	Bend	trans	-117.7	10.5	-178.2	0	0	0	0	0	114.3
5	N	39.8	Very low	41.9	Very low	162 Å²	162	161.1 Å²	161.1	87%	0.866	81%	0.813	S	S	*	*	S	Bend	trans	-100.6	2.6	-170.3	-118.5	5.8	0	0	0	115.2
6	E	40.3	Very low	42.5	Very low	193 Å²	193	156.4 Å²	156.4	90%	0.902	80%	0.8	S	S	*	*	S	Bend	trans	-107.1	5.5	-171.8	-97.9	-177.4	161.7	0	0	116
7	K	45.4	Very low	43.2	Very low	198 Å²	198	159.2 Å²	159.2	86%	0.861	80%	0.798	S	S	*	*			trans	-128.3	61.8	175.7	-73.3	-171.1	177.9	-178.6	0	113.2
8	L	39.5	Very low	43.6	Very low	130 Å²	130	156 Å²	156	68%	0.681	78%	0.783	S	S	*	*			trans	-134.5	130	163.6	-104.8	101.9	0	0	0	111.6	L12	L8-L12 HydrophobicContact CD2-CB 4.44Å; L8-L12 HydrophobicContact CD2-CD1 3.6Å
9	P	45.5	Very low	44.2	Very low	100 Å²	100	157.7 Å²	157.7	65%	0.649	78%	0.779	S	S	*	*			trans	-68.9	147.6	-178.1	26.3	-31.7	0	0	0	112.2	Q11 L12	P9-Q11 PolarHBondContact O-N 2.96Å; P9-L12 PolarHBondContact O-N 2.73Å
10	A	42.2	Very low	44.8	Very low	100 Å²	100	157.1 Å²	157.1	83%	0.826	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-62.4	-0.5	-168.7	0	0	0	0	0	116.7
11	Q	46.3	Very low	45.4	Very low	191 Å²	191	154.7 Å²	154.7	89%	0.893	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-86.5	-6.8	179.3	-76.8	-176.3	-29.1	0	0	114.8	P9	P9-Q11 PolarHBondContact O-N 2.96Å
12	L	48	Very low	46.4	Very low	103 Å²	103	145.2 Å²	145.2	54%	0.539	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-89.9	7.3	-179.3	-89.8	154	0	0	0	115.2	L8 P9 R14	L8-L12 HydrophobicContact CD2-CB 4.44Å; L8-L12 HydrophobicContact CD2-CD1 3.6Å; P9-L12 PolarHBondContact O-N 2.73Å; L12-R14 PolarHBondContact O-N 3.2Å
13	R	43.3	Very low	47.7	Very low	227 Å²	227	138.8 Å²	138.8	86%	0.857	70%	0.701	S	S	*	*	S	Bend	trans	-84.4	2	-173.7	-129.2	175.9	-178.8	-177.4	-0.1	115.5
14	R	47	Very low	49.3	Very low	247 Å²	247	135.2 Å²	135.2	93%	0.932	68%	0.682	S	S	*	*	S	Bend	trans	-131.8	15.1	-166	-108.1	-177.8	-177	-179.8	2.5	120.7	L12	L12-R14 PolarHBondContact O-N 3.2Å
15	S	49.5	Very low	50.6	Low	57 Å²	57	136.5 Å²	136.5	40%	0.399	68%	0.676	S	S	.	*			trans	-137.8	123	170.8	80.5	0	0	0	0	115.5	R17 L18	S15-R17 VanDerWaalsContact C-N 3.26Å; S15-R17 PolarHBondContact O-N 3.32Å; S15-L18 WeakPolarHBondContact OG-CD1 3.3Å
16	S	52.2	Low	52	Low	86 Å²	86	134.6 Å²	134.6	60%	0.601	66%	0.664	S	S	*	*	H	α-helix	trans	-71	-18.4	178.4	64	0	0	0	0	113.5	K20	S16-K20 PolarHBondContact O-N 2.49Å
17	R	53.9	Low	52.8	Low	203 Å²	203	128 Å²	128	77%	0.766	64%	0.643	S	S	*	*	H	α-helix	trans	-72.4	-34.8	179.5	-66.1	-175.4	-170.3	179.3	3	112.6	S15 K20 M21	S15-R17 VanDerWaalsContact C-N 3.26Å; S15-R17 PolarHBondContact O-N 3.32Å; R17-K20 PolarHBondContact O-N 2.92Å; R17-M21 WeakPolarHBondContact O-CG 3.24Å; R17-M21 PolarHBondContact O-N 2.91Å
18	L	50	Low	53.7	Low	102 Å²	102	121.2 Å²	121.2	53%	0.534	62%	0.624	S	S	.	*	H	α-helix	trans	-70.9	-32.6	179.5	-99.7	143.5	0	0	0	112.9	S15 M21 A22	S15-L18 WeakPolarHBondContact OG-CD1 3.3Å; L18-M21 PolarHBondContact O-N 2.78Å; L18-A22 WeakPolarHBondContact O-CB 3.46Å; L18-A22 PolarHBondContact O-N 3.47Å
19	R	55.3	Low	54.8	Low	189 Å²	189	122.3 Å²	122.3	71%	0.713	62%	0.62	S	S	*	*	H	α-helix	trans	-68.1	-37.8	172.4	-67.6	-173.4	-161.4	166.8	5.9	112.5	A22 A23	R19-A22 PolarHBondContact O-N 2.61Å; R19-A23 WeakPolarHBondContact O-CB 3.38Å; R19-A23 PolarHBondContact O-N 3.07Å
20	K	55.6	Low	55.6	Low	144 Å²	144	119.7 Å²	119.7	63%	0.626	61%	0.607	S	S	*	*	H	α-helix	trans	-65.8	-42.1	175.1	-68.6	-179.8	179.9	-174.2	0	111	S16 R17 A23 I24	S16-K20 PolarHBondContact O-N 2.49Å; R17-K20 PolarHBondContact O-N 2.92Å; K20-A23 PolarHBondContact O-N 2.85Å; K20-I24 WeakPolarHBondContact O-CD1 3.29Å; K20-I24 WeakPolarHBondContact O-CG1 3.4Å; K20-I24 PolarHBondContact O-N 3.05Å
21	M	59.2	Low	56.9	Low	108 Å²	108	119.9 Å²	119.9	53%	0.532	60%	0.597	S	S	.	*	H	α-helix	trans	-65.4	-41.7	174.4	-72.8	-117.9	65.5	0	0	112.8	R17 L18 I24 L25	R17-M21 WeakPolarHBondContact O-CG 3.24Å; R17-M21 PolarHBondContact O-N 2.91Å; L18-M21 PolarHBondContact O-N 2.78Å; M21-I24 PolarHBondContact O-N 2.98Å; M21-L25 WeakPolarHBondContact O-CB 3.31Å; M21-L25 WeakPolarHBondContact O-CG 3.48Å; M21-L25 PolarHBondContact O-N 3.08Å
22	A	58.3	Low	58.1	Low	47 Å²	47	118.4 Å²	118.4	39%	0.388	59%	0.588	S	S	.	*	H	α-helix	trans	-64	-40.9	176.3	0	0	0	0	0	112.2	L18 R19 L25 I26	L18-A22 WeakPolarHBondContact O-CB 3.46Å; L18-A22 PolarHBondContact O-N 3.47Å; R19-A22 PolarHBondContact O-N 2.61Å; A22-L25 PolarHBondContact O-N 3.39Å; A22-I26 WeakPolarHBondContact O-CB 3.32Å; A22-I26 WeakPolarHBondContact O-CD1 3.39Å; A22-I26 WeakPolarHBondContact O-CG1 3.48Å; A22-I26 PolarHBondContact O-N 3.29Å
23	A	59.2	Low	59.2	Low	58 Å²	58	120.6 Å²	120.6	48%	0.479	59%	0.593	S	S	.	*	H	α-helix	trans	-65.5	-39.6	175.7	0	0	0	0	0	112.5	R19 K20 I26 A27	R19-A23 WeakPolarHBondContact O-CB 3.38Å; R19-A23 PolarHBondContact O-N 3.07Å; K20-A23 PolarHBondContact O-N 2.85Å; A23-I26 PolarHBondContact O-N 2.82Å; A23-A27 WeakPolarHBondContact O-CB 3.19Å; A23-A27 PolarHBondContact O-N 3.08Å
24	I	67.9	Low	60.1	Low	107 Å²	107	115 Å²	115	55%	0.549	58%	0.58	S	S	.	*	H	α-helix	trans	-66.4	-40	175.6	-68	165	0	0	0	110.8	K20 M21 A27 A28	K20-I24 WeakPolarHBondContact O-CD1 3.29Å; K20-I24 WeakPolarHBondContact O-CG1 3.4Å; K20-I24 PolarHBondContact O-N 3.05Å; M21-I24 PolarHBondContact O-N 2.98Å; I24-A27 PolarHBondContact O-N 3.47Å; I24-A28 VanDerWaalsContact O-CB 3.28Å; I24-A28 WeakPolarHBondContact O-CB 3.3Å; I24-A28 PolarHBondContact O-N 2.82Å
25	L	63.8	Low	60.7	Low	114 Å²	114	106.1 Å²	106.1	60%	0.597	56%	0.556	S	S	*	*	H	α-helix	trans	-68.4	-37.6	176.5	-78.8	164.6	0	0	0	112.5	M21 A22 A28 Y29	M21-L25 WeakPolarHBondContact O-CB 3.31Å; M21-L25 WeakPolarHBondContact O-CG 3.48Å; M21-L25 PolarHBondContact O-N 3.08Å; A22-L25 PolarHBondContact O-N 3.39Å; L25-A28 PolarHBondContact O-N 3.08Å; L25-Y29 VanDerWaalsContact O-CB 3.24Å; L25-Y29 WeakPolarHBondContact O-CB 3.13Å; L25-Y29 PolarHBondContact O-N 3.31Å
26	I	69.1	Low	61.3	Low	122 Å²	122	106.3 Å²	106.3	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-67.9	-40.8	174.9	-67.9	164.1	0	0	0	110.7	A22 A23 Y29 A30	A22-I26 WeakPolarHBondContact O-CB 3.32Å; A22-I26 WeakPolarHBondContact O-CD1 3.39Å; A22-I26 WeakPolarHBondContact O-CG1 3.48Å; A22-I26 PolarHBondContact O-N 3.29Å; A23-I26 PolarHBondContact O-N 2.82Å; I26-Y29 PolarHBondContact O-N 3.01Å; I26-A30 WeakPolarHBondContact O-CB 3.36Å; I26-A30 PolarHBondContact O-N 2.86Å
27	A	58.3	Low	61.9	Low	56 Å²	56	110.6 Å²	110.6	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-65.6	-43	175	0	0	0	0	0	112	A23 I24 Y29 A30 V31	A23-A27 WeakPolarHBondContact O-CB 3.19Å; A23-A27 PolarHBondContact O-N 3.08Å; I24-A27 PolarHBondContact O-N 3.47Å; A27-Y29 VanDerWaalsContact C-N 3.34Å; A27-Y29 PolarHBondContact O-N 3.17Å; A27-A30 PolarHBondContact O-N 3.3Å; A27-V31 WeakPolarHBondContact O-CG2 3.48Å; A27-V31 PolarHBondContact O-N 2.93Å
28	A	64.3	Low	61.8	Low	55 Å²	55	107 Å²	107	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-64.7	-37.8	175.7	0	0	0	0	0	112	I24 L25 K32	I24-A28 VanDerWaalsContact O-CB 3.28Å; I24-A28 WeakPolarHBondContact O-CB 3.3Å; I24-A28 PolarHBondContact O-N 2.82Å; L25-A28 PolarHBondContact O-N 3.08Å; A28-K32 WeakPolarHBondContact O-CB 3.48Å; A28-K32 PolarHBondContact O-N 2.91Å
29	Y	62.3	Low	61.9	Low	153 Å²	153	110.4 Å²	110.4	60%	0.6	56%	0.559	S	S	*	*	H	α-helix	trans	-68.6	-38.9	175.3	-171.9	-105.3	0	0	0	112.3	L25 I26 A27 K32 K33	L25-Y29 VanDerWaalsContact O-CB 3.24Å; L25-Y29 WeakPolarHBondContact O-CB 3.13Å; L25-Y29 PolarHBondContact O-N 3.31Å; I26-Y29 PolarHBondContact O-N 3.01Å; A27-Y29 VanDerWaalsContact C-N 3.34Å; A27-Y29 PolarHBondContact O-N 3.17Å; Y29-K32 PolarHBondContact O-N 3.49Å; Y29-K33 HydrophobicContact CE1-CD 4.38Å; Y29-K33 WeakPolarHBondContact O-CB 3.35Å; Y29-K33 PolarHBondContact O-N 2.65Å
30	A	61.7	Low	61.7	Low	44 Å²	44	109 Å²	109	36%	0.364	55%	0.553	S	S	.	*	H	α-helix	trans	-64.1	-42.8	174.3	0	0	0	0	0	112	I26 A27 K33 L34	I26-A30 WeakPolarHBondContact O-CB 3.36Å; I26-A30 PolarHBondContact O-N 2.86Å; A27-A30 PolarHBondContact O-N 3.3Å; A30-K33 PolarHBondContact O-N 2.8Å; A30-L34 WeakPolarHBondContact O-CB 3.47Å; A30-L34 WeakPolarHBondContact O-CG 3.41Å; A30-L34 PolarHBondContact O-N 2.89Å
31	V	68.9	Low	61.7	Low	104 Å²	104	111.8 Å²	111.8	63%	0.63	56%	0.56	S	S	*	*	H	α-helix	trans	-64.4	-44.3	175.1	172.2	0	0	0	0	111.1	A27 K33 L34 S35	A27-V31 WeakPolarHBondContact O-CG2 3.48Å; A27-V31 PolarHBondContact O-N 2.93Å; V31-K33 VanDerWaalsContact C-N 3.29Å; V31-K33 PolarHBondContact O-N 3.11Å; V31-L34 PolarHBondContact O-N 3.32Å; V31-S35 WeakPolarHBondContact O-CB 3.35Å; V31-S35 PolarHBondContact O-N 2.99Å
32	K	71.7	Confident	61	Low	160 Å²	160	112.6 Å²	112.6	70%	0.696	57%	0.566	S	S	*	*	H	α-helix	trans	-60.5	-38.2	176	-169.9	175.6	-179.2	177.2	0	111.9	A28 Y29 S35 P36	A28-K32 WeakPolarHBondContact O-CB 3.48Å; A28-K32 PolarHBondContact O-N 2.91Å; Y29-K32 PolarHBondContact O-N 3.49Å; K32-S35 PolarHBondContact O-OG 3.45Å; K32-S35 VanDerWaalsContact O-OG 3.04Å; K32-P36 WeakPolarHBondContact O-CD 3.2Å
33	K	71.5	Confident	60.3	Low	150 Å²	150	115.9 Å²	115.9	65%	0.652	57%	0.573	S	S	*	*	H	α-helix	trans	-79.8	-28.7	-178.8	-162.9	172.1	-177.9	179.7	0	114	Y29 A30 V31 P36	Y29-K33 HydrophobicContact CE1-CD 4.38Å; Y29-K33 WeakPolarHBondContact O-CB 3.35Å; Y29-K33 PolarHBondContact O-N 2.65Å; A30-K33 PolarHBondContact O-N 2.8Å; V31-K33 VanDerWaalsContact C-N 3.29Å; V31-K33 PolarHBondContact O-N 3.11Å; K33-P36 VanDerWaalsContact O-CD 3.27Å; K33-P36 WeakPolarHBondContact O-CD 3.38Å
34	L	62.8	Low	59.6	Low	109 Å²	109	122.8 Å²	122.8	57%	0.571	59%	0.587	S	S	*	*	H	α-helix	trans	-87.1	-25.8	177.6	-78.3	159.5	0	0	0	113.4	A30 V31 Y37 M38	A30-L34 WeakPolarHBondContact O-CB 3.47Å; A30-L34 WeakPolarHBondContact O-CG 3.41Å; A30-L34 PolarHBondContact O-N 2.89Å; V31-L34 PolarHBondContact O-N 3.32Å; L34-Y37 PolarHBondContact O-N 3.36Å; L34-Y37 VanDerWaalsContact O-N 3.11Å; L34-M38 PolarHBondContact O-N 3.42Å
35	S	60.4	Low	58.2	Low	61 Å²	61	121.1 Å²	121.1	43%	0.427	60%	0.596	S	S	.	*	H	α-helix	trans	-53.3	-39.3	178.3	74.6	0	0	0	0	115.2	V31 K32 Y37 W39	V31-S35 WeakPolarHBondContact O-CB 3.35Å; V31-S35 PolarHBondContact O-N 2.99Å; K32-S35 PolarHBondContact O-OG 3.45Å; K32-S35 VanDerWaalsContact O-OG 3.04Å; S35-Y37 VanDerWaalsContact C-N 3.33Å; S35-Y37 PolarHBondContact O-N 2.88Å; S35-W39 WeakPolarHBondContact O-CB 3.29Å; S35-W39 PolarHBondContact O-N 3.45Å
36	P	60.8	Low	57	Low	60 Å²	60	119.9 Å²	119.9	39%	0.39	60%	0.602	S	S	.	*	H	α-helix	trans	-74	-26.2	-179.5	-9.2	26.7	0	0	0	112.2	K32 K33 R40	K32-P36 WeakPolarHBondContact O-CD 3.2Å; K33-P36 VanDerWaalsContact O-CD 3.27Å; K33-P36 WeakPolarHBondContact O-CD 3.38Å; P36-R40 WeakPolarHBondContact O-CG 3.29Å; P36-R40 PolarHBondContact O-N 3.08Å; P36-R40 VanDerWaalsContact O-N 3.14Å
37	Y	64.6	Low	55.4	Low	176 Å²	176	117.9 Å²	117.9	69%	0.69	60%	0.604	S	S	*	*	H	α-helix	trans	-77.5	-38	-179.5	-145.9	-87.4	0	0	0	111.2	L34 S35 R41	L34-Y37 PolarHBondContact O-N 3.36Å; L34-Y37 VanDerWaalsContact O-N 3.11Å; S35-Y37 VanDerWaalsContact C-N 3.33Å; S35-Y37 PolarHBondContact O-N 2.88Å; Y37-R41 PolarHBondContact O-N 2.81Å
38	M	51.6	Low	54.2	Low	128 Å²	128	118.6 Å²	118.6	63%	0.631	62%	0.617	S	S	*	*	H	α-helix	trans	-68.7	-40.1	171.4	-75.5	-178.3	46.3	0	0	112.1	L34 R41 L42	L34-M38 PolarHBondContact O-N 3.42Å; M38-R41 PolarHBondContact O-N 3.28Å; M38-L42 PolarHBondContact O-N 2.79Å; M38-L42 VanDerWaalsContact O-N 3.14Å
39	W	52.1	Low	53	Low	173 Å²	173	124 Å²	124	66%	0.655	64%	0.638	S	S	*	*	H	α-helix	trans	-65.3	-39.8	179.3	-160	-89	0	0	0	112.8	S35 R41 L42 Q43	S35-W39 WeakPolarHBondContact O-CB 3.29Å; S35-W39 PolarHBondContact O-N 3.45Å; W39-R41 VanDerWaalsContact C-N 3.27Å; W39-R41 PolarHBondContact O-N 3.04Å; W39-L42 PolarHBondContact O-N 3.23Å; W39-Q43 PolarHBondContact O-N 3.31Å; W39-Q43 VanDerWaalsContact O-N 3.07Å
40	R	52.8	Low	51.5	Low	159 Å²	159	126.3 Å²	126.3	60%	0.6	65%	0.654	S	S	*	*	H	α-helix	trans	-65.5	-26.9	174.5	-76.1	177.8	-165.5	170.7	4	113.7	P36 R44	P36-R40 WeakPolarHBondContact O-CG 3.29Å; P36-R40 PolarHBondContact O-N 3.08Å; P36-R40 VanDerWaalsContact O-N 3.14Å; R40-R44 WeakPolarHBondContact O-CG 2.88Å; R40-R44 PolarHBondContact O-N 3.43Å
41	R	53.7	Low	49.9	Very low	204 Å²	204	128.4 Å²	128.4	77%	0.77	68%	0.68	S	S	*	*	H	α-helix	trans	-79.9	-32.5	177.4	-133.5	179.5	-174.9	-179.1	1.5	112	Y37 M38 W39 G45	Y37-R41 PolarHBondContact O-N 2.81Å; M38-R41 PolarHBondContact O-N 3.28Å; W39-R41 VanDerWaalsContact C-N 3.27Å; W39-R41 PolarHBondContact O-N 3.04Å; R41-G45 PolarHBondContact O-N 3.46Å
42	L	44.9	Very low	47.9	Very low	124 Å²	124	127.6 Å²	127.6	65%	0.649	69%	0.692	S	S	*	*	H	α-helix	trans	-69.1	-37.3	172.1	-98.9	139.2	0	0	0	112.4	M38 W39 G45	M38-L42 PolarHBondContact O-N 2.79Å; M38-L42 VanDerWaalsContact O-N 3.14Å; W39-L42 PolarHBondContact O-N 3.23Å; L42-G45 PolarHBondContact O-N 3.02Å
43	Q	43.5	Very low	45.8	Very low	116 Å²	116	124 Å²	124	54%	0.542	70%	0.701	S	S	.	*	H	α-helix	trans	-71.4	-31.5	176.1	-74.5	179	-29.9	0	0	113.4	W39 G45 A46 A47	W39-Q43 PolarHBondContact O-N 3.31Å; W39-Q43 VanDerWaalsContact O-N 3.07Å; Q43-G45 VanDerWaalsContact C-N 3.27Å; Q43-G45 PolarHBondContact O-N 3.37Å; Q43-A46 PolarHBondContact O-N 2.99Å; Q43-A47 PolarHBondContact O-N 2.85Å
44	R	44.6	Very low	43.7	Very low	204 Å²	204	121.4 Å²	121.4	77%	0.77	71%	0.708	S	S	*	*	H	α-helix	trans	-71.9	-16.7	173.2	-74.5	-177	-162	173.7	3.1	114.2	R40	R40-R44 WeakPolarHBondContact O-CG 2.88Å; R40-R44 PolarHBondContact O-N 3.43Å
45	G	38.8	Very low	42.1	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-10.5	171.5	0	0	0	0	0	113.9	R41 L42 Q43	R41-G45 PolarHBondContact O-N 3.46Å; L42-G45 PolarHBondContact O-N 3.02Å; Q43-G45 VanDerWaalsContact C-N 3.27Å; Q43-G45 PolarHBondContact O-N 3.37Å
46	A	38.3	Very low	40.6	Very low	87 Å²	87	128.5 Å²	128.5	72%	0.719	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-8.1	-176.8	0	0	0	0	0	113.8	Q43	Q43-A46 PolarHBondContact O-N 2.99Å
47	A	35	Very low	39.6	Very low	81 Å²	81	130.9 Å²	130.9	67%	0.669	75%	0.752	S	S	*	*			trans	-101.6	87.3	170.4	0	0	0	0	0	108.8	Q43	Q43-A47 PolarHBondContact O-N 2.85Å
48	G	33.4	Very low	37.8	Very low	71 Å²	71	128.9 Å²	128.9	73%	0.732	76%	0.758	S	S	*	*			trans	-80.4	126.9	166.7	0	0	0	0	0	110.2
49	D	39.9	Very low	36.4	Very low	169 Å²	169	126 Å²	126	90%	0.904	76%	0.761	S	S	*	*			trans	60.6	83.1	140	-119.3	11.3	0	0	0	118.5
50	E	30.1	Very low	35.3	Very low	201 Å²	201	124.2 Å²	124.2	94%	0.939	77%	0.769	S	S	*	*			trans	-132.1	122.1	150.1	-78.5	-168.6	160.9	0	0	110.2
51	G	28.4	Very low	34	Very low	88 Å²	88	122.9 Å²	122.9	91%	0.907	78%	0.778	S	S	*	*			trans	105.6	100.1	150	0	0	0	0	0	118.2
52	G	27.9	Very low	32.5	Very low	86 Å²	86	117.6 Å²	117.6	89%	0.887	77%	0.773	S	S	*	*			trans	174.4	53.4	164.3	0	0	0	0	0	115.9
53	G	26.5	Very low	31.4	Very low	84 Å²	84	117.7 Å²	117.7	87%	0.866	78%	0.779	S	S	*	*			trans	-84.7	139.5	175.8	0	0	0	0	0	114
54	A	27.7	Very low	30.6	Very low	97 Å²	97	118.6 Å²	118.6	80%	0.802	79%	0.792	S	S	*	*			trans	-138.2	98.1	158.2	0	0	0	0	0	110.7
55	K	28.6	Very low	29.6	Very low	192 Å²	192	118.2 Å²	118.2	84%	0.835	80%	0.799	S	S	*	*			trans	46	100.6	137.3	-67	-178.8	179	-178.4	0	119.1
56	T	30	Very low	28.9	Very low	127 Å²	127	118 Å²	118	78%	0.779	80%	0.797	S	S	*	*				90.1	160	91.1	46.9	0	0	0	0	115
57	P	38.5	Very low	28.3	Very low	109 Å²	109	119.6 Å²	119.6	71%	0.708	80%	0.802	S	S	*	*			cis	-129.6	178.8	-30.5	29.4	-6	0	0	0	110.7
58	V	26.7	Very low	27.9	Very low	135 Å²	135	124.7 Å²	124.7	82%	0.818	81%	0.812	S	S	*	*				-177.1	132.1	61.3	169.7	0	0	0	0	110.1
59	G	23.9	Very low	27.6	Very low	67 Å²	67	128.8 Å²	128.8	69%	0.691	82%	0.817	S	S	*	*			trans	81.7	134.7	141	0	0	0	0	0	119
60	V	27.2	Very low	27.1	Very low	136 Å²	136	129.1 Å²	129.1	82%	0.824	81%	0.813	S	S	*	*			cis	-156.4	131.9	22.6	162.4	0	0	0	0	109.1
61	V	26.1	Very low	26.8	Very low	131 Å²	131	128.4 Å²	128.4	79%	0.794	81%	0.807	S	S	*	*			trans	35.6	124	141.9	-171.5	0	0	0	0	122.1
62	S	22.6	Very low	26.6	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	81%	0.809	S	S	*	*			trans	-50.6	151.8	163.3	52	0	0	0	0	117.4
63	T	22.5	Very low	26.6	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	81%	0.805	S	S	*	*				172.2	148.7	82.8	34.8	0	0	0	0	105.6
64	V	26.6	Very low	26.6	Very low	135 Å²	135	144.6 Å²	144.6	82%	0.818	81%	0.805	S	S	*	*				-163.7	139.2	69	166.1	0	0	0	0	109.2
65	E	23.6	Very low	26.5	Very low	196 Å²	196	149.9 Å²	149.9	92%	0.916	81%	0.809	S	S	*	*			trans	-71.6	144	172.9	-68.3	173.5	145.9	0	0	112.5
66	G	23.9	Very low	26.7	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	80%	0.802	S	S	*	*			trans	-165.9	90.7	172.8	0	0	0	0	0	112.4
67	S	25	Very low	26.7	Very low	120 Å²	120	146.9 Å²	146.9	84%	0.839	80%	0.801	S	S	*	*			trans	49	107.9	154.7	60.1	0	0	0	0	119.5	D69	S67-D69 PolarHBondContact O-N 2.86Å
68	E	26.5	Very low	26.8	Very low	188 Å²	188	152.9 Å²	152.9	88%	0.879	81%	0.81	S	S	*	*			trans	-60	120.3	153	-61.8	-178.5	137.3	0	0	110.5
69	D	27.8	Very low	27.7	Very low	156 Å²	156	149.1 Å²	149.1	83%	0.834	79%	0.79	S	S	*	*				176.1	146.3	124.6	-96	-35.5	0	0	0	110	S67	S67-D69 PolarHBondContact O-N 2.86Å
70	E	28.6	Very low	29	Very low	176 Å²	176	148 Å²	148	82%	0.822	77%	0.77	S	S	*	*	S	Bend	trans	76.2	87.3	-175.9	-60.3	-156.8	143.4	0	0	118.4
71	K	24.7	Very low	30.6	Very low	186 Å²	186	143.5 Å²	143.5	81%	0.809	75%	0.745	S	S	*	*				170.3	79.9	122.6	-90	159.3	-170.5	169.9	0	110.7	K73	K71-K73 PolarHBondContact O-N 3.23Å
72	K	24.6	Very low	32.8	Very low	217 Å²	217	140.1 Å²	140.1	94%	0.943	73%	0.725	S	S	*	*			trans	-73.3	69.5	154.3	-85.9	-179.9	177.6	167.6	0	109.5	K74	K72-K74 PolarHBondContact O-N 2.88Å
73	K	26.5	Very low	35.6	Very low	185 Å²	185	139.5 Å²	139.5	80%	0.804	71%	0.714	S	S	*	*			trans	-77.8	112.6	157.3	-91	-173.4	176.8	-179.5	0	107.1	K71 K75	K71-K73 PolarHBondContact O-N 3.23Å; K73-K75 PolarHBondContact O-N 3.19Å
74	K	26.6	Very low	38.5	Very low	197 Å²	197	143.5 Å²	143.5	86%	0.857	72%	0.715	S	S	*	*			trans	-43.8	107.4	173.3	-78.5	173.7	172.3	173.8	0	110.2	K72 V76	K72-K74 PolarHBondContact O-N 2.88Å; K74-V76 PolarHBondContact O-N 3.01Å
75	K	25.8	Very low	41.2	Very low	207 Å²	207	141 Å²	141	90%	0.9	70%	0.697	S	S	*	*			trans	-61.1	105.9	152.6	-90.5	-179.4	174.3	175.4	0	105.8	K73 D77	K73-K75 PolarHBondContact O-N 3.19Å; K75-D77 PolarHBondContact O-N 2.81Å
76	V	32.3	Very low	44.2	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.685	66%	0.658	S	S	*	*			trans	-63.7	108	171	175.9	0	0	0	0	106	K74 R78	K74-V76 PolarHBondContact O-N 3.01Å; V76-R78 PolarHBondContact O-N 2.82Å
77	D	30.5	Very low	47.3	Very low	143 Å²	143	133.6 Å²	133.6	77%	0.765	65%	0.65	S	S	*	*			trans	-57.9	108.4	171.5	-111.7	-22.4	0	0	0	108.2	K75 S79	K75-D77 PolarHBondContact O-N 2.81Å; D77-S79 PolarHBondContact O-N 2.84Å
78	R	41.3	Very low	50.4	Low	235 Å²	235	133 Å²	133	89%	0.887	64%	0.636	S	S	*	*			trans	-71.8	42.6	176.6	-65	-178.7	178.3	178	0.5	111.6	V76	V76-R78 PolarHBondContact O-N 2.82Å
79	S	44.8	Very low	53.6	Low	57 Å²	57	127.3 Å²	127.3	40%	0.399	61%	0.607	S	S	.	*			trans	-80.9	126	170.3	66.7	0	0	0	0	108.3	D77 S81	D77-S79 PolarHBondContact O-N 2.84Å; S79-S81 PolarHBondContact O-N 2.81Å; S79-S81 PolarHBondContact O-OG 3.04Å; S79-S81 VanDerWaalsContact O-OG 3.13Å
80	P	52.4	Low	56.7	Low	43 Å²	43	121.3 Å²	121.3	28%	0.279	57%	0.574	S	S	.	*			trans	-67.2	87.4	175.1	27	-32.1	0	0	0	108.4	A285	P80-A285 HydrophobicContact CG-CB 4.46Å
81	S	60.7	Low	59.7	Low	42 Å²	42	115.5 Å²	115.5	29%	0.294	55%	0.553	S	S	.	*			trans	-112.5	156.2	174.5	40.5	0	0	0	0	108.6	S79 N83	S79-S81 PolarHBondContact O-N 2.81Å; S79-S81 PolarHBondContact O-OG 3.04Å; S79-S81 VanDerWaalsContact O-OG 3.13Å; S81-N83 PolarHBondContact O-N 2.83Å; S81-N83 PolarHBondContact OG-ND2 3.41Å; S81-N83 PolarHBondContact OG-OD1 3.08Å
82	V	71.2	Confident	62.8	Low	60 Å²	60	110.3 Å²	110.3	36%	0.364	53%	0.532	S	S	.	.	S	Bend	trans	-69.7	80.6	179.8	-173.9	0	0	0	0	108.8	F86 V424 A428	V82-F86 HydrophobicContact CG1-CD1 3.79Å; V82-F86 HydrophobicContact CG1-CE1 4.01Å; V82-V424 HydrophobicContact CG1-CG1 4.26Å; V82-V424 HydrophobicContact CG2-CG1 3.85Å; V82-A428 HydrophobicContact CG2-CB 4.38Å
83	N	81.4	Confident	66	Low	79 Å²	79	100 Å²	100	42%	0.422	49%	0.487	S	S	.	.			trans	-109	173.4	-177.4	-65.7	-22.5	0	0	0	110.9	S81 D85 F86 V87	S81-N83 PolarHBondContact O-N 2.83Å; S81-N83 PolarHBondContact OG-ND2 3.41Å; S81-N83 PolarHBondContact OG-OD1 3.08Å; N83-D85 PolarHBondContact O-N 3.44Å; N83-F86 WeakPolarHBondContact O-CB 3.38Å; N83-F86 PolarHBondContact O-N 3Å; N83-V87 PolarHBondContact O-N 3.48Å
84	R	84.6	Confident	69.1	Low	211 Å²	211	94.1 Å²	94.1	80%	0.796	46%	0.464	S	S	*	.	H	α-helix	trans	-54	-37	173	-172.1	177.4	178.9	178.9	-0.8	112.1	F86 V87 L88	R84-F86 VanDerWaalsContact C-N 3.33Å; R84-F86 PolarHBondContact O-N 3.42Å; R84-V87 PolarHBondContact O-N 3Å; R84-L88 HydrophobicContact CG-CD1 4.45Å; R84-L88 WeakPolarHBondContact O-CG 3.41Å; R84-L88 PolarHBondContact O-N 3.37Å; R84-L88 VanDerWaalsContact O-N 3.09Å
85	D	83.4	Confident	72.2	Confident	82 Å²	82	91.5 Å²	91.5	44%	0.439	45%	0.453	S	S	.	.	H	α-helix	trans	-64	-36.8	176.9	-63	-13.8	0	0	0	112.4	N83 V87 L88 R89	N83-D85 PolarHBondContact O-N 3.44Å; D85-V87 VanDerWaalsContact C-N 3.34Å; D85-V87 PolarHBondContact O-N 2.93Å; D85-L88 PolarHBondContact O-N 3.09Å; D85-R89 WeakPolarHBondContact O-CB 3.31Å; D85-R89 WeakPolarHBondContact O-CG 3.34Å; D85-R89 PolarHBondContact O-N 3.49Å
86	F	86.8	Confident	75.2	Confident	21 Å²	21	83.6 Å²	83.6	9%	0.092	42%	0.42	C	S	.	.	H	α-helix	trans	-60.3	-45.8	174.8	157.4	-105.3	0	0	0	110.9	V82 N83 R84 L88 R89 L90 V424 L427 A428 T431	V82-F86 HydrophobicContact CG1-CD1 3.79Å; V82-F86 HydrophobicContact CG1-CE1 4.01Å; N83-F86 WeakPolarHBondContact O-CB 3.38Å; N83-F86 PolarHBondContact O-N 3Å; R84-F86 VanDerWaalsContact C-N 3.33Å; R84-F86 PolarHBondContact O-N 3.42Å; F86-L88 VanDerWaalsContact C-N 3.33Å; F86-L88 PolarHBondContact O-N 2.93Å; F86-R89 PolarHBondContact O-N 3.4Å; F86-L90 HydrophobicContact CE1-CD2 4.31Å; F86-L90 HydrophobicContact CE2-CB 4.31Å; F86-L90 HydrophobicContact CE2-CD2 4.24Å; F86-L90 HydrophobicContact CZ-CD2 3.76Å; F86-L90 VanDerWaalsContact O-CB 3.26Å; F86-L90 WeakPolarHBondContact O-CB 3.31Å; F86-L90 PolarHBondContact O-N 2.83Å; F86-V424 HydrophobicContact CE1-CG1 4.41Å; F86-V424 HydrophobicContact CZ-CG1 4.49Å; F86-L427 HydrophobicContact CE2-CG 4.35Å; F86-L427 HydrophobicContact CZ-CD2 4.39Å; F86-L427 HydrophobicContact CZ-CG 4.47Å; F86-A428 VanDerWaalsContact CD2-CA 3.49Å; F86-A428 HydrophobicContact CD2-CB 3.55Å; F86-A428 VanDerWaalsContact CE2-CA 3.48Å; F86-A428 HydrophobicContact CE2-CB 3.79Å; F86-A428 HydrophobicContact CG-CB 4.03Å; F86-A428 HydrophobicContact CZ-CB 4.46Å; F86-T431 HydrophobicContact CD2-CG2 4.07Å; F86-T431 HydrophobicContact CE2-CG2 4.2Å
87	V	88.6	Confident	77.9	Confident	88 Å²	88	78.2 Å²	78.2	53%	0.533	39%	0.388	S	S	.	.	H	α-helix	trans	-64.2	-39.9	179.5	-179.2	0	0	0	0	111.2	N83 R84 D85 S91	N83-V87 PolarHBondContact O-N 3.48Å; R84-V87 PolarHBondContact O-N 3Å; D85-V87 VanDerWaalsContact C-N 3.34Å; D85-V87 PolarHBondContact O-N 2.93Å; V87-S91 VanDerWaalsContact O-CB 3.29Å; V87-S91 WeakPolarHBondContact O-CB 3.29Å; V87-S91 PolarHBondContact O-N 3.01Å
88	L	90.2	Very high	80.8	Confident	106 Å²	106	74 Å²	74	56%	0.555	36%	0.362	S	S	*	.	H	α-helix	trans	-63.6	-47.2	175.9	-71.1	170	0	0	0	111.8	R84 D85 F86 S91 H92	R84-L88 HydrophobicContact CG-CD1 4.45Å; R84-L88 WeakPolarHBondContact O-CG 3.41Å; R84-L88 PolarHBondContact O-N 3.37Å; R84-L88 VanDerWaalsContact O-N 3.09Å; D85-L88 PolarHBondContact O-N 3.09Å; F86-L88 VanDerWaalsContact C-N 3.33Å; F86-L88 PolarHBondContact O-N 2.93Å; L88-S91 PolarHBondContact O-N 3.03Å; L88-H92 PolarHBondContact O-N 2.87Å; L88-H92 VanDerWaalsContact O-N 3.1Å
89	R	92.3	Very high	82.6	Confident	69 Å²	69	66.6 Å²	66.6	26%	0.26	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-45.3	177.3	-68.5	174.8	-173.1	173.5	3	111.6	D85 F86 S91 H92 L93 T431 S432 W435	D85-R89 WeakPolarHBondContact O-CB 3.31Å; D85-R89 WeakPolarHBondContact O-CG 3.34Å; D85-R89 PolarHBondContact O-N 3.49Å; F86-R89 PolarHBondContact O-N 3.4Å; R89-S91 PolarHBondContact O-N 2.8Å; R89-H92 WeakPolarHBondContact O-CB 3.24Å; R89-H92 PolarHBondContact O-N 3.14Å; R89-L93 PolarHBondContact O-N 2.97Å; R89-T431 HydrophobicContact CB-CG2 3.85Å; R89-S432 PolarHBondContact NH1-OG 2.96Å; R89-W435 HydrophobicContact CB-CB 4.18Å; R89-W435 HydrophobicContact CB-CD2 4.38Å; R89-W435 HydrophobicContact CB-CG 3.89Å; R89-W435 HydrophobicContact CG-CB 4.3Å; R89-W435 HydrophobicContact CG-CD2 3.65Å; R89-W435 HydrophobicContact CG-CE3 4.15Å; R89-W435 HydrophobicContact CG-CG 3.7Å
90	L	92.8	Very high	84.6	Confident	30 Å²	30	73.4 Å²	73.4	16%	0.157	36%	0.362	C	S	.	.	H	α-helix	trans	-62.1	-43	177	-178.1	63	0	0	0	111.1	F86 H92 L93 L94 F219 T431	F86-L90 HydrophobicContact CE1-CD2 4.31Å; F86-L90 HydrophobicContact CE2-CB 4.31Å; F86-L90 HydrophobicContact CE2-CD2 4.24Å; F86-L90 HydrophobicContact CZ-CD2 3.76Å; F86-L90 VanDerWaalsContact O-CB 3.26Å; F86-L90 WeakPolarHBondContact O-CB 3.31Å; F86-L90 PolarHBondContact O-N 2.83Å; L90-H92 VanDerWaalsContact C-N 3.27Å; L90-H92 PolarHBondContact O-N 3.31Å; L90-L93 PolarHBondContact O-N 3.41Å; L90-L94 HydrophobicContact CD1-CD1 4.37Å; L90-L94 HydrophobicContact CD1-CG 4.22Å; L90-L94 HydrophobicContact CD2-CD1 4.43Å; L90-L94 HydrophobicContact CG-CD1 3.88Å; L90-L94 HydrophobicContact CG-CG 4.2Å; L90-L94 WeakPolarHBondContact O-CB 3.42Å; L90-L94 VanDerWaalsContact O-CG 3.27Å; L90-L94 WeakPolarHBondContact O-CG 3.43Å; L90-L94 PolarHBondContact O-N 3.01Å; L90-F219 HydrophobicContact CD1-CE2 3.97Å; L90-F219 HydrophobicContact CD1-CZ 4.08Å; L90-T431 HydrophobicContact CB-CG2 4.05Å
91	S	91.5	Very high	85.7	Confident	54 Å²	54	78.4 Å²	78.4	38%	0.378	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-39.1	176.3	-179.2	0	0	0	0	111.9	V87 L88 R89 L94 K95	V87-S91 VanDerWaalsContact O-CB 3.29Å; V87-S91 WeakPolarHBondContact O-CB 3.29Å; V87-S91 PolarHBondContact O-N 3.01Å; L88-S91 PolarHBondContact O-N 3.03Å; R89-S91 PolarHBondContact O-N 2.8Å; S91-L94 PolarHBondContact O-N 3.28Å; S91-K95 WeakPolarHBondContact O-CG 3.33Å; S91-K95 PolarHBondContact O-N 3.11Å; S91-K95 VanDerWaalsContact O-N 3.07Å
92	H	90.4	Very high	86.6	Confident	78 Å²	78	84.5 Å²	84.5	36%	0.361	41%	0.414	S	S	.	.	H	α-helix	trans	-63.9	-48	175	-165.1	-101.4	0	0	0	112	L88 R89 L90 L94 K95 L96	L88-H92 PolarHBondContact O-N 2.87Å; L88-H92 VanDerWaalsContact O-N 3.1Å; R89-H92 WeakPolarHBondContact O-CB 3.24Å; R89-H92 PolarHBondContact O-N 3.14Å; L90-H92 VanDerWaalsContact C-N 3.27Å; L90-H92 PolarHBondContact O-N 3.31Å; H92-L94 VanDerWaalsContact C-N 3.32Å; H92-L94 PolarHBondContact O-N 2.89Å; H92-K95 WeakPolarHBondContact O-CB 3.23Å; H92-K95 PolarHBondContact O-N 3.04Å; H92-L96 PolarHBondContact O-N 2.86Å
93	L	93	Very high	87.3	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-65	-35.4	177.4	-63.1	-177.9	0	0	0	112.2	R89 L90 K95 L96 L97 F219 T431 V434 W435 F438	R89-L93 PolarHBondContact O-N 2.97Å; L90-L93 PolarHBondContact O-N 3.41Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.36Å; L93-L96 HydrophobicContact CD2-CD1 4.21Å; L93-L96 WeakPolarHBondContact O-CB 3.41Å; L93-L96 PolarHBondContact O-N 2.93Å; L93-L96 VanDerWaalsContact O-N 3.15Å; L93-L97 WeakPolarHBondContact O-CG 3.41Å; L93-L97 PolarHBondContact O-N 3.1Å; L93-F219 HydrophobicContact CB-CE1 4.22Å; L93-F219 HydrophobicContact CB-CZ 3.76Å; L93-F219 HydrophobicContact CD1-CD2 4.39Å; L93-F219 HydrophobicContact CD1-CE1 4.14Å; L93-F219 HydrophobicContact CD1-CE2 3.73Å; L93-F219 HydrophobicContact CD1-CZ 3.59Å; L93-F219 HydrophobicContact CG-CZ 4.33Å; L93-T431 HydrophobicContact CD1-CG2 4.01Å; L93-V434 HydrophobicContact CD1-CB 4.18Å; L93-V434 HydrophobicContact CD1-CG1 3.97Å; L93-V434 HydrophobicContact CD2-CG1 4.08Å; L93-W435 HydrophobicContact CD1-CB 4.4Å; L93-F438 HydrophobicContact CD2-CD2 3.77Å; L93-F438 HydrophobicContact CD2-CE2 4.04Å
94	L	91.6	Very high	87.6	Confident	62 Å²	62	83.6 Å²	83.6	33%	0.325	41%	0.414	S	S	.	.	H	α-helix	trans	-65.3	-33.2	174.6	-74.6	171.1	0	0	0	112.2	L90 S91 H92 L96 L97 F98 V223	L90-L94 HydrophobicContact CD1-CD1 4.37Å; L90-L94 HydrophobicContact CD1-CG 4.22Å; L90-L94 HydrophobicContact CD2-CD1 4.43Å; L90-L94 HydrophobicContact CG-CD1 3.88Å; L90-L94 HydrophobicContact CG-CG 4.2Å; L90-L94 WeakPolarHBondContact O-CB 3.42Å; L90-L94 VanDerWaalsContact O-CG 3.27Å; L90-L94 WeakPolarHBondContact O-CG 3.43Å; L90-L94 PolarHBondContact O-N 3.01Å; S91-L94 PolarHBondContact O-N 3.28Å; H92-L94 VanDerWaalsContact C-N 3.32Å; H92-L94 PolarHBondContact O-N 2.89Å; L94-L96 VanDerWaalsContact C-N 3.29Å; L94-L96 PolarHBondContact O-N 3.5Å; L94-L97 HydrophobicContact CD2-CD1 4.16Å; L94-L97 PolarHBondContact O-N 3.41Å; L94-F98 HydrophobicContact CD2-CE2 4.36Å; L94-F98 PolarHBondContact O-N 2.96Å; L94-V223 HydrophobicContact CD2-CG1 4.46Å
95	K	90.5	Very high	87.8	Confident	141 Å²	141	74.1 Å²	74.1	61%	0.613	38%	0.379	S	S	*	.	H	α-helix	trans	-65.5	-32.7	172.5	-72.5	173.1	-178.9	-177.6	0	112.3	S91 H92 L93 F98 P99	S91-K95 WeakPolarHBondContact O-CG 3.33Å; S91-K95 PolarHBondContact O-N 3.11Å; S91-K95 VanDerWaalsContact O-N 3.07Å; H92-K95 WeakPolarHBondContact O-CB 3.23Å; H92-K95 PolarHBondContact O-N 3.04Å; L93-K95 VanDerWaalsContact C-N 3.31Å; L93-K95 PolarHBondContact O-N 3.36Å; K95-F98 CarbonylContact O-C 3.56Å; K95-F98 VanDerWaalsContact O-C 3.3Å; K95-P99 WeakPolarHBondContact O-CA 3.49Å
96	L	89.4	Confident	88.2	Confident	42 Å²	42	75 Å²	75	22%	0.22	38%	0.378	C	S	.	.	H	α-helix	trans	-70.6	-36.5	172.2	-63.9	173.5	0	0	0	111.5	H92 L93 L94 R180 L181 F438	H92-L96 PolarHBondContact O-N 2.86Å; L93-L96 HydrophobicContact CD2-CD1 4.21Å; L93-L96 WeakPolarHBondContact O-CB 3.41Å; L93-L96 PolarHBondContact O-N 2.93Å; L93-L96 VanDerWaalsContact O-N 3.15Å; L94-L96 VanDerWaalsContact C-N 3.29Å; L94-L96 PolarHBondContact O-N 3.5Å; L96-R180 WeakPolarHBondContact O-CD 3.37Å; L96-L181 HydrophobicContact CB-CD2 4.25Å; L96-F438 HydrophobicContact CD1-CD2 4.47Å; L96-F438 HydrophobicContact CD1-CE2 4.38Å
97	L	89.5	Confident	88.4	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-69.3	-37.2	175.4	-68.5	177.6	0	0	0	112.6	L93 L94 P99 F177 R180 L181 F219 V223	L93-L97 WeakPolarHBondContact O-CG 3.41Å; L93-L97 PolarHBondContact O-N 3.1Å; L94-L97 HydrophobicContact CD2-CD1 4.16Å; L94-L97 PolarHBondContact O-N 3.41Å; L97-P99 WeakPolarHBondContact O-CD 3.43Å; L97-F177 HydrophobicContact CB-CD1 4.42Å; L97-F177 HydrophobicContact CD1-CD1 4.44Å; L97-F177 HydrophobicContact CD1-CD2 4.31Å; L97-F177 HydrophobicContact CD1-CG 4.23Å; L97-F177 HydrophobicContact CD2-CB 3.65Å; L97-F177 HydrophobicContact CD2-CD1 3.87Å; L97-F177 HydrophobicContact CD2-CG 3.83Å; L97-F177 HydrophobicContact CG-CD1 4.48Å; L97-R180 PolarHBondContact O-NH1 2.99Å; L97-L181 HydrophobicContact CD2-CD1 3.8Å; L97-L181 HydrophobicContact CD2-CD2 4.05Å; L97-L181 HydrophobicContact CD2-CG 3.66Å; L97-L181 HydrophobicContact CG-CD2 4.48Å; L97-F219 HydrophobicContact CD1-CE1 4.15Å; L97-V223 HydrophobicContact CD1-CG1 4.48Å
98	F	89.7	Confident	88.6	Confident	54 Å²	54	73.5 Å²	73.5	24%	0.237	38%	0.378	C	S	.	.			trans	-124.4	79.1	-178.8	-59.8	-79.5	0	0	0	111.3	L94 K95 R100 E105 L109 F177	L94-F98 HydrophobicContact CD2-CE2 4.36Å; L94-F98 PolarHBondContact O-N 2.96Å; K95-F98 CarbonylContact O-C 3.56Å; K95-F98 VanDerWaalsContact O-C 3.3Å; F98-R100 VanDerWaalsContact C-N 3.35Å; F98-R100 PolarHBondContact O-N 3.43Å; F98-E105 HydrophobicContact CD1-CB 4.22Å; F98-E105 HydrophobicContact CE1-CB 3.89Å; F98-L109 HydrophobicContact CE1-CD2 4.21Å; F98-L109 HydrophobicContact CZ-CD2 3.92Å; F98-F177 HydrophobicContact CE1-CE1 4.13Å; F98-F177 HydrophobicContact CE1-CZ 4.47Å; F98-F177 HydrophobicContact CE2-CE1 4.1Å; F98-F177 HydrophobicContact CE2-CZ 4.02Å; F98-F177 AromaticContact CZ-CE1 3.58Å; F98-F177 HydrophobicContact CZ-CE1 3.58Å; F98-F177 AromaticContact CZ-CZ 3.56Å; F98-F177 HydrophobicContact CZ-CZ 3.56Å
99	P	80.9	Confident	88.7	Confident	80 Å²	80	69.8 Å²	69.8	52%	0.519	36%	0.359	S	S	.	.	S	Bend	trans	-71.2	-28.9	-175.7	26.6	-33.6	0	0	0	113.2	K95 L97	K95-P99 WeakPolarHBondContact O-CA 3.49Å; L97-P99 WeakPolarHBondContact O-CD 3.43Å
100	R	85.4	Confident	88.7	Confident	200 Å²	200	68.4 Å²	68.4	76%	0.755	36%	0.362	S	S	*	.	S	Bend	trans	-137.4	159.4	177.2	-60.4	-178.4	178.4	173.7	-0.7	110	F98 L102 C103	F98-R100 VanDerWaalsContact C-N 3.35Å; F98-R100 PolarHBondContact O-N 3.43Å; R100-L102 VanDerWaalsContact C-N 3.26Å; R100-L102 PolarHBondContact O-N 3.48Å; R100-C103 PolarHBondContact O-SG 3.43Å
101	L	75.3	Confident	88.8	Confident	147 Å²	147	71.2 Å²	71.2	77%	0.77	38%	0.377	S	S	*	.	S	Bend	trans	-68	-25.8	177.2	-65.4	173	0	0	0	112.8	F106	L101-F106 WeakPolarHBondContact O-CD1 3.41Å; L101-F106 WeakPolarHBondContact O-CG 3.41Å
102	L	79.9	Confident	88.9	Confident	171 Å²	171	68.7 Å²	68.7	90%	0.895	36%	0.359	S	S	*	.	S	Bend	trans	-107.5	72.9	177.5	-72.1	163.9	0	0	0	110.2	R100	R100-L102 VanDerWaalsContact C-N 3.26Å; R100-L102 PolarHBondContact O-N 3.48Å
103	C	87.3	Confident	89.1	Confident	19 Å²	19	66.4 Å²	66.4	13%	0.128	35%	0.352	C	S	.	.			trans	-117.8	152.4	174.9	-72.2	0	0	0	0	110.6	R100 E105 F106 G107	R100-C103 PolarHBondContact O-SG 3.43Å; C103-E105 WeakPolarHBondContact CB-OE2 3.38Å; C103-E105 PolarHBondContact O-N 3.09Å; C103-F106 WeakPolarHBondContact O-CB 3.38Å; C103-F106 PolarHBondContact O-N 2.7Å; C103-G107 PolarHBondContact O-N 2.63Å
104	P	86.5	Confident	89.1	Confident	101 Å²	101	71.2 Å²	71.2	66%	0.656	38%	0.376	S	S	*	.	H	α-helix	trans	-57.6	-31.3	177.9	20.3	-29.1	0	0	0	112.5	G107 L108	P104-G107 PolarHBondContact O-N 3.2Å; P104-L108 PolarHBondContact O-N 3.08Å
105	E	89.8	Confident	89.2	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.056	37%	0.366	C	S	.	.	H	α-helix	trans	-65.7	-38.7	175.8	-66.3	69.8	-162	0	0	112.1	F98 C103 G107 L108 L109 S176 F177 R180	F98-E105 HydrophobicContact CD1-CB 4.22Å; F98-E105 HydrophobicContact CE1-CB 3.89Å; C103-E105 WeakPolarHBondContact CB-OE2 3.38Å; C103-E105 PolarHBondContact O-N 3.09Å; E105-G107 VanDerWaalsContact C-N 3.34Å; E105-L108 PolarHBondContact O-N 2.95Å; E105-L109 VanDerWaalsContact O-CB 3.32Å; E105-L109 WeakPolarHBondContact O-CB 3.31Å; E105-L109 PolarHBondContact O-N 3.29Å; E105-S176 WeakPolarHBondContact CG-OG 3.44Å; E105-S176 PolarHBondContact OE1-OG 3.08Å; E105-F177 HydrophobicContact CB-CE1 4.32Å; E105-F177 HydrophobicContact CG-CD1 4.43Å; E105-F177 HydrophobicContact CG-CE1 4.43Å; E105-R180 IonicContact OE1-CZ 3.87Å; E105-R180 IonicContact OE1-NH1 3.62Å; E105-R180 PolarHBondContact OE1-NH1 2.75Å; E105-R180 IonicContact OE1-NH2 3.86Å; E105-R180 PolarHBondContact OE1-NH2 3.06Å; E105-R180 IonicContact OE2-CZ 3.99Å; E105-R180 IonicContact OE2-NH1 3Å; E105-R180 PolarHBondContact OE2-NH1 3.43Å; E105-R180 IonicContact OE2-NH2 2.7Å; E105-R180 PolarHBondContact OE2-NH2 3.2Å
106	F	90.6	Very high	89.3	Confident	99 Å²	99	62.4 Å²	62.4	43%	0.434	34%	0.337	S	S	.	.	H	α-helix	trans	-67.7	-39.6	176.2	-172.2	-93.8	0	0	0	110.4	L101 C103 L109 A110	L101-F106 WeakPolarHBondContact O-CD1 3.41Å; L101-F106 WeakPolarHBondContact O-CG 3.41Å; C103-F106 WeakPolarHBondContact O-CB 3.38Å; C103-F106 PolarHBondContact O-N 2.7Å; F106-L109 PolarHBondContact O-N 2.86Å; F106-A110 WeakPolarHBondContact O-CB 3.17Å; F106-A110 PolarHBondContact O-N 3.46Å
107	G	91.2	Very high	89.4	Confident	42 Å²	42	64.7 Å²	64.7	43%	0.433	35%	0.348	S	S	.	.	H	α-helix	trans	-59.8	-44.5	172.3	0	0	0	0	0	112.5	C103 P104 E105 A110 L111	C103-G107 PolarHBondContact O-N 2.63Å; P104-G107 PolarHBondContact O-N 3.2Å; E105-G107 VanDerWaalsContact C-N 3.34Å; G107-A110 PolarHBondContact O-N 3.29Å; G107-L111 WeakPolarHBondContact O-CB 3.41Å; G107-L111 PolarHBondContact O-N 3.49Å
108	L	92.1	Very high	89.5	Confident	37 Å²	37	67.1 Å²	67.1	19%	0.194	37%	0.365	C	S	.	.	H	α-helix	trans	-65.6	-41.3	176.8	-167.7	72.4	0	0	0	112.1	P104 E105 L111 H112 L169 Q172 L173	P104-L108 PolarHBondContact O-N 3.08Å; E105-L108 PolarHBondContact O-N 2.95Å; L108-L111 PolarHBondContact O-N 3.44Å; L108-H112 WeakPolarHBondContact O-CB 3.13Å; L108-H112 PolarHBondContact O-N 3.11Å; L108-L169 HydrophobicContact CD1-CD2 3.75Å; L108-Q172 HydrophobicContact CD1-CB 4.25Å; L108-Q172 HydrophobicContact CD2-CB 3.8Å; L108-L173 HydrophobicContact CD2-CB 4Å; L108-L173 HydrophobicContact CD2-CD1 3.99Å; L108-L173 HydrophobicContact CG-CD1 4.44Å
109	L	92.9	Very high	89.5	Confident	28 Å²	28	67.1 Å²	67.1	15%	0.147	36%	0.363	C	S	.	.	H	α-helix	trans	-63.6	-41.5	175.1	-172.4	71.9	0	0	0	111.7	F98 E105 F106 H112 S113 L173 Y227	F98-L109 HydrophobicContact CE1-CD2 4.21Å; F98-L109 HydrophobicContact CZ-CD2 3.92Å; E105-L109 VanDerWaalsContact O-CB 3.32Å; E105-L109 WeakPolarHBondContact O-CB 3.31Å; E105-L109 PolarHBondContact O-N 3.29Å; F106-L109 PolarHBondContact O-N 2.86Å; L109-H112 PolarHBondContact O-N 3.39Å; L109-S113 WeakPolarHBondContact O-CB 3.12Å; L109-S113 PolarHBondContact O-N 2.76Å; L109-S113 PolarHBondContact O-OG 3.5Å; L109-L173 HydrophobicContact CD1-CD2 3.91Å; L109-Y227 HydrophobicContact CD1-CD1 3.73Å; L109-Y227 HydrophobicContact CD1-CD2 4.16Å; L109-Y227 HydrophobicContact CD1-CE1 3.49Å; L109-Y227 VanDerWaalsContact CD1-CE1 3.49Å; L109-Y227 HydrophobicContact CD1-CE2 3.94Å; L109-Y227 HydrophobicContact CD1-CG 4.06Å; L109-Y227 HydrophobicContact CG-CE1 4.35Å
110	A	92.8	Very high	89.9	Confident	39 Å²	39	63.4 Å²	63.4	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-63.9	-46	176.3	0	0	0	0	0	111.3	F106 G107 H112 S113 I114	F106-A110 WeakPolarHBondContact O-CB 3.17Å; F106-A110 PolarHBondContact O-N 3.46Å; G107-A110 PolarHBondContact O-N 3.29Å; A110-H112 VanDerWaalsContact C-N 3.31Å; A110-H112 PolarHBondContact O-N 3.04Å; A110-S113 WeakPolarHBondContact O-CB 3.38Å; A110-S113 PolarHBondContact O-N 3.32Å; A110-I114 WeakPolarHBondContact O-CG1 3.5Å; A110-I114 PolarHBondContact O-N 3.15Å
111	L	94.5	Very high	90.1	Very high	89 Å²	89	59.6 Å²	59.6	47%	0.466	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-41.7	174.7	-179.4	61	0	0	0	111.9	G107 L108 I114 T115 L169	G107-L111 WeakPolarHBondContact O-CB 3.41Å; G107-L111 PolarHBondContact O-N 3.49Å; L108-L111 PolarHBondContact O-N 3.44Å; L111-I114 PolarHBondContact O-N 3.22Å; L111-T115 WeakPolarHBondContact O-CB 3.46Å; L111-T115 PolarHBondContact O-N 2.97Å; L111-T115 PolarHBondContact O-OG1 3.1Å; L111-L169 HydrophobicContact CD2-CD1 4.47Å; L111-L169 HydrophobicContact CD2-CD2 3.75Å; L111-L169 HydrophobicContact CG-CD1 4.06Å; L111-L169 HydrophobicContact CG-CD2 4.16Å
112	H	93.9	Very high	90.8	Very high	1 Å²	1	54 Å²	54	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-46	174.6	-168.8	72.9	0	0	0	111.4	L108 L109 A110 I114 T115 L116 I166 L169 Y227 S228	L108-H112 WeakPolarHBondContact O-CB 3.13Å; L108-H112 PolarHBondContact O-N 3.11Å; L109-H112 PolarHBondContact O-N 3.39Å; A110-H112 VanDerWaalsContact C-N 3.31Å; A110-H112 PolarHBondContact O-N 3.04Å; H112-I114 PolarHBondContact O-N 3.09Å; H112-T115 WeakPolarHBondContact O-CB 3.33Å; H112-T115 PolarHBondContact O-N 3.43Å; H112-T115 VanDerWaalsContact O-N 3.15Å; H112-L116 WeakPolarHBondContact O-CG 3.43Å; H112-L116 PolarHBondContact O-N 3Å; H112-I166 PolarHBondContact CE1-O 3.18Å; H112-I166 VanDerWaalsContact CE1-O 3.29Å; H112-L169 HydrophobicContact CB-CB 4.25Å; H112-L169 HydrophobicContact CB-CD1 4.38Å; H112-L169 VanDerWaalsContact ND1-CB 3.29Å; H112-L169 WeakPolarHBondContact ND1-CB 3.18Å; H112-Y227 AromaticContact CD2-CD1 3.75Å; H112-Y227 AromaticContact CD2-CE1 3.78Å; H112-S228 WeakPolarHBondContact NE2-CB 3.46Å
113	S	93.9	Very high	91	Very high	30 Å²	30	48 Å²	48	21%	0.21	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-46.4	176.5	-54	0	0	0	0	112.4	L109 A110 T115 L116 M117 Y227	L109-S113 WeakPolarHBondContact O-CB 3.12Å; L109-S113 PolarHBondContact O-N 2.76Å; L109-S113 PolarHBondContact O-OG 3.5Å; A110-S113 WeakPolarHBondContact O-CB 3.38Å; A110-S113 PolarHBondContact O-N 3.32Å; S113-T115 VanDerWaalsContact C-N 3.3Å; S113-T115 PolarHBondContact O-N 2.76Å; S113-L116 WeakPolarHBondContact O-CB 3.38Å; S113-L116 PolarHBondContact O-N 2.97Å; S113-M117 WeakPolarHBondContact O-CG 3.4Å; S113-M117 PolarHBondContact O-N 2.92Å; S113-Y227 PolarHBondContact OG-OH 3.01Å
114	I	94.2	Very high	91	Very high	101 Å²	101	48.7 Å²	48.7	52%	0.518	27%	0.273	S	S	.	.	H	α-helix	trans	-62.1	-40.6	177.8	-68.6	165	0	0	0	110.7	A110 L111 H112 M117 S118	A110-I114 WeakPolarHBondContact O-CG1 3.5Å; A110-I114 PolarHBondContact O-N 3.15Å; L111-I114 PolarHBondContact O-N 3.22Å; H112-I114 PolarHBondContact O-N 3.09Å; I114-M117 PolarHBondContact O-N 2.78Å; I114-S118 WeakPolarHBondContact O-CB 3.41Å; I114-S118 PolarHBondContact O-N 3.37Å; I114-S118 PolarHBondContact O-OG 3.43Å
115	T	93.6	Very high	91.1	Very high	18 Å²	18	49.1 Å²	49.1	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-40.7	177.8	-52.9	0	0	0	0	111.5	L111 H112 S113 S118 R119 I162 A165 I166 L169	L111-T115 WeakPolarHBondContact O-CB 3.46Å; L111-T115 PolarHBondContact O-N 2.97Å; L111-T115 PolarHBondContact O-OG1 3.1Å; H112-T115 WeakPolarHBondContact O-CB 3.33Å; H112-T115 PolarHBondContact O-N 3.43Å; H112-T115 VanDerWaalsContact O-N 3.15Å; S113-T115 VanDerWaalsContact C-N 3.3Å; S113-T115 PolarHBondContact O-N 2.76Å; T115-S118 PolarHBondContact O-N 3.36Å; T115-R119 PolarHBondContact O-N 2.8Å; T115-I162 HydrophobicContact CG2-CG2 3.91Å; T115-A165 HydrophobicContact CG2-CB 4.05Å; T115-I166 HydrophobicContact CG2-CG1 3.7Å; T115-L169 HydrophobicContact CG2-CD1 4.44Å; T115-L169 WeakPolarHBondContact OG1-CD1 3.46Å
116	L	91.3	Very high	91.1	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-46.4	173.4	-67.8	-178.1	0	0	0	111.4	H112 S113 S118 R119 T120 I166 Y227 T231 K232	H112-L116 WeakPolarHBondContact O-CG 3.43Å; H112-L116 PolarHBondContact O-N 3Å; S113-L116 WeakPolarHBondContact O-CB 3.38Å; S113-L116 PolarHBondContact O-N 2.97Å; L116-S118 PolarHBondContact O-N 2.84Å; L116-R119 WeakPolarHBondContact O-CB 3.35Å; L116-R119 PolarHBondContact O-N 2.85Å; L116-T120 PolarHBondContact O-N 2.85Å; L116-T120 VanDerWaalsContact O-N 3.13Å; L116-T120 PolarHBondContact O-OG1 2.87Å; L116-I166 HydrophobicContact CD2-CD1 3.76Å; L116-I166 HydrophobicContact CD2-CG1 3.9Å; L116-I166 HydrophobicContact CD2-CG2 3.81Å; L116-Y227 HydrophobicContact CD1-CE1 4.37Å; L116-T231 HydrophobicContact CD1-CG2 4.19Å; L116-K232 HydrophobicContact CD2-CB 4.02Å; L116-K232 HydrophobicContact CD2-CD 4.33Å
117	M	91.2	Very high	90.8	Very high	90 Å²	90	46.1 Å²	46.1	44%	0.443	25%	0.254	S	S	.	.	H	α-helix	trans	-59.9	-46.5	176.4	-70.4	-179.9	71.6	0	0	111.8	S113 I114 R119 T120 F121 L235	S113-M117 WeakPolarHBondContact O-CG 3.4Å; S113-M117 PolarHBondContact O-N 2.92Å; I114-M117 PolarHBondContact O-N 2.78Å; M117-R119 PolarHBondContact O-N 3.49Å; M117-T120 PolarHBondContact O-N 3.03Å; M117-T120 VanDerWaalsContact O-N 3.14Å; M117-F121 HydrophobicContact CE-CE2 4.46Å; M117-F121 WeakPolarHBondContact O-CD2 3.34Å; M117-F121 PolarHBondContact O-N 2.99Å; M117-F121 VanDerWaalsContact O-N 3.14Å; M117-L235 HydrophobicContact CB-CD2 4.14Å; M117-L235 HydrophobicContact CG-CD2 3.72Å
118	S	92.4	Very high	90.5	Very high	51 Å²	51	46 Å²	46	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-59.1	-38.1	178.4	-57.7	0	0	0	0	111.5	I114 T115 L116 L122	I114-S118 WeakPolarHBondContact O-CB 3.41Å; I114-S118 PolarHBondContact O-N 3.37Å; I114-S118 PolarHBondContact O-OG 3.43Å; T115-S118 PolarHBondContact O-N 3.36Å; L116-S118 PolarHBondContact O-N 2.84Å; S118-L122 WeakPolarHBondContact O-CB 3.43Å; S118-L122 PolarHBondContact O-N 2.92Å; S118-L122 VanDerWaalsContact O-N 3.1Å
119	R	90.1	Very high	90.3	Very high	53 Å²	53	44.2 Å²	44.2	20%	0.2	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-44.4	175.3	-176.4	59.4	-170.7	-160.1	-0.4	112.6	T115 L116 M117 L122 S123 A159 I162 I166	T115-R119 PolarHBondContact O-N 2.8Å; L116-R119 WeakPolarHBondContact O-CB 3.35Å; L116-R119 PolarHBondContact O-N 2.85Å; M117-R119 PolarHBondContact O-N 3.49Å; R119-L122 PolarHBondContact O-N 2.86Å; R119-S123 PolarHBondContact O-N 3.39Å; R119-S123 PolarHBondContact O-OG 3.49Å; R119-A159 PolarHBondContact NH1-O 3.39Å; R119-I162 HydrophobicContact CB-CG2 3.64Å; R119-I162 HydrophobicContact CG-CG2 4.28Å; R119-I166 HydrophobicContact CB-CD1 3.9Å; R119-I166 HydrophobicContact CG-CD1 4.02Å
120	T	89.3	Confident	90.1	Very high	2 Å²	2	45 Å²	45	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-45.3	179.9	-63.3	0	0	0	0	111.5	L116 M117 L122 S123 I124 L235 D236 V239	L116-T120 PolarHBondContact O-N 2.85Å; L116-T120 VanDerWaalsContact O-N 3.13Å; L116-T120 PolarHBondContact O-OG1 2.87Å; M117-T120 PolarHBondContact O-N 3.03Å; M117-T120 VanDerWaalsContact O-N 3.14Å; T120-L122 VanDerWaalsContact C-N 3.33Å; T120-L122 PolarHBondContact O-N 3.33Å; T120-S123 PolarHBondContact O-N 3.16Å; T120-I124 HydrophobicContact CG2-CD1 4.34Å; T120-I124 PolarHBondContact O-N 2.84Å; T120-L235 HydrophobicContact CG2-CD2 4.23Å; T120-L235 HydrophobicContact CG2-CG 4.07Å; T120-D236 VanDerWaalsContact CB-OD1 3.27Å; T120-D236 WeakPolarHBondContact CB-OD1 3.23Å; T120-D236 WeakPolarHBondContact CG2-OD1 3.24Å; T120-D236 PolarHBondContact OG1-OD1 2.76Å; T120-V239 HydrophobicContact CG2-CB 4.21Å; T120-V239 HydrophobicContact CG2-CG2 4.18Å
121	F	89.3	Confident	89.7	Confident	121 Å²	121	43.2 Å²	43.2	53%	0.531	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-42	175.8	-72.8	-65.8	0	0	0	112.4	M117 S123 I124 Y125	M117-F121 HydrophobicContact CE-CE2 4.46Å; M117-F121 WeakPolarHBondContact O-CD2 3.34Å; M117-F121 PolarHBondContact O-N 2.99Å; M117-F121 VanDerWaalsContact O-N 3.14Å; F121-S123 VanDerWaalsContact C-N 3.33Å; F121-S123 PolarHBondContact O-N 2.87Å; F121-I124 PolarHBondContact O-N 2.84Å; F121-Y125 PolarHBondContact O-N 3.1Å
122	L	89.3	Confident	89.3	Confident	28 Å²	28	41.5 Å²	41.5	15%	0.147	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-38.3	177.9	-163.8	65	0	0	0	112.2	S118 R119 T120 I124 Y125 V126 V155 A159 I162	S118-L122 WeakPolarHBondContact O-CB 3.43Å; S118-L122 PolarHBondContact O-N 2.92Å; S118-L122 VanDerWaalsContact O-N 3.1Å; R119-L122 PolarHBondContact O-N 2.86Å; T120-L122 VanDerWaalsContact C-N 3.33Å; T120-L122 PolarHBondContact O-N 3.33Å; L122-I124 VanDerWaalsContact C-N 3.32Å; L122-I124 PolarHBondContact O-N 2.69Å; L122-Y125 HydrophobicContact CD1-CD1 4.45Å; L122-Y125 PolarHBondContact O-N 3.06Å; L122-V126 VanDerWaalsContact O-CG2 3.29Å; L122-V126 WeakPolarHBondContact O-CG2 3.14Å; L122-V126 PolarHBondContact O-N 2.91Å; L122-V155 HydrophobicContact CD1-CG1 3.75Å; L122-V155 HydrophobicContact CG-CG1 4.33Å; L122-A159 HydrophobicContact CD2-CB 3.41Å; L122-A159 VanDerWaalsContact CD2-CB 3.41Å; L122-A159 HydrophobicContact CG-CB 4.31Å; L122-I162 HydrophobicContact CD2-CD1 4.01Å
123	S	85.6	Confident	89.1	Confident	47 Å²	47	42.3 Å²	42.3	33%	0.329	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-39.3	175	-81.1	0	0	0	0	112.6	R119 T120 F121 A127	R119-S123 PolarHBondContact O-N 3.39Å; R119-S123 PolarHBondContact O-OG 3.49Å; T120-S123 PolarHBondContact O-N 3.16Å; F121-S123 VanDerWaalsContact C-N 3.33Å; F121-S123 PolarHBondContact O-N 2.87Å; S123-A127 PolarHBondContact O-N 2.86Å
124	I	86.3	Confident	88.9	Confident	33 Å²	33	43 Å²	43	17%	0.169	22%	0.224	C	C	.	.	H	α-helix	trans	-68.4	-42.3	175.5	-64.5	160.2	0	0	0	110.8	T120 F121 L122 V126 A127 S128 V239 L406	T120-I124 HydrophobicContact CG2-CD1 4.34Å; T120-I124 PolarHBondContact O-N 2.84Å; F121-I124 PolarHBondContact O-N 2.84Å; L122-I124 VanDerWaalsContact C-N 3.32Å; L122-I124 PolarHBondContact O-N 2.69Å; I124-V126 PolarHBondContact O-N 3.04Å; I124-A127 PolarHBondContact O-N 3.49Å; I124-S128 PolarHBondContact O-N 3.3Å; I124-V239 HydrophobicContact CD1-CB 4.08Å; I124-V239 HydrophobicContact CD1-CG1 3.19Å; I124-L406 HydrophobicContact CG1-CD2 4.37Å
125	Y	88.9	Confident	88.4	Confident	109 Å²	109	41.2 Å²	41.2	43%	0.427	21%	0.211	S	C	.	.	H	α-helix	trans	-61.1	-44.4	177.3	-176.7	-115.4	0	0	0	111.7	F121 L122 A127 S128 L129 V155	F121-Y125 PolarHBondContact O-N 3.1Å; L122-Y125 HydrophobicContact CD1-CD1 4.45Å; L122-Y125 PolarHBondContact O-N 3.06Å; Y125-A127 PolarHBondContact O-N 3.04Å; Y125-S128 PolarHBondContact O-N 3.37Å; Y125-S128 VanDerWaalsContact O-N 3.16Å; Y125-S128 PolarHBondContact O-OG 3.4Å; Y125-L129 HydrophobicContact CD1-CD1 3.77Å; Y125-L129 HydrophobicContact CE1-CD1 3.43Å; Y125-L129 VanDerWaalsContact CE1-CD1 3.43Å; Y125-L129 HydrophobicContact CE1-CG 4.26Å; Y125-L129 HydrophobicContact CG-CD1 4.47Å; Y125-L129 PolarHBondContact O-N 3.29Å; Y125-V155 HydrophobicContact CD1-CG1 4.09Å; Y125-V155 HydrophobicContact CD1-CG2 4.23Å; Y125-V155 HydrophobicContact CE1-CG1 4.34Å; Y125-V155 HydrophobicContact CE1-CG2 3.63Å
126	V	89.2	Confident	88.1	Confident	38 Å²	38	40.8 Å²	40.8	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-44.6	173.8	172.4	0	0	0	0	111.2	L122 I124 S128 L129 D130 V155	L122-V126 VanDerWaalsContact O-CG2 3.29Å; L122-V126 WeakPolarHBondContact O-CG2 3.14Å; L122-V126 PolarHBondContact O-N 2.91Å; I124-V126 PolarHBondContact O-N 3.04Å; V126-S128 VanDerWaalsContact C-N 3.26Å; V126-S128 PolarHBondContact O-N 3.12Å; V126-L129 WeakPolarHBondContact O-CB 3.1Å; V126-L129 PolarHBondContact O-N 3.15Å; V126-L129 VanDerWaalsContact O-N 3.16Å; V126-D130 PolarHBondContact O-N 3.03Å; V126-V155 HydrophobicContact CG2-CG1 3.79Å
127	A	85.4	Confident	87.8	Confident	10 Å²	10	45.5 Å²	45.5	8%	0.083	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-31.5	177.2	0	0	0	0	0	113.2	S123 I124 Y125 G131 N405 L406	S123-A127 PolarHBondContact O-N 2.86Å; I124-A127 PolarHBondContact O-N 3.49Å; Y125-A127 PolarHBondContact O-N 3.04Å; A127-G131 PolarHBondContact O-N 3.47Å; A127-N405 HydrophobicContact CB-CB 4.41Å; A127-L406 HydrophobicContact CB-CD2 4.1Å; A127-L406 HydrophobicContact CB-CG 4.41Å
128	S	85.1	Confident	87.5	Confident	39 Å²	39	44.1 Å²	44.1	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-72.6	-39.8	174.2	78.5	0	0	0	0	112.4	I124 Y125 V126 G131 M132	I124-S128 PolarHBondContact O-N 3.3Å; Y125-S128 PolarHBondContact O-N 3.37Å; Y125-S128 VanDerWaalsContact O-N 3.16Å; Y125-S128 PolarHBondContact O-OG 3.4Å; V126-S128 VanDerWaalsContact C-N 3.26Å; V126-S128 PolarHBondContact O-N 3.12Å; S128-G131 PolarHBondContact O-N 3.25Å; S128-M132 PolarHBondContact O-N 2.92Å; S128-M132 VanDerWaalsContact O-N 3.08Å
129	L	87.3	Confident	87.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-43.9	174.3	-76.9	165	0	0	0	111.2	Y125 V126 G131 M132 I133 K151 V155	Y125-L129 HydrophobicContact CD1-CD1 3.77Å; Y125-L129 HydrophobicContact CE1-CD1 3.43Å; Y125-L129 VanDerWaalsContact CE1-CD1 3.43Å; Y125-L129 HydrophobicContact CE1-CG 4.26Å; Y125-L129 HydrophobicContact CG-CD1 4.47Å; Y125-L129 PolarHBondContact O-N 3.29Å; V126-L129 WeakPolarHBondContact O-CB 3.1Å; V126-L129 PolarHBondContact O-N 3.15Å; V126-L129 VanDerWaalsContact O-N 3.16Å; L129-G131 VanDerWaalsContact C-N 3.28Å; L129-G131 PolarHBondContact O-N 3.23Å; L129-M132 HydrophobicContact CB-CE 4.49Å; L129-M132 HydrophobicContact CD2-CE 3.58Å; L129-M132 HydrophobicContact CG-CE 4.09Å; L129-M132 PolarHBondContact O-N 3.38Å; L129-M132 VanDerWaalsContact O-N 3.08Å; L129-I133 WeakPolarHBondContact O-CG1 3.29Å; L129-I133 PolarHBondContact O-N 2.98Å; L129-K151 HydrophobicContact CD2-CB 4.31Å; L129-V155 HydrophobicContact CD1-CG2 4.08Å
130	D	87.6	Confident	86.9	Confident	46 Å²	46	51.4 Å²	51.4	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-55.8	-44	174.9	-73.8	-8.9	0	0	0	111.6	V126 M132 I133 V134 W152 N405	V126-D130 PolarHBondContact O-N 3.03Å; D130-M132 PolarHBondContact O-N 2.88Å; D130-I133 PolarHBondContact O-N 3.24Å; D130-V134 WeakPolarHBondContact O-CG2 3.39Å; D130-V134 PolarHBondContact O-N 3.06Å; D130-V134 VanDerWaalsContact O-N 3.07Å; D130-W152 VanDerWaalsContact OD1-CD1 3.28Å; D130-W152 PolarHBondContact OD1-NE1 3.24Å; D130-N405 PolarHBondContact OD2-ND2 3.49Å
131	G	85.3	Confident	86.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-40.6	176.1	0	0	0	0	0	112.9	A127 S128 L129 V134 R135	A127-G131 PolarHBondContact O-N 3.47Å; S128-G131 PolarHBondContact O-N 3.25Å; L129-G131 VanDerWaalsContact C-N 3.28Å; L129-G131 PolarHBondContact O-N 3.23Å; G131-V134 PolarHBondContact O-N 3.4Å; G131-R135 PolarHBondContact O-N 3.41Å
132	M	86.8	Confident	86.9	Confident	53 Å²	53	53.1 Å²	53.1	26%	0.261	28%	0.277	S	S	.	.	H	α-helix	trans	-67.6	-37.8	176.6	-71	-172.1	-69.2	0	0	112.3	S128 L129 D130 R135 C136	S128-M132 PolarHBondContact O-N 2.92Å; S128-M132 VanDerWaalsContact O-N 3.08Å; L129-M132 HydrophobicContact CB-CE 4.49Å; L129-M132 HydrophobicContact CD2-CE 3.58Å; L129-M132 HydrophobicContact CG-CE 4.09Å; L129-M132 PolarHBondContact O-N 3.38Å; L129-M132 VanDerWaalsContact O-N 3.08Å; D130-M132 PolarHBondContact O-N 2.88Å; M132-R135 VanDerWaalsContact O-CB 3.31Å; M132-R135 WeakPolarHBondContact O-CB 3.23Å; M132-R135 PolarHBondContact O-N 2.62Å; M132-C136 PolarHBondContact O-N 2.88Å; M132-C136 PolarHBondContact O-SG 2.8Å
133	I	89.7	Confident	87	Confident	19 Å²	19	62.1 Å²	62.1	10%	0.097	31%	0.309	C	S	.	.	H	α-helix	trans	-61.4	-46.7	174.8	-68.5	166.7	0	0	0	109.9	L129 D130 R135 C136 I137 F145 Q148 W152	L129-I133 WeakPolarHBondContact O-CG1 3.29Å; L129-I133 PolarHBondContact O-N 2.98Å; D130-I133 PolarHBondContact O-N 3.24Å; I133-R135 VanDerWaalsContact C-N 3.31Å; I133-R135 PolarHBondContact O-N 3.18Å; I133-C136 PolarHBondContact O-N 3.02Å; I133-I137 HydrophobicContact CG2-CD1 4.19Å; I133-I137 WeakPolarHBondContact O-CG1 3.35Å; I133-I137 PolarHBondContact O-N 2.92Å; I133-F145 HydrophobicContact CG2-CD2 3.95Å; I133-F145 HydrophobicContact CG2-CE2 3.66Å; I133-Q148 HydrophobicContact CG1-CB 3.8Å; I133-W152 HydrophobicContact CD1-CB 3.87Å; I133-W152 HydrophobicContact CD1-CG 4.02Å
134	V	87.9	Confident	87.1	Confident	45 Å²	45	61.1 Å²	61.1	27%	0.273	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-38.3	176.4	174.6	0	0	0	0	111.6	D130 G131 C136 I137 V138 T397 T401	D130-V134 WeakPolarHBondContact O-CG2 3.39Å; D130-V134 PolarHBondContact O-N 3.06Å; D130-V134 VanDerWaalsContact O-N 3.07Å; G131-V134 PolarHBondContact O-N 3.4Å; V134-C136 PolarHBondContact O-N 3.38Å; V134-I137 PolarHBondContact O-N 3.45Å; V134-V138 WeakPolarHBondContact O-CG2 3.45Å; V134-V138 PolarHBondContact O-N 3.09Å; V134-T397 HydrophobicContact CG1-CG2 3.91Å; V134-T401 HydrophobicContact CB-CG2 4.39Å; V134-T401 HydrophobicContact CG2-CG2 4.02Å
135	R	84.4	Confident	87.4	Confident	63 Å²	63	62.6 Å²	62.6	24%	0.238	31%	0.309	C	S	.	.	H	α-helix	trans	-55.8	-49	172.8	-168.2	-159.9	179.7	134.5	-3.9	111.5	G131 M132 I133 I137 V138 Q139 S394 E395 Q398	G131-R135 PolarHBondContact O-N 3.41Å; M132-R135 VanDerWaalsContact O-CB 3.31Å; M132-R135 WeakPolarHBondContact O-CB 3.23Å; M132-R135 PolarHBondContact O-N 2.62Å; I133-R135 VanDerWaalsContact C-N 3.31Å; I133-R135 PolarHBondContact O-N 3.18Å; R135-I137 VanDerWaalsContact C-N 3.32Å; R135-I137 PolarHBondContact O-N 3.08Å; R135-V138 PolarHBondContact O-N 3.16Å; R135-Q139 WeakPolarHBondContact O-CB 3.36Å; R135-Q139 WeakPolarHBondContact O-CG 3.38Å; R135-Q139 PolarHBondContact O-N 2.9Å; R135-S394 WeakPolarHBondContact CG-OG 3.38Å; R135-E395 IonicContact CZ-OE1 3.92Å; R135-E395 IonicContact NH1-OE1 3.8Å; R135-E395 IonicContact NH2-OE1 3.21Å; R135-E395 PolarHBondContact NH2-OE1 3Å; R135-Q398 HydrophobicContact CB-CB 4.19Å; R135-Q398 HydrophobicContact CG-CB 4.45Å
136	C	86.6	Confident	87.6	Confident	9 Å²	9	62 Å²	62	6%	0.061	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-36.7	179.2	-65.2	0	0	0	0	112.5	M132 I133 V134 Q139 K140 D141 A144 F145	M132-C136 PolarHBondContact O-N 2.88Å; M132-C136 PolarHBondContact O-SG 2.8Å; I133-C136 PolarHBondContact O-N 3.02Å; V134-C136 PolarHBondContact O-N 3.38Å; C136-Q139 PolarHBondContact O-N 2.96Å; C136-K140 PolarHBondContact O-N 3.3Å; C136-D141 PolarHBondContact O-N 2.92Å; C136-A144 HydrophobicContact CB-CB 4.49Å; C136-F145 HydrophobicContact CB-CB 4.21Å
137	I	87	Confident	87.8	Confident	99 Å²	99	64.7 Å²	64.7	51%	0.508	33%	0.328	S	S	.	.	H	α-helix	trans	-62.1	-46	174.5	-66.1	167.5	0	0	0	110.3	I133 V134 R135 K140 F145	I133-I137 HydrophobicContact CG2-CD1 4.19Å; I133-I137 WeakPolarHBondContact O-CG1 3.35Å; I133-I137 PolarHBondContact O-N 2.92Å; V134-I137 PolarHBondContact O-N 3.45Å; R135-I137 VanDerWaalsContact C-N 3.32Å; R135-I137 PolarHBondContact O-N 3.08Å; I137-K140 PolarHBondContact O-N 3.03Å; I137-F145 HydrophobicContact CD1-CD2 4.39Å; I137-F145 HydrophobicContact CD1-CE2 3.98Å; I137-F145 HydrophobicContact CG1-CD2 3.83Å; I137-F145 HydrophobicContact CG1-CE2 3.9Å
138	V	84.8	Confident	88.1	Confident	61 Å²	61	65.8 Å²	65.8	37%	0.37	33%	0.332	S	S	.	.	H	α-helix	trans	-67.3	-37.3	178.9	175.9	0	0	0	0	111.7	V134 R135 K140 T397	V134-V138 WeakPolarHBondContact O-CG2 3.45Å; V134-V138 PolarHBondContact O-N 3.09Å; R135-V138 PolarHBondContact O-N 3.16Å; V138-K140 PolarHBondContact O-N 3.39Å; V138-T397 HydrophobicContact CG2-CG2 4.07Å
139	Q	84.5	Confident	88.4	Confident	75 Å²	75	67.5 Å²	67.5	35%	0.35	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.1	175.7	-71.9	178.3	-34.8	0	0	113.8	R135 C136 D141 S394	R135-Q139 WeakPolarHBondContact O-CB 3.36Å; R135-Q139 WeakPolarHBondContact O-CG 3.38Å; R135-Q139 PolarHBondContact O-N 2.9Å; C136-Q139 PolarHBondContact O-N 2.96Å; Q139-D141 PolarHBondContact O-N 3.26Å; Q139-S394 WeakPolarHBondContact CG-OG 3.4Å
140	K	85.6	Confident	88.7	Confident	183 Å²	183	70.5 Å²	70.5	80%	0.796	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	35.5	-176.9	-56.3	178.9	-178.5	173.9	0	113.4	C136 I137 V138 P142	C136-K140 PolarHBondContact O-N 3.3Å; I137-K140 PolarHBondContact O-N 3.03Å; V138-K140 PolarHBondContact O-N 3.39Å; K140-P142 WeakPolarHBondContact O-CD 3.39Å
141	D	88.4	Confident	88.9	Confident	67 Å²	67	72.5 Å²	72.5	36%	0.358	37%	0.365	S	S	.	.			trans	-98.7	99.9	176.2	-175.5	-8.1	0	0	0	111.1	C136 Q139 R143 A144 F145	C136-D141 PolarHBondContact O-N 2.92Å; Q139-D141 PolarHBondContact O-N 3.26Å; D141-R143 VanDerWaalsContact C-N 3.32Å; D141-R143 PolarHBondContact O-N 3.38Å; D141-R143 PolarHBondContact OD1-N 3.27Å; D141-A144 HydrophobicContact CB-CB 4.11Å; D141-A144 PolarHBondContact OD1-N 3.14Å; D141-A144 WeakPolarHBondContact OD2-CB 3.42Å; D141-F145 WeakPolarHBondContact O-CB 3.43Å; D141-F145 PolarHBondContact O-N 3.31Å; D141-F145 VanDerWaalsContact O-N 3.07Å
142	P	88.9	Confident	89.3	Confident	92 Å²	92	77 Å²	77	60%	0.597	38%	0.382	S	S	*	.	H	α-helix	trans	-69.4	-28.6	-177.5	29	-35.4	0	0	0	112.7	K140 V146	K140-P142 WeakPolarHBondContact O-CD 3.39Å; P142-V146 WeakPolarHBondContact O-CG2 3.34Å; P142-V146 PolarHBondContact O-N 3.18Å; P142-V146 VanDerWaalsContact O-N 3.14Å
143	R	91.2	Very high	89.6	Confident	217 Å²	217	80 Å²	80	82%	0.819	40%	0.399	S	S	*	.	H	α-helix	trans	-73.8	-47.1	-177.7	-67.2	-177.6	180	176	0.6	110.2	D141 F145 V146 L147	D141-R143 VanDerWaalsContact C-N 3.32Å; D141-R143 PolarHBondContact O-N 3.38Å; D141-R143 PolarHBondContact OD1-N 3.27Å; R143-F145 VanDerWaalsContact C-N 3.3Å; R143-F145 PolarHBondContact O-N 3.02Å; R143-V146 PolarHBondContact O-N 3.11Å; R143-L147 PolarHBondContact O-N 2.85Å
144	A	88.3	Confident	89.7	Confident	26 Å²	26	85.4 Å²	85.4	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-63.4	-37.8	174.5	0	0	0	0	0	111.7	C136 D141 L147 Q148	C136-A144 HydrophobicContact CB-CB 4.49Å; D141-A144 HydrophobicContact CB-CB 4.11Å; D141-A144 PolarHBondContact OD1-N 3.14Å; D141-A144 WeakPolarHBondContact OD2-CB 3.42Å; A144-L147 PolarHBondContact O-N 2.79Å; A144-Q148 WeakPolarHBondContact O-CG 3.29Å; A144-Q148 PolarHBondContact O-N 2.99Å
145	F	92.1	Very high	90	Very high	64 Å²	64	84.1 Å²	84.1	28%	0.281	42%	0.419	S	S	.	.	H	α-helix	trans	-58.3	-51	175.9	173.6	-100.3	0	0	0	112.7	I133 C136 I137 D141 R143 L147 Q148 L149	I133-F145 HydrophobicContact CG2-CD2 3.95Å; I133-F145 HydrophobicContact CG2-CE2 3.66Å; C136-F145 HydrophobicContact CB-CB 4.21Å; I137-F145 HydrophobicContact CD1-CD2 4.39Å; I137-F145 HydrophobicContact CD1-CE2 3.98Å; I137-F145 HydrophobicContact CG1-CD2 3.83Å; I137-F145 HydrophobicContact CG1-CE2 3.9Å; D141-F145 WeakPolarHBondContact O-CB 3.43Å; D141-F145 PolarHBondContact O-N 3.31Å; D141-F145 VanDerWaalsContact O-N 3.07Å; R143-F145 VanDerWaalsContact C-N 3.3Å; R143-F145 PolarHBondContact O-N 3.02Å; F145-L147 VanDerWaalsContact C-N 3.27Å; F145-L147 PolarHBondContact O-N 3.37Å; F145-Q148 PolarHBondContact O-N 3.29Å; F145-L149 HydrophobicContact CE1-CD2 3.97Å; F145-L149 HydrophobicContact CZ-CD2 3.98Å; F145-L149 VanDerWaalsContact O-CB 3.27Å; F145-L149 WeakPolarHBondContact O-CB 3.42Å; F145-L149 PolarHBondContact O-N 2.82Å
146	V	93.5	Very high	90.3	Very high	95 Å²	95	82.8 Å²	82.8	58%	0.576	42%	0.422	S	S	*	.	H	α-helix	trans	-61.3	-38.3	179.5	173.8	0	0	0	0	111.2	P142 R143 S150	P142-V146 WeakPolarHBondContact O-CG2 3.34Å; P142-V146 PolarHBondContact O-N 3.18Å; P142-V146 VanDerWaalsContact O-N 3.14Å; R143-V146 PolarHBondContact O-N 3.11Å; V146-S150 WeakPolarHBondContact O-CB 3.42Å; V146-S150 PolarHBondContact O-N 3.18Å; V146-S150 PolarHBondContact O-OG 3.36Å
147	L	92.6	Very high	90.5	Very high	95 Å²	95	87 Å²	87	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-69.7	-39.7	179.4	-150.9	163.8	0	0	0	112.1	R143 A144 F145 S150 K151	R143-L147 PolarHBondContact O-N 2.85Å; A144-L147 PolarHBondContact O-N 2.79Å; F145-L147 VanDerWaalsContact C-N 3.27Å; F145-L147 PolarHBondContact O-N 3.37Å; L147-S150 PolarHBondContact O-OG 2.85Å; L147-K151 HydrophobicContact CD2-CD 4.04Å; L147-K151 VanDerWaalsContact CD2-CE 3.41Å; L147-K151 HydrophobicContact CD2-CG 4.44Å; L147-K151 WeakPolarHBondContact O-CG 3.35Å; L147-K151 PolarHBondContact O-N 3.23Å
148	Q	91.6	Very high	90.8	Very high	34 Å²	34	85.3 Å²	85.3	16%	0.159	44%	0.442	C	S	.	.	H	α-helix	trans	-73	-36.3	176.1	-64.8	-63	-5.6	0	0	112.3	I133 A144 F145 K151 W152	I133-Q148 HydrophobicContact CG1-CB 3.8Å; A144-Q148 WeakPolarHBondContact O-CG 3.29Å; A144-Q148 PolarHBondContact O-N 2.99Å; F145-Q148 PolarHBondContact O-N 3.29Å; Q148-K151 PolarHBondContact O-N 2.9Å; Q148-W152 WeakPolarHBondContact O-CB 3.37Å; Q148-W152 PolarHBondContact O-N 2.86Å
149	L	91.8	Very high	91.1	Very high	74 Å²	74	83 Å²	83	39%	0.387	43%	0.43	S	S	.	.	H	α-helix	trans	-66.2	-40	175.2	-175.8	63.4	0	0	0	111.9	F145 W152 L153	F145-L149 HydrophobicContact CE1-CD2 3.97Å; F145-L149 HydrophobicContact CZ-CD2 3.98Å; F145-L149 VanDerWaalsContact O-CB 3.27Å; F145-L149 WeakPolarHBondContact O-CB 3.42Å; F145-L149 PolarHBondContact O-N 2.82Å; L149-W152 WeakPolarHBondContact O-CB 3.37Å; L149-W152 PolarHBondContact O-N 3.29Å; L149-L153 PolarHBondContact O-N 2.87Å
150	S	93.7	Very high	91.5	Very high	64 Å²	64	83.5 Å²	83.5	45%	0.448	44%	0.438	S	S	.	.	H	α-helix	trans	-66	-40.2	176.3	68.6	0	0	0	0	112	V146 L147 W152 L153 L154	V146-S150 WeakPolarHBondContact O-CB 3.42Å; V146-S150 PolarHBondContact O-N 3.18Å; V146-S150 PolarHBondContact O-OG 3.36Å; L147-S150 PolarHBondContact O-OG 2.85Å; S150-W152 VanDerWaalsContact C-N 3.35Å; S150-W152 PolarHBondContact O-N 3.09Å; S150-L153 PolarHBondContact O-N 2.62Å; S150-L154 WeakPolarHBondContact O-CB 3.21Å; S150-L154 PolarHBondContact O-N 3.28Å
151	K	93.2	Very high	92	Very high	87 Å²	87	81.8 Å²	81.8	38%	0.378	43%	0.431	S	S	.	.	H	α-helix	trans	-58.8	-45.1	171	-75.9	173.7	176.4	173.7	0	111.8	L129 L147 Q148 L153 L154 V155	L129-K151 HydrophobicContact CD2-CB 4.31Å; L147-K151 HydrophobicContact CD2-CD 4.04Å; L147-K151 VanDerWaalsContact CD2-CE 3.41Å; L147-K151 HydrophobicContact CD2-CG 4.44Å; L147-K151 WeakPolarHBondContact O-CG 3.35Å; L147-K151 PolarHBondContact O-N 3.23Å; Q148-K151 PolarHBondContact O-N 2.9Å; K151-L153 PolarHBondContact O-N 3.39Å; K151-L154 PolarHBondContact O-N 3.15Å; K151-V155 WeakPolarHBondContact O-CG2 3.4Å; K151-V155 PolarHBondContact O-N 3.19Å
152	W	92.5	Very high	92.2	Very high	96 Å²	96	80 Å²	80	36%	0.364	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-44.2	177.8	-177.1	97.3	0	0	0	112.1	D130 I133 Q148 L149 S150 V155 A156	D130-W152 VanDerWaalsContact OD1-CD1 3.28Å; D130-W152 PolarHBondContact OD1-NE1 3.24Å; I133-W152 HydrophobicContact CD1-CB 3.87Å; I133-W152 HydrophobicContact CD1-CG 4.02Å; Q148-W152 WeakPolarHBondContact O-CB 3.37Å; Q148-W152 PolarHBondContact O-N 2.86Å; L149-W152 WeakPolarHBondContact O-CB 3.37Å; L149-W152 PolarHBondContact O-N 3.29Å; S150-W152 VanDerWaalsContact C-N 3.35Å; S150-W152 PolarHBondContact O-N 3.09Å; W152-V155 PolarHBondContact O-N 2.87Å; W152-A156 PolarHBondContact O-N 3.11Å
153	L	93	Very high	92.3	Very high	116 Å²	116	78.8 Å²	78.8	61%	0.607	41%	0.41	S	S	*	.	H	α-helix	trans	-65.6	-40.6	177.1	-168.8	71.3	0	0	0	112.1	L149 S150 K151 V155 A156	L149-L153 PolarHBondContact O-N 2.87Å; S150-L153 PolarHBondContact O-N 2.62Å; K151-L153 PolarHBondContact O-N 3.39Å; L153-V155 VanDerWaalsContact C-N 3.31Å; L153-V155 PolarHBondContact O-N 3.22Å; L153-A156 VanDerWaalsContact O-CB 3.23Å; L153-A156 WeakPolarHBondContact O-CB 3.45Å; L153-A156 PolarHBondContact O-N 2.88Å; L153-A156 VanDerWaalsContact O-N 3.14Å
154	L	93	Very high	92.5	Very high	131 Å²	131	72.1 Å²	72.1	69%	0.686	40%	0.396	S	S	*	.	H	α-helix	trans	-63.4	-38.3	178.3	-171.2	69	0	0	0	111.9	S150 K151 A156 V157 P158	S150-L154 WeakPolarHBondContact O-CB 3.21Å; S150-L154 PolarHBondContact O-N 3.28Å; K151-L154 PolarHBondContact O-N 3.15Å; L154-A156 PolarHBondContact O-N 2.85Å; L154-V157 PolarHBondContact O-N 3.11Å; L154-P158 WeakPolarHBondContact O-CD 3.42Å
155	V	93.6	Very high	92.8	Very high	18 Å²	18	71.7 Å²	71.7	11%	0.109	39%	0.393	C	S	.	.	H	α-helix	trans	-68.1	-23.2	177	172.1	0	0	0	0	112.1	L122 Y125 V126 L129 K151 W152 L153 V157 P158 A159	L122-V155 HydrophobicContact CD1-CG1 3.75Å; L122-V155 HydrophobicContact CG-CG1 4.33Å; Y125-V155 HydrophobicContact CD1-CG1 4.09Å; Y125-V155 HydrophobicContact CD1-CG2 4.23Å; Y125-V155 HydrophobicContact CE1-CG1 4.34Å; Y125-V155 HydrophobicContact CE1-CG2 3.63Å; V126-V155 HydrophobicContact CG2-CG1 3.79Å; L129-V155 HydrophobicContact CD1-CG2 4.08Å; K151-V155 WeakPolarHBondContact O-CG2 3.4Å; K151-V155 PolarHBondContact O-N 3.19Å; W152-V155 PolarHBondContact O-N 2.87Å; L153-V155 VanDerWaalsContact C-N 3.31Å; L153-V155 PolarHBondContact O-N 3.22Å; V155-V157 VanDerWaalsContact C-N 3.27Å; V155-V157 PolarHBondContact O-N 3.47Å; V155-P158 VanDerWaalsContact O-CD 3.26Å; V155-P158 WeakPolarHBondContact O-CD 3.4Å; V155-P158 WeakPolarHBondContact O-CG 3.47Å; V155-A159 WeakPolarHBondContact O-CB 3.27Å; V155-A159 PolarHBondContact O-N 3.05Å
156	A	89.8	Confident	92.8	Very high	35 Å²	35	69 Å²	69	29%	0.289	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-32.3	177.3	0	0	0	0	0	112.6	W152 L153 L154 A159 T160	W152-A156 PolarHBondContact O-N 3.11Å; L153-A156 VanDerWaalsContact O-CB 3.23Å; L153-A156 WeakPolarHBondContact O-CB 3.45Å; L153-A156 PolarHBondContact O-N 2.88Å; L153-A156 VanDerWaalsContact O-N 3.14Å; L154-A156 PolarHBondContact O-N 2.85Å; A156-A159 WeakPolarHBondContact O-CB 3.31Å; A156-A159 PolarHBondContact O-N 3.27Å; A156-T160 WeakPolarHBondContact O-CG2 3.41Å; A156-T160 PolarHBondContact O-N 3.02Å; A156-T160 PolarHBondContact O-OG1 3.21Å; A156-T160 VanDerWaalsContact O-OG1 3.11Å
157	V	92.1	Very high	92.8	Very high	99 Å²	99	71.4 Å²	71.4	60%	0.6	38%	0.38	S	S	*	.	H	α-helix	trans	-63.1	-56.4	179.9	179.5	0	0	0	0	112.8	L154 V155 A159 T160 F161	L154-V157 PolarHBondContact O-N 3.11Å; V155-V157 VanDerWaalsContact C-N 3.27Å; V155-V157 PolarHBondContact O-N 3.47Å; V157-A159 PolarHBondContact O-N 3.42Å; V157-T160 PolarHBondContact O-N 3.28Å; V157-T160 PolarHBondContact O-OG1 2.97Å; V157-F161 PolarHBondContact O-N 2.91Å; V157-F161 VanDerWaalsContact O-N 3.09Å
158	P	93.4	Very high	92.9	Very high	62 Å²	62	73.2 Å²	73.2	40%	0.403	38%	0.384	S	S	.	.	H	α-helix	trans	-64.7	-29	174.2	25.2	-33.3	0	0	0	111.8	L154 V155 F161 I162	L154-P158 WeakPolarHBondContact O-CD 3.42Å; V155-P158 VanDerWaalsContact O-CD 3.26Å; V155-P158 WeakPolarHBondContact O-CD 3.4Å; V155-P158 WeakPolarHBondContact O-CG 3.47Å; P158-F161 PolarHBondContact O-N 3.46Å; P158-I162 WeakPolarHBondContact O-CB 3.28Å; P158-I162 VanDerWaalsContact O-CG1 3.28Å; P158-I162 WeakPolarHBondContact O-CG1 3.49Å; P158-I162 PolarHBondContact O-N 3.08Å
159	A	90.1	Very high	93.1	Very high	13 Å²	13	72.1 Å²	72.1	11%	0.107	38%	0.379	C	S	.	.	H	α-helix	trans	-64.1	-48.1	176.2	0	0	0	0	0	112.6	R119 L122 V155 A156 V157 F161 I162 N163	R119-A159 PolarHBondContact NH1-O 3.39Å; L122-A159 HydrophobicContact CD2-CB 3.41Å; L122-A159 VanDerWaalsContact CD2-CB 3.41Å; L122-A159 HydrophobicContact CG-CB 4.31Å; V155-A159 WeakPolarHBondContact O-CB 3.27Å; V155-A159 PolarHBondContact O-N 3.05Å; A156-A159 WeakPolarHBondContact O-CB 3.31Å; A156-A159 PolarHBondContact O-N 3.27Å; V157-A159 PolarHBondContact O-N 3.42Å; A159-F161 VanDerWaalsContact C-N 3.35Å; A159-I162 PolarHBondContact O-N 3.35Å; A159-N163 PolarHBondContact O-N 3.31Å
160	T	93.3	Very high	93.2	Very high	86 Å²	86	69.5 Å²	69.5	53%	0.528	37%	0.365	S	S	.	.	H	α-helix	trans	-66.3	-39.4	178.1	53.3	0	0	0	0	110.9	A156 V157 I162 N163 S164	A156-T160 WeakPolarHBondContact O-CG2 3.41Å; A156-T160 PolarHBondContact O-N 3.02Å; A156-T160 PolarHBondContact O-OG1 3.21Å; A156-T160 VanDerWaalsContact O-OG1 3.11Å; V157-T160 PolarHBondContact O-N 3.28Å; V157-T160 PolarHBondContact O-OG1 2.97Å; T160-I162 PolarHBondContact O-N 3.39Å; T160-N163 PolarHBondContact O-N 3.48Å; T160-S164 PolarHBondContact O-N 3.41Å; T160-S164 PolarHBondContact O-OG 2.69Å
161	F	95.2	Very high	93.3	Very high	146 Å²	146	68.4 Å²	68.4	64%	0.64	36%	0.364	S	S	*	.	H	α-helix	trans	-56.8	-51.4	173.2	177.6	-99.3	0	0	0	112.1	V157 P158 A159 N163 S164 A165	V157-F161 PolarHBondContact O-N 2.91Å; V157-F161 VanDerWaalsContact O-N 3.09Å; P158-F161 PolarHBondContact O-N 3.46Å; A159-F161 VanDerWaalsContact C-N 3.35Å; F161-N163 VanDerWaalsContact C-N 3.28Å; F161-N163 PolarHBondContact O-N 2.89Å; F161-S164 PolarHBondContact O-N 3.41Å; F161-A165 WeakPolarHBondContact O-CB 3.4Å; F161-A165 PolarHBondContact O-N 2.88Å
162	I	94	Very high	93.3	Very high	29 Å²	29	67.9 Å²	67.9	15%	0.149	36%	0.362	C	S	.	.	H	α-helix	trans	-59.6	-40.2	178.5	-71	168.5	0	0	0	110.8	T115 R119 L122 P158 A159 T160 S164 A165 I166	T115-I162 HydrophobicContact CG2-CG2 3.91Å; R119-I162 HydrophobicContact CB-CG2 3.64Å; R119-I162 HydrophobicContact CG-CG2 4.28Å; L122-I162 HydrophobicContact CD2-CD1 4.01Å; P158-I162 WeakPolarHBondContact O-CB 3.28Å; P158-I162 VanDerWaalsContact O-CG1 3.28Å; P158-I162 WeakPolarHBondContact O-CG1 3.49Å; P158-I162 PolarHBondContact O-N 3.08Å; A159-I162 PolarHBondContact O-N 3.35Å; T160-I162 PolarHBondContact O-N 3.39Å; I162-S164 PolarHBondContact O-N 3.41Å; I162-A165 PolarHBondContact O-N 3.42Å; I162-I166 HydrophobicContact CG2-CD1 4.2Å; I162-I166 VanDerWaalsContact O-CG1 3.28Å; I162-I166 WeakPolarHBondContact O-CG1 3.37Å; I162-I166 PolarHBondContact O-N 3.01Å
163	N	91.2	Very high	93.4	Very high	68 Å²	68	63.4 Å²	63.4	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-42.8	178	-171	70.5	0	0	0	112.4	A159 T160 F161 I166 R167	A159-N163 PolarHBondContact O-N 3.31Å; T160-N163 PolarHBondContact O-N 3.48Å; F161-N163 VanDerWaalsContact C-N 3.28Å; F161-N163 PolarHBondContact O-N 2.89Å; N163-I166 PolarHBondContact O-N 3.23Å; N163-R167 PolarHBondContact O-N 3.32Å
164	S	94.3	Very high	93.5	Very high	76 Å²	76	59.4 Å²	59.4	53%	0.531	33%	0.326	S	S	.	.	H	α-helix	trans	-66.7	-39.4	174.7	-61.5	0	0	0	0	111.8	T160 F161 I162 I166 R167 F168	T160-S164 PolarHBondContact O-N 3.41Å; T160-S164 PolarHBondContact O-OG 2.69Å; F161-S164 PolarHBondContact O-N 3.41Å; I162-S164 PolarHBondContact O-N 3.41Å; S164-I166 VanDerWaalsContact C-N 3.35Å; S164-I166 PolarHBondContact O-N 2.88Å; S164-R167 PolarHBondContact O-N 3.04Å; S164-F168 PolarHBondContact O-N 2.99Å
165	A	94.7	Very high	93.7	Very high	18 Å²	18	56.7 Å²	56.7	15%	0.149	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-39.8	176.9	0	0	0	0	0	112	T115 F161 I162 R167 F168 L169	T115-A165 HydrophobicContact CG2-CB 4.05Å; F161-A165 WeakPolarHBondContact O-CB 3.4Å; F161-A165 PolarHBondContact O-N 2.88Å; I162-A165 PolarHBondContact O-N 3.42Å; A165-R167 PolarHBondContact O-N 2.82Å; A165-F168 PolarHBondContact O-N 3.07Å; A165-L169 VanDerWaalsContact O-CB 3.31Å; A165-L169 WeakPolarHBondContact O-CB 3.32Å; A165-L169 VanDerWaalsContact O-CG 3.22Å; A165-L169 WeakPolarHBondContact O-CG 3.41Å; A165-L169 PolarHBondContact O-N 3.3Å
166	I	92.9	Very high	93.7	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-57.2	-49.3	174.2	-68.3	167.3	0	0	0	110.3	H112 T115 L116 R119 I162 N163 S164 L169 E170	H112-I166 PolarHBondContact CE1-O 3.18Å; H112-I166 VanDerWaalsContact CE1-O 3.29Å; T115-I166 HydrophobicContact CG2-CG1 3.7Å; L116-I166 HydrophobicContact CD2-CD1 3.76Å; L116-I166 HydrophobicContact CD2-CG1 3.9Å; L116-I166 HydrophobicContact CD2-CG2 3.81Å; R119-I166 HydrophobicContact CB-CD1 3.9Å; R119-I166 HydrophobicContact CG-CD1 4.02Å; I162-I166 HydrophobicContact CG2-CD1 4.2Å; I162-I166 VanDerWaalsContact O-CG1 3.28Å; I162-I166 WeakPolarHBondContact O-CG1 3.37Å; I162-I166 PolarHBondContact O-N 3.01Å; N163-I166 PolarHBondContact O-N 3.23Å; S164-I166 VanDerWaalsContact C-N 3.35Å; S164-I166 PolarHBondContact O-N 2.88Å; I166-L169 PolarHBondContact O-N 3.1Å; I166-E170 VanDerWaalsContact O-CB 3.3Å; I166-E170 WeakPolarHBondContact O-CB 3.41Å; I166-E170 PolarHBondContact O-N 3.23Å
167	R	92.5	Very high	93.9	Very high	146 Å²	146	55.7 Å²	55.7	55%	0.551	30%	0.303	S	S	*	.	H	α-helix	trans	-65.4	-40.6	-179.8	-68.1	-58.7	-168.9	-174.5	5.6	112.8	N163 S164 A165 E170 G171	N163-R167 PolarHBondContact O-N 3.32Å; S164-R167 PolarHBondContact O-N 3.04Å; A165-R167 PolarHBondContact O-N 2.82Å; R167-E170 IonicContact CZ-OE2 3.66Å; R167-E170 IonicContact NH1-OE1 2.64Å; R167-E170 IonicContact NH1-OE2 3.65Å; R167-E170 PolarHBondContact NH1-OE2 3.16Å; R167-G171 PolarHBondContact O-N 3.43Å; R167-G171 VanDerWaalsContact O-N 3.08Å
168	F	95.3	Very high	94.1	Very high	132 Å²	132	55.8 Å²	55.8	58%	0.579	29%	0.293	S	S	*	.	H	α-helix	trans	-62	-48.7	175.2	174.5	-99.2	0	0	0	111.7	S164 A165 E170 G171 Q172	S164-F168 PolarHBondContact O-N 2.99Å; A165-F168 PolarHBondContact O-N 3.07Å; F168-E170 VanDerWaalsContact C-N 3.34Å; F168-E170 PolarHBondContact O-N 2.56Å; F168-G171 PolarHBondContact O-N 3.32Å; F168-Q172 HydrophobicContact CD1-CG 4.27Å; F168-Q172 HydrophobicContact CE1-CG 3.81Å; F168-Q172 HydrophobicContact CE2-CG 4.14Å; F168-Q172 HydrophobicContact CZ-CG 3.74Å; F168-Q172 WeakPolarHBondContact O-CG 3.18Å; F168-Q172 PolarHBondContact O-N 3.4Å
169	L	94.8	Very high	94.1	Very high	12 Å²	12	55.6 Å²	55.6	6%	0.063	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-36.9	179.7	-70.8	171.8	0	0	0	112.2	L108 L111 H112 T115 A165 I166 Q172 L173	L108-L169 HydrophobicContact CD1-CD2 3.75Å; L111-L169 HydrophobicContact CD2-CD1 4.47Å; L111-L169 HydrophobicContact CD2-CD2 3.75Å; L111-L169 HydrophobicContact CG-CD1 4.06Å; L111-L169 HydrophobicContact CG-CD2 4.16Å; H112-L169 HydrophobicContact CB-CB 4.25Å; H112-L169 HydrophobicContact CB-CD1 4.38Å; H112-L169 VanDerWaalsContact ND1-CB 3.29Å; H112-L169 WeakPolarHBondContact ND1-CB 3.18Å; T115-L169 HydrophobicContact CG2-CD1 4.44Å; T115-L169 WeakPolarHBondContact OG1-CD1 3.46Å; A165-L169 VanDerWaalsContact O-CB 3.31Å; A165-L169 WeakPolarHBondContact O-CB 3.32Å; A165-L169 VanDerWaalsContact O-CG 3.22Å; A165-L169 WeakPolarHBondContact O-CG 3.41Å; A165-L169 PolarHBondContact O-N 3.3Å; I166-L169 PolarHBondContact O-N 3.1Å; L169-Q172 PolarHBondContact O-N 3.12Å; L169-L173 VanDerWaalsContact O-CB 3.32Å; L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 PolarHBondContact O-N 2.86Å
170	E	94.4	Very high	94.2	Very high	19 Å²	19	58 Å²	58	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-43.9	173	-175.1	-173.3	161.1	0	0	111.7	I166 R167 F168 L173 T174 H225	I166-E170 VanDerWaalsContact O-CB 3.3Å; I166-E170 WeakPolarHBondContact O-CB 3.41Å; I166-E170 PolarHBondContact O-N 3.23Å; R167-E170 IonicContact CZ-OE2 3.66Å; R167-E170 IonicContact NH1-OE1 2.64Å; R167-E170 IonicContact NH1-OE2 3.65Å; R167-E170 PolarHBondContact NH1-OE2 3.16Å; F168-E170 VanDerWaalsContact C-N 3.34Å; F168-E170 PolarHBondContact O-N 2.56Å; E170-L173 PolarHBondContact O-N 3.16Å; E170-T174 PolarHBondContact O-N 3.4Å; E170-T174 PolarHBondContact O-OG1 2.91Å; E170-H225 WeakPolarHBondContact OE1-CA 3.45Å; E170-H225 IonicContact OE1-CD2 3.14Å; E170-H225 PolarHBondContact OE1-CD2 2.7Å; E170-H225 IonicContact OE1-CG 2.71Å
171	G	95.3	Very high	94.3	Very high	40 Å²	40	53.9 Å²	53.9	41%	0.412	27%	0.274	S	S	.	.	H	α-helix	trans	-65.6	-42.8	175.7	0	0	0	0	0	113	R167 F168 L173 T174 L175	R167-G171 PolarHBondContact O-N 3.43Å; R167-G171 VanDerWaalsContact O-N 3.08Å; F168-G171 PolarHBondContact O-N 3.32Å; G171-L173 VanDerWaalsContact C-N 3.32Å; G171-L173 PolarHBondContact O-N 3.37Å; G171-T174 WeakPolarHBondContact O-CB 3.41Å; G171-T174 PolarHBondContact O-N 3.34Å; G171-L175 PolarHBondContact O-N 3.28Å
172	Q	95.2	Very high	94.3	Very high	76 Å²	76	48.2 Å²	48.2	36%	0.355	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-40.5	175	-72	-65.3	-16.6	0	0	111.8	L108 F168 L169 L175 S176	L108-Q172 HydrophobicContact CD1-CB 4.25Å; L108-Q172 HydrophobicContact CD2-CB 3.8Å; F168-Q172 HydrophobicContact CD1-CG 4.27Å; F168-Q172 HydrophobicContact CE1-CG 3.81Å; F168-Q172 HydrophobicContact CE2-CG 4.14Å; F168-Q172 HydrophobicContact CZ-CG 3.74Å; F168-Q172 WeakPolarHBondContact O-CG 3.18Å; F168-Q172 PolarHBondContact O-N 3.4Å; L169-Q172 PolarHBondContact O-N 3.12Å; Q172-L175 PolarHBondContact O-N 3.28Å; Q172-S176 WeakPolarHBondContact O-CB 3.44Å; Q172-S176 PolarHBondContact O-N 3.12Å
173	L	94.2	Very high	94.3	Very high	2 Å²	2	50 Å²	50	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-43.9	177.9	-169.2	70.2	0	0	0	111	L108 L109 L169 E170 G171 L175 S176 F177 A224	L108-L173 HydrophobicContact CD2-CB 4Å; L108-L173 HydrophobicContact CD2-CD1 3.99Å; L108-L173 HydrophobicContact CG-CD1 4.44Å; L109-L173 HydrophobicContact CD1-CD2 3.91Å; L169-L173 VanDerWaalsContact O-CB 3.32Å; L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 PolarHBondContact O-N 2.86Å; E170-L173 PolarHBondContact O-N 3.16Å; G171-L173 VanDerWaalsContact C-N 3.32Å; G171-L173 PolarHBondContact O-N 3.37Å; L173-L175 PolarHBondContact O-N 3.13Å; L173-S176 PolarHBondContact O-N 3.05Å; L173-F177 HydrophobicContact CD1-CD1 4.39Å; L173-F177 HydrophobicContact CD1-CE1 3.63Å; L173-F177 HydrophobicContact CD1-CE2 4.02Å; L173-F177 HydrophobicContact CD1-CZ 3.41Å; L173-F177 VanDerWaalsContact CD1-CZ 3.41Å; L173-F177 HydrophobicContact CD2-CE2 3.79Å; L173-F177 HydrophobicContact CD2-CZ 3.84Å; L173-F177 HydrophobicContact CG-CD2 4.13Å; L173-F177 HydrophobicContact CG-CE1 4.05Å; L173-F177 HydrophobicContact CG-CE2 3.53Å; L173-F177 HydrophobicContact CG-CZ 3.48Å; L173-F177 VanDerWaalsContact CG-CZ 3.48Å; L173-F177 WeakPolarHBondContact O-CB 3.46Å; L173-F177 VanDerWaalsContact O-CG 3.26Å; L173-F177 WeakPolarHBondContact O-CG 3.35Å; L173-F177 PolarHBondContact O-N 2.7Å; L173-A224 HydrophobicContact CB-CB 4.34Å; L173-A224 HydrophobicContact CD2-CB 4.06Å; L173-A224 HydrophobicContact CG-CB 4.28Å
174	T	95.5	Very high	94.4	Very high	33 Å²	33	49.5 Å²	49.5	20%	0.202	26%	0.261	C	S	.	.	H	α-helix	trans	-56.6	-48	174.3	-60.8	0	0	0	0	111.7	E170 G171 R178 A221 A224	E170-T174 PolarHBondContact O-N 3.4Å; E170-T174 PolarHBondContact O-OG1 2.91Å; G171-T174 WeakPolarHBondContact O-CB 3.41Å; G171-T174 PolarHBondContact O-N 3.34Å; T174-R178 WeakPolarHBondContact O-CB 3.48Å; T174-R178 PolarHBondContact O-N 3.27Å; T174-A221 HydrophobicContact CG2-CB 3.8Å; T174-A224 VanDerWaalsContact OG1-CB 3.25Å; T174-A224 WeakPolarHBondContact OG1-CB 3.35Å
175	L	95.4	Very high	94.4	Very high	73 Å²	73	45.9 Å²	45.9	38%	0.382	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-45.9	-179.7	178.2	59.9	0	0	0	111.4	G171 Q172 L173 R178 S179	G171-L175 PolarHBondContact O-N 3.28Å; Q172-L175 PolarHBondContact O-N 3.28Å; L173-L175 PolarHBondContact O-N 3.13Å; L175-R178 PolarHBondContact O-N 2.82Å; L175-S179 PolarHBondContact O-N 3.07Å; L175-S179 PolarHBondContact O-OG 3.29Å; L175-S179 VanDerWaalsContact O-OG 3.09Å
176	S	94.1	Very high	94.4	Very high	29 Å²	29	50.4 Å²	50.4	20%	0.203	25%	0.25	C	S	.	.	H	α-helix	trans	-64.4	-44	-178.8	-179.5	0	0	0	0	112.3	E105 Q172 L173 R178 S179 R180	E105-S176 WeakPolarHBondContact CG-OG 3.44Å; E105-S176 PolarHBondContact OE1-OG 3.08Å; Q172-S176 WeakPolarHBondContact O-CB 3.44Å; Q172-S176 PolarHBondContact O-N 3.12Å; L173-S176 PolarHBondContact O-N 3.05Å; S176-R178 PolarHBondContact O-N 3.17Å; S176-S179 PolarHBondContact O-N 3.47Å; S176-R180 PolarHBondContact O-N 3.42Å; S176-R180 VanDerWaalsContact O-N 3.17Å
177	F	94.6	Very high	94.5	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-46	172.9	-69.8	-12.9	0	0	0	112.2	L97 F98 E105 L173 R180 L181 V223 A224	L97-F177 HydrophobicContact CB-CD1 4.42Å; L97-F177 HydrophobicContact CD1-CD1 4.44Å; L97-F177 HydrophobicContact CD1-CD2 4.31Å; L97-F177 HydrophobicContact CD1-CG 4.23Å; L97-F177 HydrophobicContact CD2-CB 3.65Å; L97-F177 HydrophobicContact CD2-CD1 3.87Å; L97-F177 HydrophobicContact CD2-CG 3.83Å; L97-F177 HydrophobicContact CG-CD1 4.48Å; F98-F177 HydrophobicContact CE1-CE1 4.13Å; F98-F177 HydrophobicContact CE1-CZ 4.47Å; F98-F177 HydrophobicContact CE2-CE1 4.1Å; F98-F177 HydrophobicContact CE2-CZ 4.02Å; F98-F177 AromaticContact CZ-CE1 3.58Å; F98-F177 HydrophobicContact CZ-CE1 3.58Å; F98-F177 AromaticContact CZ-CZ 3.56Å; F98-F177 HydrophobicContact CZ-CZ 3.56Å; E105-F177 HydrophobicContact CB-CE1 4.32Å; E105-F177 HydrophobicContact CG-CD1 4.43Å; E105-F177 HydrophobicContact CG-CE1 4.43Å; L173-F177 HydrophobicContact CD1-CD1 4.39Å; L173-F177 HydrophobicContact CD1-CE1 3.63Å; L173-F177 HydrophobicContact CD1-CE2 4.02Å; L173-F177 HydrophobicContact CD1-CZ 3.41Å; L173-F177 VanDerWaalsContact CD1-CZ 3.41Å; L173-F177 HydrophobicContact CD2-CE2 3.79Å; L173-F177 HydrophobicContact CD2-CZ 3.84Å; L173-F177 HydrophobicContact CG-CD2 4.13Å; L173-F177 HydrophobicContact CG-CE1 4.05Å; L173-F177 HydrophobicContact CG-CE2 3.53Å; L173-F177 HydrophobicContact CG-CZ 3.48Å; L173-F177 VanDerWaalsContact CG-CZ 3.48Å; L173-F177 WeakPolarHBondContact O-CB 3.46Å; L173-F177 VanDerWaalsContact O-CG 3.26Å; L173-F177 WeakPolarHBondContact O-CG 3.35Å; L173-F177 PolarHBondContact O-N 2.7Å; F177-R180 PolarHBondContact O-N 3.18Å; F177-L181 WeakPolarHBondContact O-CG 3.35Å; F177-L181 PolarHBondContact O-N 2.67Å; F177-V223 HydrophobicContact CD2-CG1 4.38Å; F177-V223 HydrophobicContact CE2-CG1 4.02Å; F177-A224 HydrophobicContact CD2-CB 4.38Å; F177-A224 HydrophobicContact CE2-CB 4.37Å
178	R	95.2	Very high	94.5	Very high	101 Å²	101	50.5 Å²	50.5	38%	0.381	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-52.4	177.9	-178.3	-176.8	67.5	143.3	1.9	111.3	T174 L175 S176 R180 L181 V182 V217 S220	T174-R178 WeakPolarHBondContact O-CB 3.48Å; T174-R178 PolarHBondContact O-N 3.27Å; L175-R178 PolarHBondContact O-N 2.82Å; S176-R178 PolarHBondContact O-N 3.17Å; R178-R180 PolarHBondContact O-N 3.48Å; R178-L181 PolarHBondContact O-N 3.24Å; R178-V182 HydrophobicContact CG-CG2 4.03Å; R178-V182 WeakPolarHBondContact O-CB 3.29Å; R178-V182 VanDerWaalsContact O-CG2 3.3Å; R178-V182 WeakPolarHBondContact O-CG2 3.04Å; R178-V182 PolarHBondContact O-N 3.44Å; R178-V217 HydrophobicContact CG-CG2 4.44Å; R178-S220 WeakPolarHBondContact CA-OG 3.5Å; R178-S220 PolarHBondContact N-OG 3.45Å
179	S	94.4	Very high	94.5	Very high	57 Å²	57	46.3 Å²	46.3	40%	0.399	24%	0.238	S	C	.	.	H	α-helix	trans	-57.4	-39.4	-177	-65.2	0	0	0	0	111.9	L175 S176 S183	L175-S179 PolarHBondContact O-N 3.07Å; L175-S179 PolarHBondContact O-OG 3.29Å; L175-S179 VanDerWaalsContact O-OG 3.09Å; S176-S179 PolarHBondContact O-N 3.47Å; S179-S183 WeakPolarHBondContact O-CB 3.42Å; S179-S183 PolarHBondContact O-N 3.24Å; S179-S183 PolarHBondContact O-OG 3.32Å
180	R	92.9	Very high	94.4	Very high	63 Å²	63	52 Å²	52	24%	0.238	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-49.2	177	-179.2	165.2	-69.6	153.3	2.2	112.7	L96 L97 E105 S176 F177 R178 V182 S183 H184	L96-R180 WeakPolarHBondContact O-CD 3.37Å; L97-R180 PolarHBondContact O-NH1 2.99Å; E105-R180 IonicContact OE1-CZ 3.87Å; E105-R180 IonicContact OE1-NH1 3.62Å; E105-R180 PolarHBondContact OE1-NH1 2.75Å; E105-R180 IonicContact OE1-NH2 3.86Å; E105-R180 PolarHBondContact OE1-NH2 3.06Å; E105-R180 IonicContact OE2-CZ 3.99Å; E105-R180 IonicContact OE2-NH1 3Å; E105-R180 PolarHBondContact OE2-NH1 3.43Å; E105-R180 IonicContact OE2-NH2 2.7Å; E105-R180 PolarHBondContact OE2-NH2 3.2Å; S176-R180 PolarHBondContact O-N 3.42Å; S176-R180 VanDerWaalsContact O-N 3.17Å; F177-R180 PolarHBondContact O-N 3.18Å; R178-R180 PolarHBondContact O-N 3.48Å; R180-V182 PolarHBondContact O-N 3.14Å; R180-S183 PolarHBondContact O-N 2.97Å; R180-H184 PolarHBondContact O-N 3.15Å
181	L	94.4	Very high	94.3	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-41.7	-179.7	-72.2	175.3	0	0	0	112	L96 L97 F177 R178 H184 A185 I216 F219 F438	L96-L181 HydrophobicContact CB-CD2 4.25Å; L97-L181 HydrophobicContact CD2-CD1 3.8Å; L97-L181 HydrophobicContact CD2-CD2 4.05Å; L97-L181 HydrophobicContact CD2-CG 3.66Å; L97-L181 HydrophobicContact CG-CD2 4.48Å; F177-L181 WeakPolarHBondContact O-CG 3.35Å; F177-L181 PolarHBondContact O-N 2.67Å; R178-L181 PolarHBondContact O-N 3.24Å; L181-H184 PolarHBondContact O-N 3.11Å; L181-A185 VanDerWaalsContact O-CB 3.25Å; L181-A185 WeakPolarHBondContact O-CB 3.27Å; L181-A185 PolarHBondContact O-N 3.01Å; L181-I216 HydrophobicContact CB-CG2 3.63Å; L181-I216 HydrophobicContact CD1-CG2 4.18Å; L181-F219 HydrophobicContact CD1-CD1 3.57Å; L181-F219 HydrophobicContact CD1-CE1 3.71Å; L181-F438 HydrophobicContact CD2-CE2 4.29Å; L181-F438 HydrophobicContact CD2-CZ 4.35Å
182	V	94.9	Very high	94	Very high	27 Å²	27	57 Å²	57	16%	0.164	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-45.5	176.7	172.2	0	0	0	0	110.7	R178 R180 H184 A185 Y186 I216	R178-V182 HydrophobicContact CG-CG2 4.03Å; R178-V182 WeakPolarHBondContact O-CB 3.29Å; R178-V182 VanDerWaalsContact O-CG2 3.3Å; R178-V182 WeakPolarHBondContact O-CG2 3.04Å; R178-V182 PolarHBondContact O-N 3.44Å; R180-V182 PolarHBondContact O-N 3.14Å; V182-H184 VanDerWaalsContact C-N 3.32Å; V182-H184 PolarHBondContact O-N 3.1Å; V182-A185 PolarHBondContact O-N 2.97Å; V182-Y186 HydrophobicContact CG1-CD1 4.37Å; V182-Y186 HydrophobicContact CG1-CD2 3.78Å; V182-Y186 HydrophobicContact CG1-CE1 4.05Å; V182-Y186 HydrophobicContact CG1-CE2 3.4Å; V182-Y186 HydrophobicContact CG1-CG 4.26Å; V182-Y186 WeakPolarHBondContact O-CB 3.31Å; V182-Y186 PolarHBondContact O-N 3.49Å; V182-I216 HydrophobicContact CG2-CD1 4.37Å; V182-I216 HydrophobicContact CG2-CG2 3.84Å
183	S	94.1	Very high	93.8	Very high	65 Å²	65	56.7 Å²	56.7	46%	0.455	28%	0.281	S	S	.	.	H	α-helix	trans	-59.3	-44.5	178	-59.4	0	0	0	0	111.7	S179 R180 Q187	S179-S183 WeakPolarHBondContact O-CB 3.42Å; S179-S183 PolarHBondContact O-N 3.24Å; S179-S183 PolarHBondContact O-OG 3.32Å; R180-S183 PolarHBondContact O-N 2.97Å; S183-Q187 VanDerWaalsContact O-CG 3.31Å; S183-Q187 WeakPolarHBondContact O-CG 3.42Å; S183-Q187 PolarHBondContact O-N 3.07Å; S183-Q187 VanDerWaalsContact O-N 3.08Å
184	H	93.9	Very high	93.6	Very high	58 Å²	58	56.6 Å²	56.6	27%	0.269	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176.6	-174.5	57.1	0	0	0	112.3	R180 L181 V182 Q187 L188 F438	R180-H184 PolarHBondContact O-N 3.15Å; L181-H184 PolarHBondContact O-N 3.11Å; V182-H184 VanDerWaalsContact C-N 3.32Å; V182-H184 PolarHBondContact O-N 3.1Å; H184-Q187 PolarHBondContact O-N 3.14Å; H184-L188 PolarHBondContact O-N 3.19Å; H184-L188 VanDerWaalsContact O-N 3.09Å; H184-F438 AromaticContact CD2-CE1 3.54Å
185	A	94.2	Very high	93.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-41.9	178	0	0	0	0	0	112.1	L181 V182 L188 Y189 L212 I216 M437 F438	L181-A185 VanDerWaalsContact O-CB 3.25Å; L181-A185 WeakPolarHBondContact O-CB 3.27Å; L181-A185 PolarHBondContact O-N 3.01Å; V182-A185 PolarHBondContact O-N 2.97Å; A185-L188 PolarHBondContact O-N 3.28Å; A185-Y189 WeakPolarHBondContact O-CB 3.49Å; A185-Y189 PolarHBondContact O-N 2.81Å; A185-L212 HydrophobicContact CB-CD2 3.61Å; A185-I216 HydrophobicContact CB-CD1 3.86Å; A185-M437 HydrophobicContact CB-CE 4.16Å; A185-F438 HydrophobicContact CB-CE1 3.75Å; A185-F438 HydrophobicContact CB-CZ 4.01Å
186	Y	94.9	Very high	93.3	Very high	114 Å²	114	58.3 Å²	58.3	45%	0.447	28%	0.28	S	S	.	.	H	α-helix	trans	-65.7	-43.6	176.5	-72.1	-10.9	0	0	0	112.4	V182 L188 Y189 F190 L212	V182-Y186 HydrophobicContact CG1-CD1 4.37Å; V182-Y186 HydrophobicContact CG1-CD2 3.78Å; V182-Y186 HydrophobicContact CG1-CE1 4.05Å; V182-Y186 HydrophobicContact CG1-CE2 3.4Å; V182-Y186 HydrophobicContact CG1-CG 4.26Å; V182-Y186 WeakPolarHBondContact O-CB 3.31Å; V182-Y186 PolarHBondContact O-N 3.49Å; Y186-L188 VanDerWaalsContact C-N 3.29Å; Y186-L188 PolarHBondContact O-N 3.39Å; Y186-Y189 PolarHBondContact O-N 2.91Å; Y186-F190 WeakPolarHBondContact O-CD2 3.4Å; Y186-F190 PolarHBondContact O-N 3.33Å; Y186-L212 HydrophobicContact CD1-CD2 4.25Å; Y186-L212 HydrophobicContact CE1-CD2 4.29Å
187	Q	94.3	Very high	93.1	Very high	131 Å²	131	58.8 Å²	58.8	61%	0.612	28%	0.277	S	S	*	.	H	α-helix	trans	-55.6	-47.8	174.4	-75.2	173.7	-9.1	0	0	111.1	S183 H184 T191	S183-Q187 VanDerWaalsContact O-CG 3.31Å; S183-Q187 WeakPolarHBondContact O-CG 3.42Å; S183-Q187 PolarHBondContact O-N 3.07Å; S183-Q187 VanDerWaalsContact O-N 3.08Å; H184-Q187 PolarHBondContact O-N 3.14Å; Q187-T191 WeakPolarHBondContact O-CB 3.35Å; Q187-T191 PolarHBondContact O-N 2.87Å; Q187-T191 VanDerWaalsContact O-N 3.09Å; Q187-T191 PolarHBondContact O-OG1 3.3Å
188	L	93.3	Very high	92.8	Very high	24 Å²	24	58.7 Å²	58.7	13%	0.126	28%	0.276	C	S	.	.	H	α-helix	trans	-69.3	-39.5	-179.6	-167.7	66.5	0	0	0	112.5	H184 A185 Y186 F190 T191 F438 F441 E442	H184-L188 PolarHBondContact O-N 3.19Å; H184-L188 VanDerWaalsContact O-N 3.09Å; A185-L188 PolarHBondContact O-N 3.28Å; Y186-L188 VanDerWaalsContact C-N 3.29Å; Y186-L188 PolarHBondContact O-N 3.39Å; L188-F190 PolarHBondContact O-N 3.22Å; L188-T191 PolarHBondContact O-N 2.91Å; L188-F438 HydrophobicContact CD2-CD1 4.16Å; L188-F441 HydrophobicContact CD2-CB 3.35Å; L188-F441 HydrophobicContact CD2-CD2 4.25Å; L188-F441 HydrophobicContact CD2-CG 4.33Å; L188-F441 HydrophobicContact CG-CB 3.73Å; L188-F441 HydrophobicContact CG-CD2 4.47Å; L188-E442 HydrophobicContact CD1-CG 4.24Å; L188-E442 HydrophobicContact CD2-CG 3.83Å
189	Y	94.1	Very high	92.4	Very high	44 Å²	44	57.7 Å²	57.7	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-35.8	-179.8	-172.4	-113.8	0	0	0	113	A185 Y186 T194 Y195 I198 L212 F441	A185-Y189 WeakPolarHBondContact O-CB 3.49Å; A185-Y189 PolarHBondContact O-N 2.81Å; Y186-Y189 PolarHBondContact O-N 2.91Å; Y189-T194 CarbonylContact O-C 3.46Å; Y189-T194 WeakPolarHBondContact O-CB 3.3Å; Y189-Y195 PolarHBondContact O-N 3.1Å; Y189-I198 HydrophobicContact CD2-CD1 3.82Å; Y189-I198 HydrophobicContact CE2-CD1 3.9Å; Y189-L212 HydrophobicContact CD1-CD1 4.21Å; Y189-L212 HydrophobicContact CD2-CD1 4.14Å; Y189-L212 HydrophobicContact CE1-CD1 4.27Å; Y189-L212 HydrophobicContact CE2-CD1 4.2Å; Y189-L212 HydrophobicContact CG-CD1 4.14Å; Y189-F441 HydrophobicContact CD2-CD2 4.36Å; Y189-F441 HydrophobicContact CD2-CE1 4.16Å; Y189-F441 AromaticContact CD2-CE2 3.7Å; Y189-F441 HydrophobicContact CD2-CE2 3.7Å; Y189-F441 AromaticContact CD2-CZ 3.56Å; Y189-F441 HydrophobicContact CD2-CZ 3.56Å; Y189-F441 HydrophobicContact CE2-CZ 4.13Å; Y189-F441 HydrophobicContact CG-CE2 4.21Å; Y189-F441 HydrophobicContact CG-CZ 4.45Å
190	F	93.1	Very high	92	Very high	132 Å²	132	58.3 Å²	58.3	58%	0.579	28%	0.284	S	S	*	.	H	α-helix	trans	-92.1	-10.5	178.3	-75.3	-77.2	0	0	0	114.3	Y186 L188 Y195	Y186-F190 WeakPolarHBondContact O-CD2 3.4Å; Y186-F190 PolarHBondContact O-N 3.33Å; L188-F190 PolarHBondContact O-N 3.22Å; F190-Y195 AromaticContact CD1-CD1 3.94Å; F190-Y195 HydrophobicContact CD1-CD1 3.94Å; F190-Y195 HydrophobicContact CD1-CE1 4.33Å; F190-Y195 HydrophobicContact CE1-CD1 4.3Å
191	T	92.9	Very high	91.4	Very high	64 Å²	64	55.5 Å²	55.5	39%	0.393	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-68.2	135.9	174.2	-64.1	0	0	0	0	110.7	Q187 L188 Q193 T194	Q187-T191 WeakPolarHBondContact O-CB 3.35Å; Q187-T191 PolarHBondContact O-N 2.87Å; Q187-T191 VanDerWaalsContact O-N 3.09Å; Q187-T191 PolarHBondContact O-OG1 3.3Å; L188-T191 PolarHBondContact O-N 2.91Å; T191-Q193 PolarHBondContact O-N 2.96Å; T191-Q193 VanDerWaalsContact O-N 3.11Å; T191-T194 WeakPolarHBondContact O-CB 3.46Å; T191-T194 PolarHBondContact O-N 3.2Å; T191-T194 PolarHBondContact O-OG1 3.16Å
192	N	88.3	Confident	90.9	Very high	99 Å²	99	55.8 Å²	55.8	53%	0.529	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	50.6	35.7	175.3	-66.7	-16.6	0	0	0	115	T194 S445	N192-T194 PolarHBondContact O-N 3.22Å; N192-S445 PolarHBondContact ND2-O 2.95Å
193	Q	90.3	Very high	90.1	Very high	70 Å²	70	56 Å²	56	33%	0.327	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	57.2	30.3	-179.2	-54.5	166.5	-10.4	0	0	113.2	T191 Y195 Y196 R197	T191-Q193 PolarHBondContact O-N 2.96Å; T191-Q193 VanDerWaalsContact O-N 3.11Å; Q193-Y195 HydrophobicContact CB-CE1 4.3Å; Q193-Y195 PolarHBondContact O-N 2.89Å; Q193-Y196 PolarHBondContact O-N 3.42Å; Q193-R197 PolarHBondContact O-N 3.42Å
194	T	91.3	Very high	89.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.6	-35.8	-176.4	-68.3	0	0	0	0	112	Y189 T191 N192 Y196 R197 I198 F441 V444	Y189-T194 CarbonylContact O-C 3.46Å; Y189-T194 WeakPolarHBondContact O-CB 3.3Å; T191-T194 WeakPolarHBondContact O-CB 3.46Å; T191-T194 PolarHBondContact O-N 3.2Å; T191-T194 PolarHBondContact O-OG1 3.16Å; N192-T194 PolarHBondContact O-N 3.22Å; T194-Y196 VanDerWaalsContact C-N 3.32Å; T194-Y196 PolarHBondContact O-N 2.86Å; T194-R197 PolarHBondContact O-N 2.81Å; T194-R197 VanDerWaalsContact O-N 3.14Å; T194-I198 HydrophobicContact CG2-CD1 3.3Å; T194-I198 HydrophobicContact CG2-CG1 3.88Å; T194-I198 WeakPolarHBondContact O-CD1 3.36Å; T194-I198 VanDerWaalsContact O-CG1 3.28Å; T194-I198 WeakPolarHBondContact O-CG1 3.24Å; T194-I198 PolarHBondContact O-N 3.21Å; T194-F441 HydrophobicContact CG2-CB 4.33Å; T194-V444 HydrophobicContact CG2-CB 4.33Å; T194-V444 HydrophobicContact CG2-CG1 4Å
195	Y	92	Very high	88.9	Confident	100 Å²	100	53.6 Å²	53.6	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-52.7	-42.8	173.4	70.8	-89.5	0	0	0	114.1	Y189 F190 Q193	Y189-Y195 PolarHBondContact O-N 3.1Å; F190-Y195 AromaticContact CD1-CD1 3.94Å; F190-Y195 HydrophobicContact CD1-CD1 3.94Å; F190-Y195 HydrophobicContact CD1-CE1 4.33Å; F190-Y195 HydrophobicContact CE1-CD1 4.3Å; Q193-Y195 HydrophobicContact CB-CE1 4.3Å; Q193-Y195 PolarHBondContact O-N 2.89Å
196	Y	91.4	Very high	87.7	Confident	42 Å²	42	58.7 Å²	58.7	17%	0.165	30%	0.299	C	S	.	.	H	α-helix	trans	-72	-44.3	177.5	171.5	-93.5	0	0	0	110.7	Q193 T194 S199 N200 L538 W539	Q193-Y196 PolarHBondContact O-N 3.42Å; T194-Y196 VanDerWaalsContact C-N 3.32Å; T194-Y196 PolarHBondContact O-N 2.86Å; Y196-S199 PolarHBondContact O-N 2.77Å; Y196-N200 WeakPolarHBondContact CD2-ND2 3.47Å; Y196-N200 HydrophobicContact CE1-CB 4.35Å; Y196-N200 HydrophobicContact CE2-CB 4.35Å; Y196-N200 WeakPolarHBondContact CE2-ND2 2.81Å; Y196-N200 WeakPolarHBondContact O-CB 3.48Å; Y196-N200 PolarHBondContact O-N 2.92Å; Y196-N200 PolarHBondContact O-ND2 3.03Å; Y196-L538 HydrophobicContact CD1-CB 4.41Å; Y196-L538 HydrophobicContact CD1-CD2 4.03Å; Y196-L538 HydrophobicContact CD2-CD2 4.45Å; Y196-L538 HydrophobicContact CE1-CB 3.89Å; Y196-L538 HydrophobicContact CE1-CD2 4.23Å; Y196-L538 HydrophobicContact CG-CD2 4.17Å; Y196-W539 PolarHBondContact OH-NE1 3.1Å; Y196-W539 VanDerWaalsContact OH-NE1 3.13Å
197	R	89.6	Confident	86.9	Confident	38 Å²	38	55.3 Å²	55.3	14%	0.143	29%	0.289	C	S	.	.	H	α-helix	trans	-69.2	-36.8	-173.2	-67	176.7	174.7	-178.7	4.3	112.5	Q193 T194 M201 D202 V444 Y449	Q193-R197 PolarHBondContact O-N 3.42Å; T194-R197 PolarHBondContact O-N 2.81Å; T194-R197 VanDerWaalsContact O-N 3.14Å; R197-M201 HydrophobicContact CB-SD 4.25Å; R197-M201 HydrophobicContact CG-SD 3.9Å; R197-M201 WeakPolarHBondContact O-CA 3.5Å; R197-M201 WeakPolarHBondContact O-CB 3.4Å; R197-M201 PolarHBondContact O-N 3.35Å; R197-D202 PolarHBondContact O-N 3.2Å; R197-V444 HydrophobicContact CB-CG1 3.34Å; R197-V444 HydrophobicContact CG-CG1 4.4Å; R197-Y449 HydrophobicContact CB-CE1 4.08Å; R197-Y449 WeakPolarHBondContact CD-OH 3.11Å; R197-Y449 HydrophobicContact CG-CE1 4.38Å
198	I	89.4	Confident	86.4	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-43.9	176.6	-67.4	155.5	0	0	0	111	Y189 T194 L205 P208 F441 V444	Y189-I198 HydrophobicContact CD2-CD1 3.82Å; Y189-I198 HydrophobicContact CE2-CD1 3.9Å; T194-I198 HydrophobicContact CG2-CD1 3.3Å; T194-I198 HydrophobicContact CG2-CG1 3.88Å; T194-I198 WeakPolarHBondContact O-CD1 3.36Å; T194-I198 VanDerWaalsContact O-CG1 3.28Å; T194-I198 WeakPolarHBondContact O-CG1 3.24Å; T194-I198 PolarHBondContact O-N 3.21Å; I198-L205 HydrophobicContact CG2-CB 4.38Å; I198-L205 HydrophobicContact CG2-CD1 4.16Å; I198-P208 HydrophobicContact CG2-CB 4.18Å; I198-P208 HydrophobicContact CG2-CG 4.3Å; I198-F441 HydrophobicContact CD1-CD1 3.17Å; I198-F441 HydrophobicContact CD1-CE1 3.29Å; I198-F441 HydrophobicContact CD1-CG 3.91Å; I198-F441 HydrophobicContact CD1-CZ 4.1Å; I198-F441 HydrophobicContact CG1-CD1 4.1Å; I198-F441 HydrophobicContact CG1-CE1 4.34Å; I198-V444 HydrophobicContact CG1-CB 4.23Å; I198-V444 HydrophobicContact CG1-CG1 4.04Å; I198-V444 HydrophobicContact CG1-CG2 4.12Å
199	S	86.1	Confident	85.9	Confident	81 Å²	81	53.5 Å²	53.5	57%	0.566	28%	0.284	S	S	*	.	H	α-helix	trans	-76.4	-34.9	-175.5	-179	0	0	0	0	112.9	Y196	Y196-S199 PolarHBondContact O-N 2.77Å
200	N	85.6	Confident	85.4	Confident	70 Å²	70	53.6 Å²	53.6	37%	0.374	29%	0.286	S	S	.	.	H	α-helix	trans	-105.1	-28.8	-172	-65.7	-56.4	0	0	0	114.3	Y196 R451	Y196-N200 WeakPolarHBondContact CD2-ND2 3.47Å; Y196-N200 HydrophobicContact CE1-CB 4.35Å; Y196-N200 HydrophobicContact CE2-CB 4.35Å; Y196-N200 WeakPolarHBondContact CE2-ND2 2.81Å; Y196-N200 WeakPolarHBondContact O-CB 3.48Å; Y196-N200 PolarHBondContact O-N 2.92Å; Y196-N200 PolarHBondContact O-ND2 3.03Å; N200-R451 PolarHBondContact O-NH2 3.47Å
201	M	82.4	Confident	85.1	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.02	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-48.6	-174.3	-57.6	-175.2	63.8	0	0	112.9	R197 Y449 R451 P499 P540	R197-M201 HydrophobicContact CB-SD 4.25Å; R197-M201 HydrophobicContact CG-SD 3.9Å; R197-M201 WeakPolarHBondContact O-CA 3.5Å; R197-M201 WeakPolarHBondContact O-CB 3.4Å; R197-M201 PolarHBondContact O-N 3.35Å; M201-Y449 HydrophobicContact CB-CD1 3.85Å; M201-Y449 HydrophobicContact CB-CE1 4.16Å; M201-Y449 HydrophobicContact CB-CG 4.34Å; M201-Y449 HydrophobicContact CE-CD1 4.08Å; M201-Y449 HydrophobicContact CE-CD2 3.67Å; M201-Y449 HydrophobicContact CE-CE1 3.82Å; M201-Y449 HydrophobicContact CE-CE2 3.38Å; M201-Y449 HydrophobicContact CE-CG 4.01Å; M201-Y449 VanDerWaalsContact CE-CZ 3.46Å; M201-Y449 HydrophobicContact SD-CD1 4.42Å; M201-Y449 HydrophobicContact SD-CE1 3.86Å; M201-Y449 HydrophobicContact SD-CE2 4.37Å; M201-R451 PolarHBondContact O-NE 3.47Å; M201-P499 HydrophobicContact CG-CG 4.46Å; M201-P540 HydrophobicContact CE-CG 3.75Å
202	D	83.1	Confident	84.8	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.037	25%	0.247	C	C	.	.			trans	-84	152.2	176.8	-157.5	-78.3	0	0	0	110.9	R197 R204 V444 R450	R197-D202 PolarHBondContact O-N 3.2Å; D202-R204 WeakPolarHBondContact OD1-CB 3.44Å; D202-R204 VanDerWaalsContact OD1-CG 3.3Å; D202-R204 WeakPolarHBondContact OD1-CG 3.5Å; D202-R204 IonicContact OD1-CZ 3.72Å; D202-R204 PolarHBondContact OD1-N 3.14Å; D202-R204 IonicContact OD1-NE 3.89Å; D202-R204 PolarHBondContact OD1-NE 3.4Å; D202-R204 IonicContact OD2-CZ 2.91Å; D202-R204 IonicContact OD2-NE 3.72Å; D202-R204 PolarHBondContact OD2-NE 2.84Å; D202-R204 IonicContact OD2-NH2 3.55Å; D202-R204 PolarHBondContact OD2-NH2 3.12Å; D202-V444 HydrophobicContact CB-CG2 3.9Å; D202-R450 VanDerWaalsContact CG-O 3.22Å; D202-R450 PolarHBondContact OD2-N 2.82Å
203	G	77.1	Confident	84.8	Confident	32 Å²	32	44.5 Å²	44.5	33%	0.33	25%	0.245	S	C	.	.			trans	-128.5	13.7	-179.4	0	0	0	0	0	113.7	R450 S452	G203-R450 PolarHBondContact N-O 3.41Å; G203-R450 VanDerWaalsContact N-O 3.11Å; G203-S452 PolarHBondContact O-OG 2.92Å
204	R	82.8	Confident	84.7	Confident	49 Å²	49	44 Å²	44	19%	0.185	24%	0.243	C	C	.	.	S	Bend	trans	-79.9	-39.4	-179.5	-66.9	178.4	-76.7	176	-8.5	112.4	D202 V440 D443 R450	D202-R204 WeakPolarHBondContact OD1-CB 3.44Å; D202-R204 VanDerWaalsContact OD1-CG 3.3Å; D202-R204 WeakPolarHBondContact OD1-CG 3.5Å; D202-R204 IonicContact OD1-CZ 3.72Å; D202-R204 PolarHBondContact OD1-N 3.14Å; D202-R204 IonicContact OD1-NE 3.89Å; D202-R204 PolarHBondContact OD1-NE 3.4Å; D202-R204 IonicContact OD2-CZ 2.91Å; D202-R204 IonicContact OD2-NE 3.72Å; D202-R204 PolarHBondContact OD2-NE 2.84Å; D202-R204 IonicContact OD2-NH2 3.55Å; D202-R204 PolarHBondContact OD2-NH2 3.12Å; R204-V440 HydrophobicContact CB-CG2 4.1Å; R204-D443 IonicContact CZ-OD2 2.74Å; R204-D443 IonicContact NH1-OD2 2.9Å; R204-D443 PolarHBondContact NH1-OD2 3.07Å; R204-D443 IonicContact NH2-OD2 3.97Å; R204-D443 PolarHBondContact NH2-OD2 3.5Å; R204-R450 HydrophobicContact CG-CB 4.28Å
205	L	81.3	Confident	84.6	Confident	22 Å²	22	44.3 Å²	44.3	12%	0.115	24%	0.244	C	C	.	.			trans	-97.3	116.3	176.3	-64.2	174.6	0	0	0	109.4	I198 E436 M437 V440 F441	I198-L205 HydrophobicContact CG2-CB 4.38Å; I198-L205 HydrophobicContact CG2-CD1 4.16Å; L205-E436 HydrophobicContact CD2-CG 4.31Å; L205-M437 HydrophobicContact CD1-CG 4.38Å; L205-V440 HydrophobicContact CD1-CB 3.74Å; L205-V440 HydrophobicContact CD1-CG1 3.6Å; L205-V440 HydrophobicContact CD1-CG2 4.24Å; L205-V440 HydrophobicContact CD2-CG2 4.42Å; L205-V440 HydrophobicContact CG-CB 4.06Å; L205-V440 HydrophobicContact CG-CG1 3.91Å; L205-V440 HydrophobicContact CG-CG2 4.01Å; L205-F441 HydrophobicContact CD1-CD1 4.06Å; L205-F441 HydrophobicContact CD1-CE1 3.7Å
206	S	68.9	Low	84.7	Confident	107 Å²	107	39.6 Å²	39.6	75%	0.748	23%	0.226	S	C	*	.	S	Bend	trans	-74.7	-43.1	175.8	57.6	0	0	0	0	112.3
207	N	77.1	Confident	84.8	Confident	44 Å²	44	40.2 Å²	40.2	24%	0.235	23%	0.234	C	C	.	.			trans	-131.1	82.6	-174.2	-60.9	-20.6	0	0	0	110.5	D209 Q210 S211	N207-D209 VanDerWaalsContact C-N 3.28Å; N207-D209 VanDerWaalsContact C-OD1 3.25Å; N207-D209 WeakPolarHBondContact CA-OD1 3.37Å; N207-D209 WeakPolarHBondContact CB-OD1 3.43Å; N207-D209 PolarHBondContact O-N 3.3Å; N207-Q210 HydrophobicContact CB-CB 3.93Å; N207-Q210 PolarHBondContact O-N 3.26Å; N207-S211 PolarHBondContact O-N 3.13Å; N207-S211 PolarHBondContact O-OG 3.15Å; N207-S211 VanDerWaalsContact O-OG 3.1Å
208	P	83.8	Confident	84.9	Confident	16 Å²	16	42.5 Å²	42.5	10%	0.104	25%	0.247	C	C	.	.	H	α-helix	trans	-67.6	-29.6	179.5	27.1	-33.6	0	0	0	112.6	I198 S211 L212	I198-P208 HydrophobicContact CG2-CB 4.18Å; I198-P208 HydrophobicContact CG2-CG 4.3Å; P208-S211 WeakPolarHBondContact O-CB 3.45Å; P208-S211 PolarHBondContact O-N 2.7Å; P208-L212 WeakPolarHBondContact O-CB 3.31Å; P208-L212 WeakPolarHBondContact O-CG 3.36Å; P208-L212 PolarHBondContact O-N 3.43Å
209	D	83.9	Confident	85.2	Confident	100 Å²	100	42.4 Å²	42.4	54%	0.535	25%	0.247	S	C	.	.	H	α-helix	trans	-59.7	-47.9	173.9	62	-36.7	0	0	0	112.1	N207 S211 L212 T213	N207-D209 VanDerWaalsContact C-N 3.28Å; N207-D209 VanDerWaalsContact C-OD1 3.25Å; N207-D209 WeakPolarHBondContact CA-OD1 3.37Å; N207-D209 WeakPolarHBondContact CB-OD1 3.43Å; N207-D209 PolarHBondContact O-N 3.3Å; D209-S211 VanDerWaalsContact C-N 3.29Å; D209-S211 PolarHBondContact O-N 2.98Å; D209-L212 PolarHBondContact O-N 2.97Å; D209-T213 WeakPolarHBondContact O-CB 3.33Å; D209-T213 WeakPolarHBondContact O-CG2 3.34Å; D209-T213 PolarHBondContact O-N 3.26Å; D209-T213 PolarHBondContact O-OG1 2.63Å
210	Q	83.7	Confident	85.6	Confident	46 Å²	46	38.6 Å²	38.6	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-39.5	175.9	-174.2	178.3	9.2	0	0	111.2	N207 T213 E214 D215	N207-Q210 HydrophobicContact CB-CB 3.93Å; N207-Q210 PolarHBondContact O-N 3.26Å; Q210-T213 PolarHBondContact O-N 2.72Å; Q210-E214 HydrophobicContact CG-CB 4.32Å; Q210-E214 HydrophobicContact CG-CG 4.44Å; Q210-E214 PolarHBondContact NE2-OE2 2.89Å; Q210-E214 VanDerWaalsContact NE2-OE2 3.13Å; Q210-E214 WeakPolarHBondContact O-CB 3.29Å; Q210-E214 PolarHBondContact O-N 3.38Å; Q210-D215 PolarHBondContact O-N 3.04Å
211	S	85.4	Confident	86	Confident	12 Å²	12	36.9 Å²	36.9	8%	0.084	22%	0.216	C	C	.	.	I	π-helix	trans	-64	-43.3	179.5	-56	0	0	0	0	111.2	N207 P208 D209 I216 M437	N207-S211 PolarHBondContact O-N 3.13Å; N207-S211 PolarHBondContact O-OG 3.15Å; N207-S211 VanDerWaalsContact O-OG 3.1Å; P208-S211 WeakPolarHBondContact O-CB 3.45Å; P208-S211 PolarHBondContact O-N 2.7Å; D209-S211 VanDerWaalsContact C-N 3.29Å; D209-S211 PolarHBondContact O-N 2.98Å; S211-I216 PolarHBondContact O-N 3.11Å; S211-M437 VanDerWaalsContact CB-SD 3.58Å
212	L	88.5	Confident	86.6	Confident	12 Å²	12	38 Å²	38	6%	0.063	22%	0.224	C	C	.	.	I	π-helix	trans	-69.2	-37	178.5	-78.1	168	0	0	0	113.4	A185 Y186 Y189 P208 D209 I216 M437 F441	A185-L212 HydrophobicContact CB-CD2 3.61Å; Y186-L212 HydrophobicContact CD1-CD2 4.25Å; Y186-L212 HydrophobicContact CE1-CD2 4.29Å; Y189-L212 HydrophobicContact CD1-CD1 4.21Å; Y189-L212 HydrophobicContact CD2-CD1 4.14Å; Y189-L212 HydrophobicContact CE1-CD1 4.27Å; Y189-L212 HydrophobicContact CE2-CD1 4.2Å; Y189-L212 HydrophobicContact CG-CD1 4.14Å; P208-L212 WeakPolarHBondContact O-CB 3.31Å; P208-L212 WeakPolarHBondContact O-CG 3.36Å; P208-L212 PolarHBondContact O-N 3.43Å; D209-L212 PolarHBondContact O-N 2.97Å; L212-I216 HydrophobicContact CD2-CD1 4.28Å; L212-M437 HydrophobicContact CD2-SD 4.05Å; L212-M437 HydrophobicContact CG-SD 4.11Å; L212-F441 HydrophobicContact CD1-CZ 4.26Å; L212-F441 HydrophobicContact CD2-CE2 4.02Å; L212-F441 HydrophobicContact CD2-CZ 4.35Å; L212-F441 HydrophobicContact CG-CE2 4.4Å; L212-F441 HydrophobicContact CG-CZ 4.23Å
213	T	87.4	Confident	87.1	Confident	81 Å²	81	38.5 Å²	38.5	50%	0.497	23%	0.227	S	C	.	.	I	π-helix	trans	-96.5	-41	-170.7	54.8	0	0	0	0	113.9	D209 Q210 V217	D209-T213 WeakPolarHBondContact O-CB 3.33Å; D209-T213 WeakPolarHBondContact O-CG2 3.34Å; D209-T213 PolarHBondContact O-N 3.26Å; D209-T213 PolarHBondContact O-OG1 2.63Å; Q210-T213 PolarHBondContact O-N 2.72Å; T213-V217 WeakPolarHBondContact O-CG2 3.43Å
214	E	88.4	Confident	87.9	Confident	59 Å²	59	37 Å²	37	28%	0.276	21%	0.212	S	C	.	.	I	π-helix	trans	-103.3	-46.9	-175.3	-63.9	-165.9	142.5	0	0	112.5	Q210 V217 M218 R295	Q210-E214 HydrophobicContact CG-CB 4.32Å; Q210-E214 HydrophobicContact CG-CG 4.44Å; Q210-E214 PolarHBondContact NE2-OE2 2.89Å; Q210-E214 VanDerWaalsContact NE2-OE2 3.13Å; Q210-E214 WeakPolarHBondContact O-CB 3.29Å; Q210-E214 PolarHBondContact O-N 3.38Å; E214-V217 WeakPolarHBondContact O-CB 3.35Å; E214-V217 PolarHBondContact O-N 2.87Å; E214-M218 WeakPolarHBondContact O-CG 3.18Å; E214-M218 PolarHBondContact O-N 2.97Å; E214-R295 IonicContact OE1-CZ 2.94Å; E214-R295 IonicContact OE1-NH1 3.81Å; E214-R295 PolarHBondContact OE1-NH1 3.09Å; E214-R295 IonicContact OE1-NH2 3.36Å; E214-R295 PolarHBondContact OE1-NH2 3.45Å; E214-R295 IonicContact OE2-CZ 3.85Å; E214-R295 IonicContact OE2-NH1 3.26Å; E214-R295 PolarHBondContact OE2-NH1 2.64Å; E214-R295 IonicContact OE2-NH2 2.81Å
215	D	89.8	Confident	88.3	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.037	22%	0.216	C	C	.	.	I	π-helix	trans	-69.7	-38.8	-171.4	-76.3	-33.1	0	0	0	112.5	Q210 V217 M218 F219 R433 V434	Q210-D215 PolarHBondContact O-N 3.04Å; D215-V217 VanDerWaalsContact C-N 3.31Å; D215-V217 PolarHBondContact O-N 3.15Å; D215-M218 PolarHBondContact O-N 3.22Å; D215-F219 WeakPolarHBondContact O-CB 3.33Å; D215-F219 PolarHBondContact O-N 3.06Å; D215-R433 IonicContact OD1-CZ 3.47Å; D215-R433 VanDerWaalsContact OD1-CZ 3.25Å; D215-R433 IonicContact OD1-NE 2.82Å; D215-R433 PolarHBondContact OD1-NE 3.16Å; D215-R433 IonicContact OD1-NH2 2.76Å; D215-R433 PolarHBondContact OD1-NH2 3.4Å; D215-R433 WeakPolarHBondContact OD2-CB 3.38Å; D215-R433 WeakPolarHBondContact OD2-CD 3.25Å; D215-R433 IonicContact OD2-CZ 3.57Å; D215-R433 IonicContact OD2-NE 3.37Å; D215-R433 PolarHBondContact OD2-NE 3.38Å; D215-V434 HydrophobicContact CB-CG2 4Å
216	I	93.4	Very high	88.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-40.1	172.9	-63.1	175.4	0	0	0	111	L181 V182 A185 S211 L212 S220 V434 M437	L181-I216 HydrophobicContact CB-CG2 3.63Å; L181-I216 HydrophobicContact CD1-CG2 4.18Å; V182-I216 HydrophobicContact CG2-CD1 4.37Å; V182-I216 HydrophobicContact CG2-CG2 3.84Å; A185-I216 HydrophobicContact CB-CD1 3.86Å; S211-I216 PolarHBondContact O-N 3.11Å; L212-I216 HydrophobicContact CD2-CD1 4.28Å; I216-S220 WeakPolarHBondContact O-CB 3.48Å; I216-S220 PolarHBondContact O-N 3.38Å; I216-S220 PolarHBondContact O-OG 3.08Å; I216-V434 HydrophobicContact CG1-CG2 4.45Å; I216-M437 HydrophobicContact CD1-CE 3.97Å; I216-M437 HydrophobicContact CG1-CE 4.27Å
217	V	93.9	Very high	89.9	Confident	55 Å²	55	35.6 Å²	35.6	33%	0.333	19%	0.193	S	C	.	.	H	α-helix	trans	-64.4	-51.6	179.2	173.4	0	0	0	0	110.2	R178 T213 E214 D215 F219 S220 A221	R178-V217 HydrophobicContact CG-CG2 4.44Å; T213-V217 WeakPolarHBondContact O-CG2 3.43Å; E214-V217 WeakPolarHBondContact O-CB 3.35Å; E214-V217 PolarHBondContact O-N 2.87Å; D215-V217 VanDerWaalsContact C-N 3.31Å; D215-V217 PolarHBondContact O-N 3.15Å; V217-F219 PolarHBondContact O-N 3.09Å; V217-S220 PolarHBondContact O-N 3.37Å; V217-A221 WeakPolarHBondContact O-CB 3.2Å; V217-A221 PolarHBondContact O-N 3.02Å
218	M	91.6	Very high	90.4	Very high	87 Å²	87	34 Å²	34	43%	0.429	19%	0.185	S	C	.	.	H	α-helix	trans	-62.7	-42.9	179.6	-68.6	-61.9	-165.2	0	0	111.5	E214 D215 S222 Y430	E214-M218 WeakPolarHBondContact O-CG 3.18Å; E214-M218 PolarHBondContact O-N 2.97Å; D215-M218 PolarHBondContact O-N 3.22Å; M218-S222 VanDerWaalsContact O-CB 3.24Å; M218-S222 WeakPolarHBondContact O-CB 3.26Å; M218-S222 PolarHBondContact O-N 3.22Å; M218-S222 PolarHBondContact O-OG 2.75Å; M218-Y430 HydrophobicContact CB-CD1 3.67Å; M218-Y430 HydrophobicContact CB-CD2 4.16Å; M218-Y430 HydrophobicContact CB-CE1 3.46Å; M218-Y430 VanDerWaalsContact CB-CE1 3.46Å; M218-Y430 HydrophobicContact CB-CE2 3.96Å; M218-Y430 HydrophobicContact CB-CG 4.07Å; M218-Y430 HydrophobicContact CG-CE1 3.92Å
219	F	94.6	Very high	90.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-51.6	174.9	175.3	-101.6	0	0	0	111.8	L90 L93 L97 L181 D215 V217 A221 S222 V223 L427 T431 V434	L90-F219 HydrophobicContact CD1-CE2 3.97Å; L90-F219 HydrophobicContact CD1-CZ 4.08Å; L93-F219 HydrophobicContact CB-CE1 4.22Å; L93-F219 HydrophobicContact CB-CZ 3.76Å; L93-F219 HydrophobicContact CD1-CD2 4.39Å; L93-F219 HydrophobicContact CD1-CE1 4.14Å; L93-F219 HydrophobicContact CD1-CE2 3.73Å; L93-F219 HydrophobicContact CD1-CZ 3.59Å; L93-F219 HydrophobicContact CG-CZ 4.33Å; L97-F219 HydrophobicContact CD1-CE1 4.15Å; L181-F219 HydrophobicContact CD1-CD1 3.57Å; L181-F219 HydrophobicContact CD1-CE1 3.71Å; D215-F219 WeakPolarHBondContact O-CB 3.33Å; D215-F219 PolarHBondContact O-N 3.06Å; V217-F219 PolarHBondContact O-N 3.09Å; F219-A221 VanDerWaalsContact C-N 3.34Å; F219-A221 PolarHBondContact O-N 3.45Å; F219-S222 PolarHBondContact O-N 2.89Å; F219-V223 HydrophobicContact CD1-CG2 4.41Å; F219-V223 HydrophobicContact CD2-CG2 4.1Å; F219-V223 HydrophobicContact CE1-CG2 4.03Å; F219-V223 HydrophobicContact CE2-CG2 3.68Å; F219-V223 HydrophobicContact CG-CG2 4.45Å; F219-V223 HydrophobicContact CZ-CG2 3.64Å; F219-V223 WeakPolarHBondContact O-CG2 3.46Å; F219-V223 PolarHBondContact O-N 2.77Å; F219-L427 HydrophobicContact CD2-CD1 3.69Å; F219-L427 HydrophobicContact CE2-CD1 3.82Å; F219-T431 WeakPolarHBondContact CE2-OG1 3.49Å; F219-V434 HydrophobicContact CB-CG2 3.96Å; F219-V434 HydrophobicContact CG-CG2 4.35Å
220	S	95.1	Very high	90.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61	-43.3	-177.1	-56	0	0	0	0	111.8	R178 I216 V217 A224	R178-S220 WeakPolarHBondContact CA-OG 3.5Å; R178-S220 PolarHBondContact N-OG 3.45Å; I216-S220 WeakPolarHBondContact O-CB 3.48Å; I216-S220 PolarHBondContact O-N 3.38Å; I216-S220 PolarHBondContact O-OG 3.08Å; V217-S220 PolarHBondContact O-N 3.37Å; S220-A224 PolarHBondContact O-N 3.01Å
221	A	94.9	Very high	91.1	Very high	35 Å²	35	32.8 Å²	32.8	29%	0.289	18%	0.181	S	C	.	.	H	α-helix	trans	-66.8	-45.1	176.4	0	0	0	0	0	111.9	T174 V217 F219 V223 A224 H225	T174-A221 HydrophobicContact CG2-CB 3.8Å; V217-A221 WeakPolarHBondContact O-CB 3.2Å; V217-A221 PolarHBondContact O-N 3.02Å; F219-A221 VanDerWaalsContact C-N 3.34Å; F219-A221 PolarHBondContact O-N 3.45Å; A221-V223 PolarHBondContact O-N 3.31Å; A221-A224 PolarHBondContact O-N 3.15Å; A221-H225 VanDerWaalsContact O-CB 3.24Å; A221-H225 WeakPolarHBondContact O-CB 3.18Å; A221-H225 PolarHBondContact O-N 3.16Å
222	S	93.1	Very high	91.2	Very high	27 Å²	27	33.5 Å²	33.5	19%	0.189	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-39.9	178.5	-69.6	0	0	0	0	112.5	M218 F219 L226	M218-S222 VanDerWaalsContact O-CB 3.24Å; M218-S222 WeakPolarHBondContact O-CB 3.26Å; M218-S222 PolarHBondContact O-N 3.22Å; M218-S222 PolarHBondContact O-OG 2.75Å; F219-S222 PolarHBondContact O-N 2.89Å; S222-L226 WeakPolarHBondContact O-CB 3.34Å; S222-L226 PolarHBondContact O-N 3.4Å
223	V	93.8	Very high	91.3	Very high	17 Å²	17	33 Å²	33	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-47.1	177.7	172.8	0	0	0	0	111.2	L94 L97 F177 F219 A221 Y227 L427	L94-V223 HydrophobicContact CD2-CG1 4.46Å; L97-V223 HydrophobicContact CD1-CG1 4.48Å; F177-V223 HydrophobicContact CD2-CG1 4.38Å; F177-V223 HydrophobicContact CE2-CG1 4.02Å; F219-V223 HydrophobicContact CD1-CG2 4.41Å; F219-V223 HydrophobicContact CD2-CG2 4.1Å; F219-V223 HydrophobicContact CE1-CG2 4.03Å; F219-V223 HydrophobicContact CE2-CG2 3.68Å; F219-V223 HydrophobicContact CG-CG2 4.45Å; F219-V223 HydrophobicContact CZ-CG2 3.64Å; F219-V223 WeakPolarHBondContact O-CG2 3.46Å; F219-V223 PolarHBondContact O-N 2.77Å; A221-V223 PolarHBondContact O-N 3.31Å; V223-Y227 PolarHBondContact O-N 3.38Å; V223-Y227 VanDerWaalsContact O-N 3.07Å; V223-L427 HydrophobicContact CG2-CD1 3.58Å; V223-L427 HydrophobicContact CG2-CD2 4.34Å
224	A	93.6	Very high	91.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-44.5	179.3	0	0	0	0	0	112.1	L173 T174 F177 S220 A221 Y227 S228	L173-A224 HydrophobicContact CB-CB 4.34Å; L173-A224 HydrophobicContact CD2-CB 4.06Å; L173-A224 HydrophobicContact CG-CB 4.28Å; T174-A224 VanDerWaalsContact OG1-CB 3.25Å; T174-A224 WeakPolarHBondContact OG1-CB 3.35Å; F177-A224 HydrophobicContact CD2-CB 4.38Å; F177-A224 HydrophobicContact CE2-CB 4.37Å; S220-A224 PolarHBondContact O-N 3.01Å; A221-A224 PolarHBondContact O-N 3.15Å; A224-Y227 PolarHBondContact O-N 3.47Å; A224-S228 PolarHBondContact O-N 3.25Å
225	H	91.9	Very high	91.3	Very high	58 Å²	58	32 Å²	32	27%	0.269	17%	0.173	S	C	.	.	H	α-helix	trans	-61.5	-48.4	176.3	-176.7	-87.6	0	0	0	111.4	E170 A221 Y227 S228 N229 E423	E170-H225 WeakPolarHBondContact OE1-CA 3.45Å; E170-H225 IonicContact OE1-CD2 3.14Å; E170-H225 PolarHBondContact OE1-CD2 2.7Å; E170-H225 IonicContact OE1-CG 2.71Å; A221-H225 VanDerWaalsContact O-CB 3.24Å; A221-H225 WeakPolarHBondContact O-CB 3.18Å; A221-H225 PolarHBondContact O-N 3.16Å; H225-Y227 VanDerWaalsContact C-N 3.27Å; H225-Y227 PolarHBondContact O-N 3.17Å; H225-S228 PolarHBondContact O-N 2.92Å; H225-N229 VanDerWaalsContact O-CB 3.24Å; H225-N229 WeakPolarHBondContact O-CB 3.27Å; H225-N229 PolarHBondContact O-N 3.38Å; H225-E423 IonicContact CE1-OE1 2.75Å; H225-E423 PolarHBondContact CE1-OE1 2.94Å; H225-E423 IonicContact CE1-OE2 2.91Å; H225-E423 PolarHBondContact CE1-OE2 3.4Å; H225-E423 VanDerWaalsContact CE1-OE2 3.26Å; H225-E423 IonicContact ND1-OE1 2.7Å; H225-E423 IonicContact ND1-OE2 3.09Å; H225-E423 PolarHBondContact ND1-OE2 3.32Å
226	L	91.9	Very high	91.2	Very high	23 Å²	23	32.7 Å²	32.7	12%	0.12	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-37.7	-179.5	-177.4	67.2	0	0	0	111.5	S222 N229 L230 E423 V424 L427	S222-L226 WeakPolarHBondContact O-CB 3.34Å; S222-L226 PolarHBondContact O-N 3.4Å; L226-N229 PolarHBondContact O-N 3.38Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 PolarHBondContact O-N 2.74Å; L226-E423 HydrophobicContact CD1-CB 4.28Å; L226-V424 HydrophobicContact CD1-CG2 3.68Å; L226-V424 HydrophobicContact CD2-CG2 3.87Å; L226-V424 HydrophobicContact CG-CG2 4.43Å; L226-L427 HydrophobicContact CD2-CD2 3.5Å; L226-L427 VanDerWaalsContact CD2-CD2 3.5Å
227	Y	91.4	Very high	90.8	Very high	67 Å²	67	34.7 Å²	34.7	26%	0.263	19%	0.188	S	C	.	.	H	α-helix	trans	-58.6	-50.2	175.4	-177.8	-95.4	0	0	0	111.8	L109 H112 S113 L116 V223 A224 H225 T231	L109-Y227 HydrophobicContact CD1-CD1 3.73Å; L109-Y227 HydrophobicContact CD1-CD2 4.16Å; L109-Y227 HydrophobicContact CD1-CE1 3.49Å; L109-Y227 VanDerWaalsContact CD1-CE1 3.49Å; L109-Y227 HydrophobicContact CD1-CE2 3.94Å; L109-Y227 HydrophobicContact CD1-CG 4.06Å; L109-Y227 HydrophobicContact CG-CE1 4.35Å; H112-Y227 AromaticContact CD2-CD1 3.75Å; H112-Y227 AromaticContact CD2-CE1 3.78Å; S113-Y227 PolarHBondContact OG-OH 3.01Å; L116-Y227 HydrophobicContact CD1-CE1 4.37Å; V223-Y227 PolarHBondContact O-N 3.38Å; V223-Y227 VanDerWaalsContact O-N 3.07Å; A224-Y227 PolarHBondContact O-N 3.47Å; H225-Y227 VanDerWaalsContact C-N 3.27Å; H225-Y227 PolarHBondContact O-N 3.17Å; Y227-T231 WeakPolarHBondContact O-CB 3.33Å; Y227-T231 PolarHBondContact O-N 3.38Å; Y227-T231 PolarHBondContact O-OG1 3.3Å
228	S	88.1	Confident	90.4	Very high	11 Å²	11	36.3 Å²	36.3	8%	0.077	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-45.3	178	-177.4	0	0	0	0	111.9	H112 A224 H225 L230 K232	H112-S228 WeakPolarHBondContact NE2-CB 3.46Å; A224-S228 PolarHBondContact O-N 3.25Å; H225-S228 PolarHBondContact O-N 2.92Å; S228-L230 VanDerWaalsContact C-N 3.34Å; S228-L230 PolarHBondContact O-N 2.77Å; S228-K232 PolarHBondContact O-N 3.4Å
229	N	88.2	Confident	90.2	Very high	29 Å²	29	33.3 Å²	33.3	16%	0.155	18%	0.184	C	C	.	.	H	α-helix	trans	-74	-22.3	-174.5	-159.2	28	0	0	0	113.4	H225 L226 P233 S420 E423	H225-N229 VanDerWaalsContact O-CB 3.24Å; H225-N229 WeakPolarHBondContact O-CB 3.27Å; H225-N229 PolarHBondContact O-N 3.38Å; L226-N229 PolarHBondContact O-N 3.38Å; N229-P233 WeakPolarHBondContact O-CD 3.41Å; N229-P233 WeakPolarHBondContact O-CG 3.4Å; N229-S420 PolarHBondContact ND2-OG 3.36Å; N229-E423 VanDerWaalsContact ND2-CD 3.27Å; N229-E423 PolarHBondContact ND2-OE1 3.13Å; N229-E423 PolarHBondContact ND2-OE2 3.08Å
230	L	89.1	Confident	89.6	Confident	59 Å²	59	33.5 Å²	33.5	31%	0.309	19%	0.186	S	C	.	.	H	α-helix	trans	-96.6	-46.3	177.5	-163.3	74.6	0	0	0	112.1	L226 S228 K232 I234 I417	L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 PolarHBondContact O-N 2.74Å; S228-L230 VanDerWaalsContact C-N 3.34Å; S228-L230 PolarHBondContact O-N 2.77Å; L230-K232 PolarHBondContact O-N 3.45Å; L230-I234 HydrophobicContact CD1-CD1 4.32Å; L230-I234 HydrophobicContact CD2-CD1 4.21Å; L230-I234 HydrophobicContact CG-CD1 3.71Å; L230-I234 WeakPolarHBondContact O-CB 3.37Å; L230-I234 WeakPolarHBondContact O-CD1 3.36Å; L230-I234 WeakPolarHBondContact O-CG1 3.23Å; L230-I234 PolarHBondContact O-N 2.78Å; L230-I234 VanDerWaalsContact O-N 3.15Å; L230-I417 HydrophobicContact CD1-CG2 4.4Å
231	T	90	Very high	88.8	Confident	49 Å²	49	36.7 Å²	36.7	30%	0.301	21%	0.207	S	C	.	.	H	α-helix	trans	-64.5	-42.9	-173	-54.7	0	0	0	0	111.8	L116 Y227 L235	L116-T231 HydrophobicContact CD1-CG2 4.19Å; Y227-T231 WeakPolarHBondContact O-CB 3.33Å; Y227-T231 PolarHBondContact O-N 3.38Å; Y227-T231 PolarHBondContact O-OG1 3.3Å; T231-L235 WeakPolarHBondContact O-CB 3.43Å; T231-L235 PolarHBondContact O-N 3.28Å
232	K	86.6	Confident	88.3	Confident	26 Å²	26	41.8 Å²	41.8	11%	0.113	22%	0.22	C	C	.	.	H	α-helix	trans	-66.2	-54	-178.9	169.3	-178	179.1	-178.9	0	112.7	L116 S228 L230 I234 L235 D236	L116-K232 HydrophobicContact CD2-CB 4.02Å; L116-K232 HydrophobicContact CD2-CD 4.33Å; S228-K232 PolarHBondContact O-N 3.4Å; L230-K232 PolarHBondContact O-N 3.45Å; K232-I234 VanDerWaalsContact C-N 3.28Å; K232-I234 PolarHBondContact O-N 3.11Å; K232-L235 WeakPolarHBondContact O-CB 3.47Å; K232-L235 PolarHBondContact O-N 3.37Å; K232-L235 VanDerWaalsContact O-N 3.08Å; K232-D236 PolarHBondContact O-N 2.57Å
233	P	89.9	Confident	87.7	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-35.4	177.4	-31.1	41.4	0	0	0	114.2	N229 L235 D236 V237 A413 R416 I417	N229-P233 WeakPolarHBondContact O-CD 3.41Å; N229-P233 WeakPolarHBondContact O-CG 3.4Å; P233-L235 VanDerWaalsContact C-N 3.33Å; P233-L235 PolarHBondContact O-N 2.96Å; P233-D236 PolarHBondContact O-N 3.45Å; P233-V237 WeakPolarHBondContact O-CB 3.37Å; P233-V237 VanDerWaalsContact O-CG2 3.23Å; P233-V237 WeakPolarHBondContact O-CG2 3.42Å; P233-V237 PolarHBondContact O-N 3.45Å; P233-A413 HydrophobicContact CB-CB 3.9Å; P233-A413 WeakPolarHBondContact CB-O 3.04Å; P233-R416 HydrophobicContact CB-CB 4.44Å; P233-R416 HydrophobicContact CG-CB 3.92Å; P233-I417 HydrophobicContact CB-CD1 3.99Å; P233-I417 HydrophobicContact CB-CG1 3.61Å
234	I	88.9	Confident	86.9	Confident	78 Å²	78	42.4 Å²	42.4	40%	0.4	22%	0.222	S	C	.	.	H	α-helix	trans	-60	-47.1	173.4	-71.5	171.7	0	0	0	110.1	L230 K232 V237 V238 I417	L230-I234 HydrophobicContact CD1-CD1 4.32Å; L230-I234 HydrophobicContact CD2-CD1 4.21Å; L230-I234 HydrophobicContact CG-CD1 3.71Å; L230-I234 WeakPolarHBondContact O-CB 3.37Å; L230-I234 WeakPolarHBondContact O-CD1 3.36Å; L230-I234 WeakPolarHBondContact O-CG1 3.23Å; L230-I234 PolarHBondContact O-N 2.78Å; L230-I234 VanDerWaalsContact O-N 3.15Å; K232-I234 VanDerWaalsContact C-N 3.28Å; K232-I234 PolarHBondContact O-N 3.11Å; I234-V237 PolarHBondContact O-N 3.36Å; I234-V238 HydrophobicContact CG2-CG2 4.44Å; I234-V238 VanDerWaalsContact O-CG2 3.28Å; I234-V238 WeakPolarHBondContact O-CG2 3.32Å; I234-V238 PolarHBondContact O-N 2.71Å; I234-I417 HydrophobicContact CG1-CD1 3.94Å; I234-I417 HydrophobicContact CG1-CG1 4.46Å
235	L	88.4	Confident	86	Confident	43 Å²	43	45.6 Å²	45.6	23%	0.225	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-45	177.2	-170.1	68.3	0	0	0	111.5	M117 T120 T231 K232 P233 V237 V238 V239	M117-L235 HydrophobicContact CB-CD2 4.14Å; M117-L235 HydrophobicContact CG-CD2 3.72Å; T120-L235 HydrophobicContact CG2-CD2 4.23Å; T120-L235 HydrophobicContact CG2-CG 4.07Å; T231-L235 WeakPolarHBondContact O-CB 3.43Å; T231-L235 PolarHBondContact O-N 3.28Å; K232-L235 WeakPolarHBondContact O-CB 3.47Å; K232-L235 PolarHBondContact O-N 3.37Å; K232-L235 VanDerWaalsContact O-N 3.08Å; P233-L235 VanDerWaalsContact C-N 3.33Å; P233-L235 PolarHBondContact O-N 2.96Å; L235-V237 VanDerWaalsContact C-N 3.33Å; L235-V237 PolarHBondContact O-N 3.26Å; L235-V238 PolarHBondContact O-N 3.4Å; L235-V239 HydrophobicContact CD1-CG2 4.01Å; L235-V239 HydrophobicContact CG-CG2 4.15Å; L235-V239 WeakPolarHBondContact O-CB 3.39Å; L235-V239 VanDerWaalsContact O-CG2 3.24Å; L235-V239 WeakPolarHBondContact O-CG2 3.45Å; L235-V239 PolarHBondContact O-N 2.97Å
236	D	87	Confident	85.3	Confident	21 Å²	21	50.5 Å²	50.5	11%	0.112	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-44.3	177.5	-70.3	-17.5	0	0	0	111.1	T120 K232 P233 T240 A413	T120-D236 VanDerWaalsContact CB-OD1 3.27Å; T120-D236 WeakPolarHBondContact CB-OD1 3.23Å; T120-D236 WeakPolarHBondContact CG2-OD1 3.24Å; T120-D236 PolarHBondContact OG1-OD1 2.76Å; K232-D236 PolarHBondContact O-N 2.57Å; P233-D236 PolarHBondContact O-N 3.45Å; D236-T240 WeakPolarHBondContact O-CB 3.22Å; D236-T240 PolarHBondContact O-N 3.34Å; D236-T240 PolarHBondContact O-OG1 2.85Å; D236-A413 HydrophobicContact CB-CB 3.91Å
237	V	84.9	Confident	84.3	Confident	41 Å²	41	52 Å²	52	25%	0.248	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-47.9	177.7	171.6	0	0	0	0	111.6	P233 I234 L235 C241 A413 V414 I417	P233-V237 WeakPolarHBondContact O-CB 3.37Å; P233-V237 VanDerWaalsContact O-CG2 3.23Å; P233-V237 WeakPolarHBondContact O-CG2 3.42Å; P233-V237 PolarHBondContact O-N 3.45Å; I234-V237 PolarHBondContact O-N 3.36Å; L235-V237 VanDerWaalsContact C-N 3.33Å; L235-V237 PolarHBondContact O-N 3.26Å; V237-C241 WeakPolarHBondContact O-CB 3.33Å; V237-C241 PolarHBondContact O-N 3.48Å; V237-A413 HydrophobicContact CG2-CB 3.76Å; V237-V414 HydrophobicContact CG1-CG2 4.43Å; V237-V414 HydrophobicContact CG2-CG2 3.46Å; V237-V414 VanDerWaalsContact CG2-CG2 3.46Å; V237-I417 HydrophobicContact CG2-CD1 4.23Å
238	V	86.4	Confident	83.2	Confident	90 Å²	90	49.8 Å²	49.8	55%	0.545	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-50.2	-179.3	170	0	0	0	0	110.6	I234 L235 Y242	I234-V238 HydrophobicContact CG2-CG2 4.44Å; I234-V238 VanDerWaalsContact O-CG2 3.28Å; I234-V238 WeakPolarHBondContact O-CG2 3.32Å; I234-V238 PolarHBondContact O-N 2.71Å; L235-V238 PolarHBondContact O-N 3.4Å; V238-Y242 WeakPolarHBondContact O-CB 3.3Å; V238-Y242 PolarHBondContact O-N 3.04Å
239	V	85.9	Confident	82.3	Confident	23 Å²	23	55 Å²	55	14%	0.139	28%	0.283	C	S	.	.	H	α-helix	trans	-70.7	-37.4	-176.6	-174.3	0	0	0	0	111.2	T120 I124 L235 Y242 T243	T120-V239 HydrophobicContact CG2-CB 4.21Å; T120-V239 HydrophobicContact CG2-CG2 4.18Å; I124-V239 HydrophobicContact CD1-CB 4.08Å; I124-V239 HydrophobicContact CD1-CG1 3.19Å; L235-V239 HydrophobicContact CD1-CG2 4.01Å; L235-V239 HydrophobicContact CG-CG2 4.15Å; L235-V239 WeakPolarHBondContact O-CB 3.39Å; L235-V239 VanDerWaalsContact O-CG2 3.24Å; L235-V239 WeakPolarHBondContact O-CG2 3.45Å; L235-V239 PolarHBondContact O-N 2.97Å; V239-Y242 PolarHBondContact O-N 2.94Å; V239-T243 WeakPolarHBondContact O-CB 3.45Å; V239-T243 PolarHBondContact O-N 3.36Å; V239-T243 PolarHBondContact O-OG1 2.73Å
240	T	81.6	Confident	81.3	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-68.4	-42.7	177.4	-59.2	0	0	0	0	112	D236 Y242 T243 L244 L406 A410	D236-T240 WeakPolarHBondContact O-CB 3.22Å; D236-T240 PolarHBondContact O-N 3.34Å; D236-T240 PolarHBondContact O-OG1 2.85Å; T240-Y242 VanDerWaalsContact C-N 3.34Å; T240-Y242 PolarHBondContact O-N 3Å; T240-T243 PolarHBondContact O-N 2.56Å; T240-L244 HydrophobicContact CG2-CD1 3.84Å; T240-L244 HydrophobicContact CG2-CG 4.29Å; T240-L244 WeakPolarHBondContact O-CB 3.42Å; T240-L244 WeakPolarHBondContact O-CG 3.41Å; T240-L244 PolarHBondContact O-N 2.98Å; T240-L406 HydrophobicContact CG2-CB 3.79Å; T240-L406 HydrophobicContact CG2-CD2 4.27Å; T240-L406 WeakPolarHBondContact CG2-O 3.32Å; T240-A410 HydrophobicContact CG2-CB 3.88Å
241	C	79.3	Confident	80.1	Confident	67 Å²	67	58 Å²	58	45%	0.453	30%	0.302	S	S	.	.	H	α-helix	trans	-59.2	-46.8	174.8	-173.7	0	0	0	0	110.9	V237 T243 L244 L245	V237-C241 WeakPolarHBondContact O-CB 3.33Å; V237-C241 PolarHBondContact O-N 3.48Å; C241-T243 PolarHBondContact O-N 3.28Å; C241-L244 PolarHBondContact O-N 3.18Å; C241-L245 WeakPolarHBondContact O-CB 3.49Å; C241-L245 WeakPolarHBondContact O-CG 3.28Å; C241-L245 PolarHBondContact O-N 2.72Å
242	Y	83.6	Confident	78.7	Confident	142 Å²	142	57.1 Å²	57.1	56%	0.557	30%	0.302	S	S	*	.	H	α-helix	trans	-58.8	-45	175	177.2	-103.9	0	0	0	112.6	V238 V239 T240 L245 R246	V238-Y242 WeakPolarHBondContact O-CB 3.3Å; V238-Y242 PolarHBondContact O-N 3.04Å; V239-Y242 PolarHBondContact O-N 2.94Å; T240-Y242 VanDerWaalsContact C-N 3.34Å; T240-Y242 PolarHBondContact O-N 3Å; Y242-L245 PolarHBondContact O-N 3.39Å; Y242-R246 WeakPolarHBondContact O-CB 3.25Å; Y242-R246 PolarHBondContact O-N 3.49Å
243	T	81.1	Confident	77.6	Confident	33 Å²	33	56.4 Å²	56.4	20%	0.202	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-41.3	-179.2	-55.1	0	0	0	0	111.9	V239 T240 C241 T247 L406	V239-T243 WeakPolarHBondContact O-CB 3.45Å; V239-T243 PolarHBondContact O-N 3.36Å; V239-T243 PolarHBondContact O-OG1 2.73Å; T240-T243 PolarHBondContact O-N 2.56Å; C241-T243 PolarHBondContact O-N 3.28Å; T243-T247 WeakPolarHBondContact O-CB 3.37Å; T243-T247 PolarHBondContact O-N 3.43Å; T243-T247 PolarHBondContact O-OG1 3.39Å; T243-L406 HydrophobicContact CG2-CD1 3.97Å
244	L	76.8	Confident	76.4	Confident	24 Å²	24	62.3 Å²	62.3	13%	0.126	33%	0.333	C	S	.	.	H	α-helix	trans	-65.8	-43.7	177	-74.5	169	0	0	0	111.7	T240 C241 T247 A248 M361 A403 L406 L407	T240-L244 HydrophobicContact CG2-CD1 3.84Å; T240-L244 HydrophobicContact CG2-CG 4.29Å; T240-L244 WeakPolarHBondContact O-CB 3.42Å; T240-L244 WeakPolarHBondContact O-CG 3.41Å; T240-L244 PolarHBondContact O-N 2.98Å; C241-L244 PolarHBondContact O-N 3.18Å; L244-T247 PolarHBondContact O-N 2.82Å; L244-A248 WeakPolarHBondContact O-CB 3.44Å; L244-A248 PolarHBondContact O-N 3.06Å; L244-M361 HydrophobicContact CD1-CE 3.93Å; L244-A403 HydrophobicContact CD2-CB 3.85Å; L244-L406 HydrophobicContact CD2-CB 4.26Å; L244-L406 HydrophobicContact CD2-CD1 4.28Å; L244-L406 HydrophobicContact CG-CB 4.46Å; L244-L407 HydrophobicContact CD1-CD2 3.99Å; L244-L407 HydrophobicContact CD1-CG 4.14Å
245	L	74.8	Confident	75.3	Confident	68 Å²	68	60 Å²	60	36%	0.356	32%	0.322	S	S	.	.	H	α-helix	trans	-62.2	-46.5	176.2	-74.9	170.1	0	0	0	111.7	C241 Y242 T247 A248 Q249	C241-L245 WeakPolarHBondContact O-CB 3.49Å; C241-L245 WeakPolarHBondContact O-CG 3.28Å; C241-L245 PolarHBondContact O-N 2.72Å; Y242-L245 PolarHBondContact O-N 3.39Å; L245-T247 PolarHBondContact O-N 2.85Å; L245-A248 PolarHBondContact O-N 3.47Å; L245-Q249 WeakPolarHBondContact O-CB 3.19Å; L245-Q249 WeakPolarHBondContact O-CG 3.36Å; L245-Q249 PolarHBondContact O-N 2.92Å
246	R	77.3	Confident	74.5	Confident	161 Å²	161	62.3 Å²	62.3	61%	0.608	34%	0.339	S	S	*	.	H	α-helix	trans	-62.6	-42.6	178	-172.7	178.5	178.3	-174.5	0.7	112.1	Y242 A248 Q249 S250	Y242-R246 WeakPolarHBondContact O-CB 3.25Å; Y242-R246 PolarHBondContact O-N 3.49Å; R246-A248 VanDerWaalsContact C-N 3.32Å; R246-A248 PolarHBondContact O-N 2.76Å; R246-Q249 PolarHBondContact O-N 3.14Å; R246-S250 WeakPolarHBondContact O-CB 3.09Å; R246-S250 PolarHBondContact O-N 2.82Å; R246-S250 PolarHBondContact O-OG 3.46Å
247	T	70.6	Confident	73.5	Confident	55 Å²	55	70.9 Å²	70.9	34%	0.337	37%	0.369	S	S	.	.	H	α-helix	trans	-66.7	-33.9	179.1	-55.2	0	0	0	0	112.1	T243 L244 L245 S250 K251	T243-T247 WeakPolarHBondContact O-CB 3.37Å; T243-T247 PolarHBondContact O-N 3.43Å; T243-T247 PolarHBondContact O-OG1 3.39Å; L244-T247 PolarHBondContact O-N 2.82Å; L245-T247 PolarHBondContact O-N 2.85Å; T247-S250 WeakPolarHBondContact CA-OG 3.18Å; T247-S250 PolarHBondContact O-OG 3.1Å; T247-K251 WeakPolarHBondContact O-CG 3.04Å
248	A	68.8	Low	72.7	Confident	19 Å²	19	69.4 Å²	69.4	16%	0.157	36%	0.361	C	S	.	.	H	α-helix	trans	-75.8	-39.4	176.9	0	0	0	0	0	112.1	L244 L245 R246 K251 G252 A253 T255	L244-A248 WeakPolarHBondContact O-CB 3.44Å; L244-A248 PolarHBondContact O-N 3.06Å; L245-A248 PolarHBondContact O-N 3.47Å; R246-A248 VanDerWaalsContact C-N 3.32Å; R246-A248 PolarHBondContact O-N 2.76Å; A248-K251 PolarHBondContact O-N 3.04Å; A248-G252 PolarHBondContact O-N 3.07Å; A248-A253 PolarHBondContact O-N 3.1Å; A248-T255 HydrophobicContact CB-CG2 3.28Å
249	Q	69.1	Low	72.1	Confident	121 Å²	121	67.8 Å²	67.8	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-64.5	-41.5	173.8	-75.9	177.9	-16.5	0	0	112.4	L245 R246 K251 G252	L245-Q249 WeakPolarHBondContact O-CB 3.19Å; L245-Q249 WeakPolarHBondContact O-CG 3.36Å; L245-Q249 PolarHBondContact O-N 2.92Å; R246-Q249 PolarHBondContact O-N 3.14Å; Q249-K251 PolarHBondContact O-N 3.21Å; Q249-K251 VanDerWaalsContact O-N 3.07Å; Q249-G252 PolarHBondContact O-N 3.46Å; Q249-G252 VanDerWaalsContact O-N 3.1Å
250	S	66.9	Low	71.6	Confident	76 Å²	76	69.5 Å²	69.5	53%	0.531	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-13.3	176.2	63.3	0	0	0	0	113.4	R246 T247	R246-S250 WeakPolarHBondContact O-CB 3.09Å; R246-S250 PolarHBondContact O-N 2.82Å; R246-S250 PolarHBondContact O-OG 3.46Å; T247-S250 WeakPolarHBondContact CA-OG 3.18Å; T247-S250 PolarHBondContact O-OG 3.1Å
251	K	64.9	Low	71.4	Confident	75 Å²	75	73 Å²	73	33%	0.326	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	7.1	178.1	-68.1	-174.1	174.5	-137.3	0	113.8	T247 A248 Q249 A253	T247-K251 WeakPolarHBondContact O-CG 3.04Å; A248-K251 PolarHBondContact O-N 3.04Å; Q249-K251 PolarHBondContact O-N 3.21Å; Q249-K251 VanDerWaalsContact O-N 3.07Å; K251-A253 VanDerWaalsContact C-N 3.33Å; K251-A253 PolarHBondContact O-N 3.3Å
252	G	60.3	Low	71	Confident	30 Å²	30	71 Å²	71	31%	0.309	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	14.1	173.4	0	0	0	0	0	116.3	A248 Q249	A248-G252 PolarHBondContact O-N 3.07Å; Q249-G252 PolarHBondContact O-N 3.46Å; Q249-G252 VanDerWaalsContact O-N 3.1Å
253	A	63.7	Low	70.7	Confident	12 Å²	12	66.2 Å²	66.2	10%	0.099	37%	0.37	C	S	.	.			trans	-88.6	140.6	-178.2	0	0	0	0	0	112.8	A248 K251 T255 P365	A248-A253 PolarHBondContact O-N 3.1Å; K251-A253 VanDerWaalsContact C-N 3.33Å; K251-A253 PolarHBondContact O-N 3.3Å; A253-T255 PolarHBondContact O-N 3.23Å; A253-T255 VanDerWaalsContact O-N 3.14Å; A253-P365 HydrophobicContact CB-CB 3.71Å
254	D	64.8	Low	70.8	Confident	124 Å²	124	70.4 Å²	70.4	66%	0.663	39%	0.391	S	S	*	.			trans	-68.6	106.3	171.2	-81.6	-30.2	0	0	0	110.4
255	T	65.8	Low	71	Confident	29 Å²	29	70.7 Å²	70.7	18%	0.178	39%	0.393	C	S	.	.			trans	-87.6	-5.7	-174.5	41.9	0	0	0	0	114.8	A248 A253 S259	A248-T255 HydrophobicContact CB-CG2 3.28Å; A253-T255 PolarHBondContact O-N 3.23Å; A253-T255 VanDerWaalsContact O-N 3.14Å; T255-S259 WeakPolarHBondContact O-CB 3.49Å; T255-S259 PolarHBondContact O-N 2.83Å; T255-S259 PolarHBondContact O-OG 2.9Å
256	T	70.7	Confident	71.3	Confident	92 Å²	92	70.5 Å²	70.5	56%	0.564	40%	0.395	S	S	*	.	H	α-helix	trans	-67.6	-45.4	-172.1	41.8	0	0	0	0	113.7	S259 A260	T256-S259 PolarHBondContact O-OG 3.43Å; T256-S259 VanDerWaalsContact O-OG 3.05Å; T256-A260 WeakPolarHBondContact O-CB 3.31Å; T256-A260 PolarHBondContact O-N 2.88Å; T256-A260 VanDerWaalsContact O-N 3.15Å
257	W	66.6	Low	71.5	Confident	201 Å²	201	65.7 Å²	65.7	76%	0.761	39%	0.389	S	S	*	.	H	α-helix	trans	-71.6	-45.2	-179.6	-77	98.4	0	0	0	113.9	S259 A260 I261	W257-S259 PolarHBondContact O-N 3.28Å; W257-A260 PolarHBondContact O-N 2.88Å; W257-I261 WeakPolarHBondContact O-CG1 3.4Å; W257-I261 PolarHBondContact O-N 3.05Å; W257-I261 VanDerWaalsContact O-N 3.17Å
258	P	68.9	Low	72.2	Confident	11 Å²	11	68.4 Å²	68.4	7%	0.071	40%	0.401	C	S	.	.	H	α-helix	trans	-62.9	-38.1	176.6	-25.4	35.9	0	0	0	113.9	A262 M361 V364 P365	P258-A262 PolarHBondContact O-N 3.49Å; P258-M361 HydrophobicContact CB-CG 3.94Å; P258-V364 HydrophobicContact CG-CB 4.4Å; P258-V364 HydrophobicContact CG-CG1 4.1Å; P258-P365 HydrophobicContact CG-CG 4.38Å
259	S	72.4	Confident	73	Confident	55 Å²	55	67.8 Å²	67.8	39%	0.385	40%	0.395	S	S	.	.	H	α-helix	trans	-70.2	-36.4	177.5	54.8	0	0	0	0	112.7	T255 T256 W257 A262 G263	T255-S259 WeakPolarHBondContact O-CB 3.49Å; T255-S259 PolarHBondContact O-N 2.83Å; T255-S259 PolarHBondContact O-OG 2.9Å; T256-S259 PolarHBondContact O-OG 3.43Å; T256-S259 VanDerWaalsContact O-OG 3.05Å; W257-S259 PolarHBondContact O-N 3.28Å; S259-A262 PolarHBondContact O-N 2.92Å; S259-G263 PolarHBondContact O-N 3.3Å
260	A	76.8	Confident	73.6	Confident	60 Å²	60	64 Å²	64	50%	0.496	39%	0.385	S	S	.	.	H	α-helix	trans	-64.4	-40.1	174.5	0	0	0	0	0	112.8	T256 W257 G263 L264	T256-A260 WeakPolarHBondContact O-CB 3.31Å; T256-A260 PolarHBondContact O-N 2.88Å; T256-A260 VanDerWaalsContact O-N 3.15Å; W257-A260 PolarHBondContact O-N 2.88Å; A260-G263 PolarHBondContact O-N 2.87Å; A260-L264 WeakPolarHBondContact O-CB 3.42Å; A260-L264 PolarHBondContact O-N 3.24Å
261	I	75.9	Confident	74.5	Confident	79 Å²	79	68 Å²	68	41%	0.405	39%	0.393	S	S	.	.	H	α-helix	trans	-64	-45.1	176	-66.5	165.6	0	0	0	110.4	W257 L264 V265	W257-I261 WeakPolarHBondContact O-CG1 3.4Å; W257-I261 PolarHBondContact O-N 3.05Å; W257-I261 VanDerWaalsContact O-N 3.17Å; I261-L264 PolarHBondContact O-N 3.21Å; I261-V265 HydrophobicContact CG2-CG2 4.47Å; I261-V265 WeakPolarHBondContact O-CG2 3.5Å; I261-V265 PolarHBondContact O-N 3.15Å
262	A	71.4	Confident	75.6	Confident	23 Å²	23	67.1 Å²	67.1	19%	0.19	39%	0.394	C	S	.	.	H	α-helix	trans	-60.9	-46.2	176.8	0	0	0	0	0	111.7	P258 S259 L264 V265 V266 M361	P258-A262 PolarHBondContact O-N 3.49Å; S259-A262 PolarHBondContact O-N 2.92Å; A262-L264 VanDerWaalsContact C-N 3.33Å; A262-L264 PolarHBondContact O-N 3.46Å; A262-V265 PolarHBondContact O-N 3.48Å; A262-V266 VanDerWaalsContact O-CG2 3.28Å; A262-V266 WeakPolarHBondContact O-CG2 3.5Å; A262-V266 PolarHBondContact O-N 3.42Å; A262-M361 HydrophobicContact CB-SD 4.26Å
263	G	76.6	Confident	76.7	Confident	43 Å²	43	65.8 Å²	65.8	44%	0.443	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-40.8	176	0	0	0	0	0	113.2	S259 A260 A267	S259-G263 PolarHBondContact O-N 3.3Å; A260-G263 PolarHBondContact O-N 2.87Å; G263-A267 WeakPolarHBondContact O-CB 3.47Å; G263-A267 PolarHBondContact O-N 3.14Å
264	L	82.9	Confident	77.5	Confident	121 Å²	121	75.5 Å²	75.5	63%	0.634	41%	0.414	S	S	*	.	H	α-helix	trans	-65	-44.1	176.3	-178.8	66.4	0	0	0	112.1	A260 I261 A262 A267 L268	A260-L264 WeakPolarHBondContact O-CB 3.42Å; A260-L264 PolarHBondContact O-N 3.24Å; I261-L264 PolarHBondContact O-N 3.21Å; A262-L264 VanDerWaalsContact C-N 3.33Å; A262-L264 PolarHBondContact O-N 3.46Å; L264-A267 PolarHBondContact O-N 3.28Å; L264-L268 WeakPolarHBondContact O-CB 3.49Å; L264-L268 PolarHBondContact O-N 3.37Å
265	V	82.6	Confident	78.3	Confident	30 Å²	30	74.6 Å²	74.6	18%	0.182	42%	0.417	C	S	.	.	H	α-helix	trans	-61.9	-46.5	178	170.4	0	0	0	0	110.3	I261 A262 A267 L268 T269 V353	I261-V265 HydrophobicContact CG2-CG2 4.47Å; I261-V265 WeakPolarHBondContact O-CG2 3.5Å; I261-V265 PolarHBondContact O-N 3.15Å; A262-V265 PolarHBondContact O-N 3.48Å; V265-A267 PolarHBondContact O-N 3.5Å; V265-L268 PolarHBondContact O-N 3.01Å; V265-T269 WeakPolarHBondContact O-CB 3.45Å; V265-T269 PolarHBondContact O-N 2.84Å; V265-T269 PolarHBondContact O-OG1 3.29Å; V265-V353 HydrophobicContact CG1-CG1 4.09Å
266	V	79.4	Confident	79.2	Confident	63 Å²	63	76.6 Å²	76.6	38%	0.382	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-46.5	176.9	173.8	0	0	0	0	111.2	A262 L268 T269 A270 W354	A262-V266 VanDerWaalsContact O-CG2 3.28Å; A262-V266 WeakPolarHBondContact O-CG2 3.5Å; A262-V266 PolarHBondContact O-N 3.42Å; V266-L268 PolarHBondContact O-N 2.85Å; V266-T269 PolarHBondContact O-N 3.3Å; V266-A270 WeakPolarHBondContact O-CB 3.14Å; V266-A270 PolarHBondContact O-N 3.42Å; V266-W354 HydrophobicContact CB-CH2 4.32Å; V266-W354 HydrophobicContact CB-CZ2 4.11Å; V266-W354 HydrophobicContact CG1-CH2 3.95Å; V266-W354 HydrophobicContact CG1-CZ2 4Å; V266-W354 HydrophobicContact CG2-CH2 3.69Å; V266-W354 HydrophobicContact CG2-CZ2 3.72Å; V266-W354 HydrophobicContact CG2-CZ3 4.21Å
267	A	82	Confident	79.6	Confident	60 Å²	60	73.9 Å²	73.9	50%	0.496	42%	0.416	S	S	.	.	H	α-helix	trans	-63.8	-41.1	179.1	0	0	0	0	0	112.5	G263 L264 V265 A270 K271	G263-A267 WeakPolarHBondContact O-CB 3.47Å; G263-A267 PolarHBondContact O-N 3.14Å; L264-A267 PolarHBondContact O-N 3.28Å; V265-A267 PolarHBondContact O-N 3.5Å; A267-A270 PolarHBondContact O-N 2.86Å; A267-K271 PolarHBondContact O-N 3.17Å; A267-K271 VanDerWaalsContact O-N 3.08Å
268	L	86.4	Confident	80.1	Confident	112 Å²	112	66 Å²	66	59%	0.586	39%	0.39	S	S	*	.	H	α-helix	trans	-66.1	-45.8	176.9	-169.1	75.9	0	0	0	111.1	L264 V265 V266 A270 K271 V272	L264-L268 WeakPolarHBondContact O-CB 3.49Å; L264-L268 PolarHBondContact O-N 3.37Å; V265-L268 PolarHBondContact O-N 3.01Å; V266-L268 PolarHBondContact O-N 2.85Å; L268-A270 VanDerWaalsContact C-N 3.34Å; L268-A270 PolarHBondContact O-N 3.39Å; L268-K271 PolarHBondContact O-N 2.99Å; L268-V272 WeakPolarHBondContact O-CG2 3.47Å; L268-V272 PolarHBondContact O-N 2.75Å
269	T	85.5	Confident	80.6	Confident	6 Å²	6	73 Å²	73	4%	0.037	42%	0.422	C	S	.	.	H	α-helix	trans	-57.5	-47	175.8	-61.9	0	0	0	0	111.1	V265 V266 K271 V272 L273 L349 W354	V265-T269 WeakPolarHBondContact O-CB 3.45Å; V265-T269 PolarHBondContact O-N 2.84Å; V265-T269 PolarHBondContact O-OG1 3.29Å; V266-T269 PolarHBondContact O-N 3.3Å; T269-K271 VanDerWaalsContact C-N 3.33Å; T269-K271 PolarHBondContact O-N 3.17Å; T269-V272 PolarHBondContact O-N 2.7Å; T269-L273 HydrophobicContact CG2-CD1 3.86Å; T269-L273 HydrophobicContact CG2-CG 4.37Å; T269-L273 WeakPolarHBondContact O-CG 3.29Å; T269-L273 PolarHBondContact O-N 3.21Å; T269-L349 HydrophobicContact CG2-CB 3.85Å; T269-L349 HydrophobicContact CG2-CD1 4.16Å; T269-W354 HydrophobicContact CG2-CZ2 4.32Å; T269-W354 PolarHBondContact OG1-NE1 3.47Å; T269-W354 VanDerWaalsContact OG1-NE1 3.11Å
270	A	81.1	Confident	80.6	Confident	42 Å²	42	71.6 Å²	71.6	35%	0.347	41%	0.409	S	S	.	.	H	α-helix	trans	-60.5	-41.3	178	0	0	0	0	0	112.3	V266 A267 L268 R274	V266-A270 WeakPolarHBondContact O-CB 3.14Å; V266-A270 PolarHBondContact O-N 3.42Å; A267-A270 PolarHBondContact O-N 2.86Å; L268-A270 VanDerWaalsContact C-N 3.34Å; L268-A270 PolarHBondContact O-N 3.39Å; A270-R274 VanDerWaalsContact O-CB 3.28Å; A270-R274 WeakPolarHBondContact O-CB 3.35Å; A270-R274 PolarHBondContact O-N 3.43Å
271	K	85.9	Confident	80.3	Confident	160 Å²	160	69.5 Å²	69.5	70%	0.696	39%	0.393	S	S	*	.	H	α-helix	trans	-65	-42.5	177.5	-170.2	175.3	-177.8	176.1	0	112.1	A267 L268 T269 S275	A267-K271 PolarHBondContact O-N 3.17Å; A267-K271 VanDerWaalsContact O-N 3.08Å; L268-K271 PolarHBondContact O-N 2.99Å; T269-K271 VanDerWaalsContact C-N 3.33Å; T269-K271 PolarHBondContact O-N 3.17Å; K271-S275 WeakPolarHBondContact O-CB 3.36Å; K271-S275 PolarHBondContact O-N 3.04Å; K271-S275 VanDerWaalsContact O-N 3.09Å
272	V	87.9	Confident	80.3	Confident	56 Å²	56	71.8 Å²	71.8	34%	0.339	40%	0.4	S	S	.	.	H	α-helix	trans	-64.4	-49.9	177.5	172	0	0	0	0	110.7	L268 T269 R274 S275 C276 L345 L349	L268-V272 WeakPolarHBondContact O-CG2 3.47Å; L268-V272 PolarHBondContact O-N 2.75Å; T269-V272 PolarHBondContact O-N 2.7Å; V272-R274 VanDerWaalsContact C-N 3.35Å; V272-R274 PolarHBondContact O-N 2.7Å; V272-S275 PolarHBondContact O-N 2.75Å; V272-C276 PolarHBondContact O-N 2.71Å; V272-L345 HydrophobicContact CG1-CD2 4.46Å; V272-L349 HydrophobicContact CB-CD1 4.47Å; V272-L349 HydrophobicContact CG1-CD1 3.98Å
273	L	82.9	Confident	80.8	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-61.4	-42.5	179.7	-72.5	173.9	0	0	0	112.1	T269 S275 C276 S277 L345 E346 L349 M350 M418	T269-L273 HydrophobicContact CG2-CD1 3.86Å; T269-L273 HydrophobicContact CG2-CG 4.37Å; T269-L273 WeakPolarHBondContact O-CG 3.29Å; T269-L273 PolarHBondContact O-N 3.21Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 3.26Å; L273-C276 PolarHBondContact O-N 3.32Å; L273-S277 WeakPolarHBondContact O-CB 3.36Å; L273-S277 PolarHBondContact O-N 3.02Å; L273-L345 HydrophobicContact CD2-CG 4.42Å; L273-E346 HydrophobicContact CD2-CB 4.1Å; L273-L349 HydrophobicContact CD2-CD1 3.97Å; L273-L349 HydrophobicContact CG-CD1 4.04Å; L273-M350 HydrophobicContact CD1-CE 4.01Å; L273-M418 HydrophobicContact CD1-CE 4.04Å; L273-M418 HydrophobicContact CD1-CG 4.3Å; L273-M418 HydrophobicContact CD1-SD 4.37Å
274	R	80.4	Confident	80.5	Confident	217 Å²	217	71.1 Å²	71.1	82%	0.819	39%	0.385	S	S	*	.	H	α-helix	trans	-63.6	-36.5	177	-170.1	172	-176.7	163.6	1.7	112.6	A270 V272	A270-R274 VanDerWaalsContact O-CB 3.28Å; A270-R274 WeakPolarHBondContact O-CB 3.35Å; A270-R274 PolarHBondContact O-N 3.43Å; V272-R274 VanDerWaalsContact C-N 3.35Å; V272-R274 PolarHBondContact O-N 2.7Å
275	S	81.8	Confident	80	Confident	104 Å²	104	67 Å²	67	73%	0.727	37%	0.368	S	S	*	.	H	α-helix	trans	-72.8	-29.5	178	-170.3	0	0	0	0	113.1	K271 V272 L273	K271-S275 WeakPolarHBondContact O-CB 3.36Å; K271-S275 PolarHBondContact O-N 3.04Å; K271-S275 VanDerWaalsContact O-N 3.09Å; V272-S275 PolarHBondContact O-N 2.75Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 3.26Å
276	C	84.8	Confident	79.9	Confident	71 Å²	71	68.6 Å²	68.6	48%	0.48	37%	0.373	S	S	.	.	H	α-helix	trans	-96.5	-5.4	-179.2	-65.2	0	0	0	0	113.3	V272 L273 P278 L345	V272-C276 PolarHBondContact O-N 2.71Å; L273-C276 PolarHBondContact O-N 3.32Å; C276-P278 WeakPolarHBondContact O-CD 3.43Å; C276-L345 HydrophobicContact CB-CD2 3.74Å
277	S	79.1	Confident	80.1	Confident	35 Å²	35	68.4 Å²	68.4	25%	0.245	37%	0.368	C	S	.	.			trans	-70.6	120.6	-177.8	-167.3	0	0	0	0	111.1	L273	L273-S277 WeakPolarHBondContact O-CB 3.36Å; L273-S277 PolarHBondContact O-N 3.02Å
278	P	78.3	Confident	79.8	Confident	35 Å²	35	67.3 Å²	67.3	23%	0.227	36%	0.359	C	S	.	.			trans	-73.3	160.6	172.3	31.4	-33.7	0	0	0	110.7	C276 F280	C276-P278 WeakPolarHBondContact O-CD 3.43Å; P278-F280 HydrophobicContact CG-CD1 4.27Å; P278-F280 HydrophobicContact CG-CD2 3.87Å; P278-F280 HydrophobicContact CG-CE1 3.81Å; P278-F280 HydrophobicContact CG-CE2 3.39Å; P278-F280 HydrophobicContact CG-CG 4.3Å; P278-F280 HydrophobicContact CG-CZ 3.35Å; P278-F280 WeakPolarHBondContact O-CD2 3.01Å; P278-F280 PolarHBondContact O-N 2.75Å
279	H	79.4	Confident	79.5	Confident	160 Å²	160	69 Å²	69	74%	0.741	36%	0.362	S	S	*	.			trans	-72	69.3	177.6	-63.1	84.9	0	0	0	111.8	G281 K282 L283	H279-G281 VanDerWaalsContact C-N 3.28Å; H279-G281 PolarHBondContact O-N 3.05Å; H279-K282 PolarHBondContact O-N 2.61Å; H279-L283 PolarHBondContact O-N 3.25Å
280	F	72.5	Confident	79.6	Confident	25 Å²	25	71.8 Å²	71.8	11%	0.11	37%	0.372	C	S	.	.	H	α-helix	trans	-57.7	-37.5	-176.7	-75.5	-67.1	0	0	0	112.9	P278 K282 L283 V284 R339 Y342	P278-F280 HydrophobicContact CG-CD1 4.27Å; P278-F280 HydrophobicContact CG-CD2 3.87Å; P278-F280 HydrophobicContact CG-CE1 3.81Å; P278-F280 HydrophobicContact CG-CE2 3.39Å; P278-F280 HydrophobicContact CG-CG 4.3Å; P278-F280 HydrophobicContact CG-CZ 3.35Å; P278-F280 WeakPolarHBondContact O-CD2 3.01Å; P278-F280 PolarHBondContact O-N 2.75Å; F280-K282 VanDerWaalsContact C-N 3.34Å; F280-K282 PolarHBondContact O-N 3.3Å; F280-L283 PolarHBondContact O-N 3.41Å; F280-L283 VanDerWaalsContact O-N 3.16Å; F280-V284 WeakPolarHBondContact O-CG2 3.38Å; F280-V284 PolarHBondContact O-N 2.97Å; F280-R339 HydrophobicContact CE1-CB 4.4Å; F280-Y342 AromaticContact CE2-CD1 3.86Å; F280-Y342 HydrophobicContact CE2-CD1 3.86Å; F280-Y342 HydrophobicContact CE2-CE1 4.11Å; F280-Y342 HydrophobicContact CE2-CG 4.07Å; F280-Y342 AromaticContact CZ-CD1 3.98Å; F280-Y342 HydrophobicContact CZ-CD1 3.98Å; F280-Y342 HydrophobicContact CZ-CG 4.12Å
281	G	68.9	Low	79.8	Confident	16 Å²	16	74.3 Å²	74.3	17%	0.165	38%	0.375	C	S	.	.	H	α-helix	trans	-57.4	-43.3	179.3	0	0	0	0	0	113.4	H279 A285	H279-G281 VanDerWaalsContact C-N 3.28Å; H279-G281 PolarHBondContact O-N 3.05Å; G281-A285 WeakPolarHBondContact O-CB 3.43Å; G281-A285 PolarHBondContact O-N 2.72Å
282	K	77.3	Confident	79.6	Confident	127 Å²	127	67 Å²	67	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-65.5	-42.2	176.9	-175.5	176	178.2	177	0	111.6	H279 F280 A285 E286	H279-K282 PolarHBondContact O-N 2.61Å; F280-K282 VanDerWaalsContact C-N 3.34Å; F280-K282 PolarHBondContact O-N 3.3Å; K282-A285 PolarHBondContact O-N 2.73Å; K282-E286 WeakPolarHBondContact CE-OE1 3.3Å; K282-E286 WeakPolarHBondContact O-CG 3.44Å; K282-E286 PolarHBondContact O-N 2.78Å
283	L	80.7	Confident	79.4	Confident	16 Å²	16	68.1 Å²	68.1	8%	0.084	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-43.1	-179.6	-65.6	171.7	0	0	0	112.3	H279 F280 E286 E287 Q331 I335 K338	H279-L283 PolarHBondContact O-N 3.25Å; F280-L283 PolarHBondContact O-N 3.41Å; F280-L283 VanDerWaalsContact O-N 3.16Å; L283-E286 PolarHBondContact O-N 3.03Å; L283-E287 PolarHBondContact O-N 2.64Å; L283-Q331 PolarHBondContact O-NE2 2.84Å; L283-I335 HydrophobicContact CB-CD1 4.1Å; L283-I335 HydrophobicContact CB-CG1 3.91Å; L283-I335 HydrophobicContact CD1-CG1 4.47Å; L283-K338 HydrophobicContact CD1-CD 3.83Å
284	V	71.8	Confident	79.7	Confident	36 Å²	36	69 Å²	69	22%	0.218	35%	0.353	C	S	.	.	H	α-helix	trans	-68.5	-38.3	177.4	174.2	0	0	0	0	111.1	F280 E287 A288 E426	F280-V284 WeakPolarHBondContact O-CG2 3.38Å; F280-V284 PolarHBondContact O-N 2.97Å; V284-E287 PolarHBondContact O-N 2.9Å; V284-A288 WeakPolarHBondContact O-CB 3.45Å; V284-A288 PolarHBondContact O-N 3.43Å; V284-E426 HydrophobicContact CG1-CG 4.42Å
285	A	70.9	Confident	80	Confident	35 Å²	35	63.3 Å²	63.3	29%	0.289	33%	0.332	S	S	.	.	H	α-helix	trans	-62.9	-42.7	174.8	0	0	0	0	0	112.1	P80 G281 K282 A288 K289	P80-A285 HydrophobicContact CG-CB 4.46Å; G281-A285 WeakPolarHBondContact O-CB 3.43Å; G281-A285 PolarHBondContact O-N 2.72Å; K282-A285 PolarHBondContact O-N 2.73Å; A285-A288 PolarHBondContact O-N 2.9Å; A285-K289 PolarHBondContact O-N 3.05Å
286	E	81.6	Confident	80.2	Confident	62 Å²	62	64.9 Å²	64.9	29%	0.29	32%	0.323	S	S	.	.	H	α-helix	trans	-65	-38.8	174.7	-75.3	172.9	-168.8	0	0	112.6	K282 L283 K289 R290 Q331	K282-E286 WeakPolarHBondContact CE-OE1 3.3Å; K282-E286 WeakPolarHBondContact O-CG 3.44Å; K282-E286 PolarHBondContact O-N 2.78Å; L283-E286 PolarHBondContact O-N 3.03Å; E286-K289 PolarHBondContact O-N 3.36Å; E286-R290 WeakPolarHBondContact O-CG 3.34Å; E286-R290 PolarHBondContact O-N 3.09Å; E286-Q331 PolarHBondContact OE2-NE2 3.13Å
287	E	83.9	Confident	80.4	Confident	60 Å²	60	62.1 Å²	62.1	28%	0.28	30%	0.303	S	S	.	.	H	α-helix	trans	-60.6	-49.9	173.6	-178.9	-171.8	169.1	0	0	111.4	L283 V284 K289 R290 K291 L328 Q331 I332 I335	L283-E287 PolarHBondContact O-N 2.64Å; V284-E287 PolarHBondContact O-N 2.9Å; E287-K289 VanDerWaalsContact C-N 3.29Å; E287-K289 PolarHBondContact O-N 3.43Å; E287-R290 PolarHBondContact O-N 3.16Å; E287-K291 WeakPolarHBondContact O-CB 3.34Å; E287-K291 PolarHBondContact O-N 3.2Å; E287-L328 HydrophobicContact CG-CD1 4.33Å; E287-Q331 HydrophobicContact CB-CG 4.32Å; E287-I332 HydrophobicContact CG-CG1 4.32Å; E287-I335 HydrophobicContact CB-CD1 4.01Å; E287-I335 HydrophobicContact CG-CD1 4.47Å; E287-I335 WeakPolarHBondContact OE2-CD1 3.45Å
288	A	75.6	Confident	81.1	Confident	37 Å²	37	64.7 Å²	64.7	31%	0.306	31%	0.311	S	S	.	.	H	α-helix	trans	-59.4	-40.8	178.7	0	0	0	0	0	111.9	V284 A285 K291 G292	V284-A288 WeakPolarHBondContact O-CB 3.45Å; V284-A288 PolarHBondContact O-N 3.43Å; A285-A288 PolarHBondContact O-N 2.9Å; A288-K291 PolarHBondContact O-N 3.32Å; A288-G292 PolarHBondContact O-N 3.18Å
289	K	78.6	Confident	81.5	Confident	146 Å²	146	66.4 Å²	66.4	64%	0.635	32%	0.324	S	S	*	.	H	α-helix	trans	-61.2	-53.3	175.6	-174.8	179.4	177.8	-179.3	0	111.8	A285 E286 E287 K291 G292 D293	A285-K289 PolarHBondContact O-N 3.05Å; E286-K289 PolarHBondContact O-N 3.36Å; E287-K289 VanDerWaalsContact C-N 3.29Å; E287-K289 PolarHBondContact O-N 3.43Å; K289-K291 VanDerWaalsContact C-N 3.26Å; K289-K291 PolarHBondContact O-N 2.88Å; K289-G292 WeakPolarHBondContact O-CA 3.43Å; K289-G292 PolarHBondContact O-N 3.41Å; K289-D293 PolarHBondContact O-N 3.31Å
290	R	87.6	Confident	82.1	Confident	65 Å²	65	62 Å²	62	25%	0.245	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-34.1	179.6	-67.8	-179	-165.7	178	16.7	112.4	E286 E287 L294 S327 L328 Q331	E286-R290 WeakPolarHBondContact O-CG 3.34Å; E286-R290 PolarHBondContact O-N 3.09Å; E287-R290 PolarHBondContact O-N 3.16Å; R290-L294 PolarHBondContact O-N 2.88Å; R290-L294 VanDerWaalsContact O-N 3.07Å; R290-S327 PolarHBondContact NH1-O 2.83Å; R290-L328 HydrophobicContact CB-CB 4.31Å; R290-L328 HydrophobicContact CB-CD1 3.97Å; R290-Q331 VanDerWaalsContact CZ-OE1 3.26Å
291	K	85.1	Confident	83.1	Confident	96 Å²	96	62.9 Å²	62.9	42%	0.417	31%	0.306	S	S	.	.	H	α-helix	trans	-66.2	-41.2	173.2	-173.8	-178.7	179.6	-176.3	0	111.7	E287 A288 K289 L294 R295 L328	E287-K291 WeakPolarHBondContact O-CB 3.34Å; E287-K291 PolarHBondContact O-N 3.2Å; A288-K291 PolarHBondContact O-N 3.32Å; K289-K291 VanDerWaalsContact C-N 3.26Å; K289-K291 PolarHBondContact O-N 2.88Å; K291-L294 PolarHBondContact O-N 3.44Å; K291-R295 WeakPolarHBondContact O-CG 3.32Å; K291-R295 PolarHBondContact O-N 3.46Å; K291-R295 VanDerWaalsContact O-N 3.15Å; K291-L328 HydrophobicContact CB-CD1 4.27Å; K291-L328 HydrophobicContact CB-CD2 4.48Å
292	G	81.9	Confident	84.2	Confident	5 Å²	5	68.1 Å²	68.1	5%	0.052	33%	0.329	C	S	.	.	H	α-helix	trans	-60.6	-47.7	172.4	0	0	0	0	0	112.1	A288 K289 L294 R295 Y296	A288-G292 PolarHBondContact O-N 3.18Å; K289-G292 WeakPolarHBondContact O-CA 3.43Å; K289-G292 PolarHBondContact O-N 3.41Å; G292-L294 VanDerWaalsContact C-N 3.32Å; G292-L294 PolarHBondContact O-N 2.95Å; G292-R295 PolarHBondContact O-N 2.88Å; G292-R295 VanDerWaalsContact O-N 3.14Å; G292-Y296 PolarHBondContact O-N 3.35Å
293	D	84.5	Confident	84.7	Confident	80 Å²	80	65.6 Å²	65.6	43%	0.428	33%	0.331	S	S	.	.	H	α-helix	trans	-58.4	-43.2	177.8	-63	-24.1	0	0	0	111.6	K289 R295 Y296 M297	K289-D293 PolarHBondContact O-N 3.31Å; D293-R295 PolarHBondContact O-N 3.1Å; D293-Y296 PolarHBondContact O-N 3.07Å; D293-M297 VanDerWaalsContact O-CG 3.31Å; D293-M297 WeakPolarHBondContact O-CG 3.49Å; D293-M297 PolarHBondContact O-N 3.11Å
294	L	89.7	Confident	85.3	Confident	21 Å²	21	68.1 Å²	68.1	11%	0.11	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-41.3	176.6	-179.2	64.3	0	0	0	112.4	R290 K291 G292 M297 H298 L321 Y325 L328	R290-L294 PolarHBondContact O-N 2.88Å; R290-L294 VanDerWaalsContact O-N 3.07Å; K291-L294 PolarHBondContact O-N 3.44Å; G292-L294 VanDerWaalsContact C-N 3.32Å; G292-L294 PolarHBondContact O-N 2.95Å; L294-M297 WeakPolarHBondContact O-CB 3.21Å; L294-M297 PolarHBondContact O-N 2.94Å; L294-H298 PolarHBondContact O-CD2 3.06Å; L294-H298 PolarHBondContact O-N 2.91Å; L294-H298 VanDerWaalsContact O-N 3.11Å; L294-L321 HydrophobicContact CD1-CG 4.27Å; L294-Y325 HydrophobicContact CD2-CD2 3.93Å; L294-L328 HydrophobicContact CD2-CD2 3.85Å
295	R	87.1	Confident	86.3	Confident	98 Å²	98	69.8 Å²	69.8	37%	0.37	36%	0.358	S	S	.	.	H	α-helix	trans	-66.6	-41.4	176.3	-75.1	173.7	173.9	168.2	-19.9	112.1	E214 K291 G292 D293 M297 H298 S299	E214-R295 IonicContact OE1-CZ 2.94Å; E214-R295 IonicContact OE1-NH1 3.81Å; E214-R295 PolarHBondContact OE1-NH1 3.09Å; E214-R295 IonicContact OE1-NH2 3.36Å; E214-R295 PolarHBondContact OE1-NH2 3.45Å; E214-R295 IonicContact OE2-CZ 3.85Å; E214-R295 IonicContact OE2-NH1 3.26Å; E214-R295 PolarHBondContact OE2-NH1 2.64Å; E214-R295 IonicContact OE2-NH2 2.81Å; K291-R295 WeakPolarHBondContact O-CG 3.32Å; K291-R295 PolarHBondContact O-N 3.46Å; K291-R295 VanDerWaalsContact O-N 3.15Å; G292-R295 PolarHBondContact O-N 2.88Å; G292-R295 VanDerWaalsContact O-N 3.14Å; D293-R295 PolarHBondContact O-N 3.1Å; R295-M297 VanDerWaalsContact C-N 3.31Å; R295-M297 PolarHBondContact O-N 3.4Å; R295-H298 WeakPolarHBondContact O-CB 3.24Å; R295-H298 PolarHBondContact O-N 3.45Å; R295-S299 PolarHBondContact O-N 3.18Å
296	Y	85.5	Confident	87.3	Confident	136 Å²	136	74.1 Å²	74.1	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-58.2	-45.4	174.5	172.4	-99.3	0	0	0	111.1	G292 D293 H298 S299 R300	G292-Y296 PolarHBondContact O-N 3.35Å; D293-Y296 PolarHBondContact O-N 3.07Å; Y296-H298 VanDerWaalsContact C-N 3.33Å; Y296-H298 PolarHBondContact O-N 2.97Å; Y296-S299 PolarHBondContact O-N 3.43Å; Y296-R300 PolarHBondContact O-N 3.07Å
297	M	89	Confident	87.9	Confident	14 Å²	14	75.3 Å²	75.3	7%	0.069	38%	0.378	C	S	.	.	H	α-helix	trans	-57.8	-43.1	174.8	-74	-61.2	-48.8	0	0	112.7	D293 L294 R295 R300 I301 Q320	D293-M297 VanDerWaalsContact O-CG 3.31Å; D293-M297 WeakPolarHBondContact O-CG 3.49Å; D293-M297 PolarHBondContact O-N 3.11Å; L294-M297 WeakPolarHBondContact O-CB 3.21Å; L294-M297 PolarHBondContact O-N 2.94Å; R295-M297 VanDerWaalsContact C-N 3.31Å; R295-M297 PolarHBondContact O-N 3.4Å; M297-R300 VanDerWaalsContact CE-NH2 3.28Å; M297-I301 WeakPolarHBondContact O-CG1 3.34Å; M297-I301 PolarHBondContact O-N 3.39Å; M297-Q320 HydrophobicContact CE-CB 4.21Å; M297-Q320 HydrophobicContact CE-CG 3.56Å; M297-Q320 HydrophobicContact SD-CG 4.47Å
298	H	92.4	Very high	88.5	Confident	88 Å²	88	73.8 Å²	73.8	41%	0.407	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-46	174.2	-88.3	-74	0	0	0	112.7	L294 R295 Y296 R300 I301 I302	L294-H298 PolarHBondContact O-CD2 3.06Å; L294-H298 PolarHBondContact O-N 2.91Å; L294-H298 VanDerWaalsContact O-N 3.11Å; R295-H298 WeakPolarHBondContact O-CB 3.24Å; R295-H298 PolarHBondContact O-N 3.45Å; Y296-H298 VanDerWaalsContact C-N 3.33Å; Y296-H298 PolarHBondContact O-N 2.97Å; H298-R300 VanDerWaalsContact C-N 3.28Å; H298-R300 PolarHBondContact O-N 3.46Å; H298-I301 PolarHBondContact O-N 2.98Å; H298-I301 VanDerWaalsContact O-N 3.15Å; H298-I302 WeakPolarHBondContact O-CG1 3.43Å; H298-I302 PolarHBondContact O-N 3.22Å
299	S	88.5	Confident	89.4	Confident	71 Å²	71	75.5 Å²	75.5	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-59.7	-40.2	178.5	177.4	0	0	0	0	111.6	R295 Y296 I301 I302 A303	R295-S299 PolarHBondContact O-N 3.18Å; Y296-S299 PolarHBondContact O-N 3.43Å; S299-I301 PolarHBondContact O-N 3.32Å; S299-I302 PolarHBondContact O-N 3.35Å; S299-A303 WeakPolarHBondContact O-CB 3.38Å; S299-A303 PolarHBondContact O-N 3.22Å
300	R	90.9	Very high	90.3	Very high	69 Å²	69	76 Å²	76	26%	0.26	39%	0.388	S	S	.	.	H	α-helix	trans	-60.2	-42	174.7	-170.7	-172.7	75.1	171.5	8.4	112.6	Y296 M297 H298 A303 N304 E317	Y296-R300 PolarHBondContact O-N 3.07Å; M297-R300 VanDerWaalsContact CE-NH2 3.28Å; H298-R300 VanDerWaalsContact C-N 3.28Å; H298-R300 PolarHBondContact O-N 3.46Å; R300-A303 PolarHBondContact O-N 2.8Å; R300-N304 PolarHBondContact O-N 3.43Å; R300-N304 PolarHBondContact O-ND2 3.44Å; R300-E317 IonicContact CZ-OE2 3.06Å; R300-E317 IonicContact NH2-OE1 3.92Å; R300-E317 PolarHBondContact NH2-OE1 3.3Å; R300-E317 IonicContact NH2-OE2 3.13Å; R300-E317 PolarHBondContact NH2-OE2 3.49Å
301	I	94.1	Very high	90.8	Very high	42 Å²	42	82 Å²	82	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-65.4	-42	177.8	-68.1	167.5	0	0	0	110.6	M297 H298 S299 N304 S305 I308 E317 L321	M297-I301 WeakPolarHBondContact O-CG1 3.34Å; M297-I301 PolarHBondContact O-N 3.39Å; H298-I301 PolarHBondContact O-N 2.98Å; H298-I301 VanDerWaalsContact O-N 3.15Å; S299-I301 PolarHBondContact O-N 3.32Å; I301-N304 CarbonylContact O-C 3.58Å; I301-N304 PolarHBondContact O-N 3.28Å; I301-S305 VanDerWaalsContact O-CA 3.26Å; I301-S305 WeakPolarHBondContact O-CA 3.46Å; I301-S305 WeakPolarHBondContact O-CB 3.27Å; I301-S305 PolarHBondContact O-N 3.39Å; I301-I308 HydrophobicContact CB-CD1 4.32Å; I301-I308 HydrophobicContact CG1-CD1 4.31Å; I301-I308 HydrophobicContact CG2-CD1 4.19Å; I301-E317 HydrophobicContact CD1-CB 4.14Å; I301-E317 HydrophobicContact CG1-CB 4.41Å; I301-E317 HydrophobicContact CG1-CG 4.46Å; I301-L321 HydrophobicContact CD1-CD1 3.66Å
302	I	91.4	Very high	91.3	Very high	127 Å²	127	80.4 Å²	80.4	65%	0.651	42%	0.417	S	S	*	.	H	α-helix	trans	-63.1	-44.6	176.8	-64.8	165.8	0	0	0	110.4	H298 S299 N304 S305	H298-I302 WeakPolarHBondContact O-CG1 3.43Å; H298-I302 PolarHBondContact O-N 3.22Å; S299-I302 PolarHBondContact O-N 3.35Å; I302-N304 VanDerWaalsContact C-N 3.29Å; I302-N304 PolarHBondContact O-N 3.11Å; I302-S305 PolarHBondContact O-OG 2.85Å
303	A	87.9	Confident	92	Very high	73 Å²	73	81.1 Å²	81.1	60%	0.603	43%	0.425	S	S	*	.	H	α-helix	trans	-68.6	-24.4	-176.3	0	0	0	0	0	114.3	S299 R300	S299-A303 WeakPolarHBondContact O-CB 3.38Å; S299-A303 PolarHBondContact O-N 3.22Å; R300-A303 PolarHBondContact O-N 2.8Å
304	N	93.3	Very high	92.6	Very high	69 Å²	69	82.9 Å²	82.9	37%	0.369	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	30.9	-178.2	-51.5	-88.3	0	0	0	111.1	R300 I301 I302 E306 E307 I308	R300-N304 PolarHBondContact O-N 3.43Å; R300-N304 PolarHBondContact O-ND2 3.44Å; I301-N304 CarbonylContact O-C 3.58Å; I301-N304 PolarHBondContact O-N 3.28Å; I302-N304 VanDerWaalsContact C-N 3.29Å; I302-N304 PolarHBondContact O-N 3.11Å; N304-E306 VanDerWaalsContact C-N 3.27Å; N304-E306 PolarHBondContact O-N 3.42Å; N304-E307 WeakPolarHBondContact CA-OE2 3.41Å; N304-E307 PolarHBondContact O-N 2.91Å; N304-I308 HydrophobicContact CB-CD1 4.34Å; N304-I308 WeakPolarHBondContact O-CB 3.45Å; N304-I308 WeakPolarHBondContact O-CD1 3.18Å; N304-I308 WeakPolarHBondContact O-CG1 3.48Å; N304-I308 PolarHBondContact O-N 2.74Å
305	S	93.9	Very high	92.9	Very high	71 Å²	71	89.4 Å²	89.4	50%	0.497	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-34.6	-171.2	56.7	0	0	0	0	112.4	I301 I302 A309	I301-S305 VanDerWaalsContact O-CA 3.26Å; I301-S305 WeakPolarHBondContact O-CA 3.46Å; I301-S305 WeakPolarHBondContact O-CB 3.27Å; I301-S305 PolarHBondContact O-N 3.39Å; I302-S305 PolarHBondContact O-OG 2.85Å; S305-A309 VanDerWaalsContact O-CB 3.3Å; S305-A309 WeakPolarHBondContact O-CB 3.28Å; S305-A309 PolarHBondContact O-N 2.93Å
306	E	90.6	Very high	93.4	Very high	126 Å²	126	89.1 Å²	89.1	59%	0.589	47%	0.467	S	S	*	.	H	α-helix	trans	-69.5	-47.7	179.5	-173.6	175.5	-177.9	0	0	110.7	N304 I308 A309 F310	N304-E306 VanDerWaalsContact C-N 3.27Å; N304-E306 PolarHBondContact O-N 3.42Å; E306-I308 PolarHBondContact O-N 3.23Å; E306-A309 WeakPolarHBondContact O-CB 3.43Å; E306-A309 PolarHBondContact O-N 3.21Å; E306-A309 VanDerWaalsContact O-N 3.16Å; E306-F310 HydrophobicContact CG-CD2 3.79Å; E306-F310 HydrophobicContact CG-CE2 3.42Å; E306-F310 VanDerWaalsContact CG-CE2 3.42Å; E306-F310 HydrophobicContact CG-CZ 4.34Å; E306-F310 VanDerWaalsContact O-CD2 3.25Å; E306-F310 WeakPolarHBondContact O-CD2 3.49Å; E306-F310 PolarHBondContact O-N 3.45Å; E306-F310 WeakPolarHBondContact OE1-CE2 3.37Å
307	E	94.9	Very high	93.9	Very high	87 Å²	87	84.3 Å²	84.3	41%	0.407	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-44.2	176.6	-61.9	86.7	165.5	0	0	111.3	N304 A309 F310 Y311	N304-E307 WeakPolarHBondContact CA-OE2 3.41Å; N304-E307 PolarHBondContact O-N 2.91Å; E307-A309 VanDerWaalsContact C-N 3.28Å; E307-A309 PolarHBondContact O-N 3.02Å; E307-F310 PolarHBondContact O-N 3.29Å; E307-Y311 HydrophobicContact CB-CD2 4.47Å; E307-Y311 HydrophobicContact CB-CE2 4.23Å; E307-Y311 WeakPolarHBondContact O-CD2 3.42Å; E307-Y311 PolarHBondContact O-N 2.98Å
308	I	95.6	Very high	94.2	Very high	28 Å²	28	88.1 Å²	88.1	14%	0.144	47%	0.469	C	S	.	.	H	α-helix	trans	-60.7	-40.1	176.5	-67.6	162.3	0	0	0	110.7	I301 N304 E306 A312 G313 E317	I301-I308 HydrophobicContact CB-CD1 4.32Å; I301-I308 HydrophobicContact CG1-CD1 4.31Å; I301-I308 HydrophobicContact CG2-CD1 4.19Å; N304-I308 HydrophobicContact CB-CD1 4.34Å; N304-I308 WeakPolarHBondContact O-CB 3.45Å; N304-I308 WeakPolarHBondContact O-CD1 3.18Å; N304-I308 WeakPolarHBondContact O-CG1 3.48Å; N304-I308 PolarHBondContact O-N 2.74Å; E306-I308 PolarHBondContact O-N 3.23Å; I308-A312 PolarHBondContact O-N 2.88Å; I308-A312 VanDerWaalsContact O-N 3.16Å; I308-G313 PolarHBondContact O-N 2.87Å; I308-E317 HydrophobicContact CD1-CG 4.05Å; I308-E317 HydrophobicContact CG1-CG 4.3Å; I308-E317 HydrophobicContact CG2-CG 4Å
309	A	95.8	Very high	94.5	Very high	73 Å²	73	85.9 Å²	85.9	60%	0.603	46%	0.464	S	S	*	.	H	α-helix	trans	-67.5	-44.5	177.3	0	0	0	0	0	111.8	S305 E306 E307 Y311 A312	S305-A309 VanDerWaalsContact O-CB 3.3Å; S305-A309 WeakPolarHBondContact O-CB 3.28Å; S305-A309 PolarHBondContact O-N 2.93Å; E306-A309 WeakPolarHBondContact O-CB 3.43Å; E306-A309 PolarHBondContact O-N 3.21Å; E306-A309 VanDerWaalsContact O-N 3.16Å; E307-A309 VanDerWaalsContact C-N 3.28Å; E307-A309 PolarHBondContact O-N 3.02Å; A309-Y311 VanDerWaalsContact C-N 3.33Å; A309-Y311 PolarHBondContact O-N 3.06Å; A309-A312 PolarHBondContact O-N 3.28Å
310	F	96.6	Very high	94.8	Very high	156 Å²	156	85.2 Å²	85.2	68%	0.684	45%	0.452	S	S	*	.	H	α-helix	trans	-58.1	-42.8	176	-82.9	-55	0	0	0	112.5	E306 E307 A312	E306-F310 HydrophobicContact CG-CD2 3.79Å; E306-F310 HydrophobicContact CG-CE2 3.42Å; E306-F310 VanDerWaalsContact CG-CE2 3.42Å; E306-F310 HydrophobicContact CG-CZ 4.34Å; E306-F310 VanDerWaalsContact O-CD2 3.25Å; E306-F310 WeakPolarHBondContact O-CD2 3.49Å; E306-F310 PolarHBondContact O-N 3.45Å; E306-F310 WeakPolarHBondContact OE1-CE2 3.37Å; E307-F310 PolarHBondContact O-N 3.29Å; F310-A312 PolarHBondContact O-N 2.85Å
311	Y	97.4	Very high	95	Very high	191 Å²	191	83.4 Å²	83.4	75%	0.749	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.4	176.8	-61.9	-54.3	0	0	0	113.9	E307 A309 G313	E307-Y311 HydrophobicContact CB-CD2 4.47Å; E307-Y311 HydrophobicContact CB-CE2 4.23Å; E307-Y311 WeakPolarHBondContact O-CD2 3.42Å; E307-Y311 PolarHBondContact O-N 2.98Å; A309-Y311 VanDerWaalsContact C-N 3.33Å; A309-Y311 PolarHBondContact O-N 3.06Å; Y311-G313 PolarHBondContact O-N 3.38Å; Y311-G313 VanDerWaalsContact O-N 3.16Å
312	A	96.6	Very high	95.2	Very high	63 Å²	63	86.8 Å²	86.8	52%	0.521	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	33	-170.3	0	0	0	0	0	113.3	I308 A309 F310 H314	I308-A312 PolarHBondContact O-N 2.88Å; I308-A312 VanDerWaalsContact O-N 3.16Å; A309-A312 PolarHBondContact O-N 3.28Å; F310-A312 PolarHBondContact O-N 2.85Å; A312-H314 PolarHBondContact O-N 2.97Å; A312-H314 VanDerWaalsContact O-N 3.15Å; A312-H314 PolarHBondContact O-ND1 3.35Å; A312-H314 VanDerWaalsContact O-ND1 3.15Å
313	G	96.8	Very high	95.4	Very high	21 Å²	21	88.2 Å²	88.2	22%	0.216	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	1.7	-172	0	0	0	0	0	115.9	I308 Y311 K315 V316 E317	I308-G313 PolarHBondContact O-N 2.87Å; Y311-G313 PolarHBondContact O-N 3.38Å; Y311-G313 VanDerWaalsContact O-N 3.16Å; G313-K315 VanDerWaalsContact C-N 3.27Å; G313-K315 PolarHBondContact O-N 3.17Å; G313-K315 VanDerWaalsContact O-N 3.1Å; G313-V316 PolarHBondContact O-N 3.43Å; G313-E317 PolarHBondContact O-N 2.89Å
314	H	95.8	Very high	95.7	Very high	116 Å²	116	86.1 Å²	86.1	54%	0.537	44%	0.441	S	S	.	.	H	α-helix	trans	-52.8	-35.3	-172.5	62.6	-82.8	0	0	0	114.7	A312 L318	A312-H314 PolarHBondContact O-N 2.97Å; A312-H314 VanDerWaalsContact O-N 3.15Å; A312-H314 PolarHBondContact O-ND1 3.35Å; A312-H314 VanDerWaalsContact O-ND1 3.15Å; H314-L318 VanDerWaalsContact O-CB 3.28Å; H314-L318 WeakPolarHBondContact O-CB 3.47Å; H314-L318 PolarHBondContact O-N 2.94Å
315	K	97.1	Very high	95.9	Very high	158 Å²	158	89.5 Å²	89.5	69%	0.687	45%	0.45	S	S	*	.	H	α-helix	trans	-67.1	-39.7	177.9	-65.2	-177.4	-178.2	173.5	0	112.5	G313 S319	G313-K315 VanDerWaalsContact C-N 3.27Å; G313-K315 PolarHBondContact O-N 3.17Å; G313-K315 VanDerWaalsContact O-N 3.1Å; K315-S319 PolarHBondContact O-N 2.96Å; K315-S319 VanDerWaalsContact O-N 3.09Å
316	V	96.5	Very high	96.1	Very high	93 Å²	93	88.8 Å²	88.8	56%	0.564	45%	0.448	S	S	*	.	H	α-helix	trans	-68.7	-47.9	179.5	178.7	0	0	0	0	109.5	G313 L318 S319 Q320	G313-V316 PolarHBondContact O-N 3.43Å; V316-L318 VanDerWaalsContact C-N 3.35Å; V316-L318 PolarHBondContact O-N 3.48Å; V316-S319 WeakPolarHBondContact O-CB 3.46Å; V316-S319 PolarHBondContact O-N 3.26Å; V316-S319 VanDerWaalsContact O-N 3.14Å; V316-S319 PolarHBondContact O-OG 3.43Å; V316-Q320 PolarHBondContact O-N 2.97Å; V316-Q320 VanDerWaalsContact O-N 3.08Å
317	E	96.8	Very high	96.3	Very high	34 Å²	34	85.3 Å²	85.3	16%	0.159	44%	0.438	C	S	.	.	H	α-helix	trans	-59.8	-43.7	177.1	-68.2	-60.4	147.6	0	0	111.7	R300 I301 I308 G313 S319 Q320 L321	R300-E317 IonicContact CZ-OE2 3.06Å; R300-E317 IonicContact NH2-OE1 3.92Å; R300-E317 PolarHBondContact NH2-OE1 3.3Å; R300-E317 IonicContact NH2-OE2 3.13Å; R300-E317 PolarHBondContact NH2-OE2 3.49Å; I301-E317 HydrophobicContact CD1-CB 4.14Å; I301-E317 HydrophobicContact CG1-CB 4.41Å; I301-E317 HydrophobicContact CG1-CG 4.46Å; I308-E317 HydrophobicContact CD1-CG 4.05Å; I308-E317 HydrophobicContact CG1-CG 4.3Å; I308-E317 HydrophobicContact CG2-CG 4Å; G313-E317 PolarHBondContact O-N 2.89Å; E317-S319 VanDerWaalsContact C-N 3.34Å; E317-S319 PolarHBondContact O-N 3.01Å; E317-Q320 PolarHBondContact O-N 3.09Å; E317-Q320 VanDerWaalsContact O-N 3.17Å; E317-L321 WeakPolarHBondContact O-CB 3.16Å; E317-L321 PolarHBondContact O-N 3.48Å
318	L	96.3	Very high	96.3	Very high	95 Å²	95	81.9 Å²	81.9	50%	0.497	42%	0.422	S	S	.	.	H	α-helix	trans	-57.8	-44.9	174.2	179.4	63.1	0	0	0	111.9	H314 V316 Q320 L321 Q322	H314-L318 VanDerWaalsContact O-CB 3.28Å; H314-L318 WeakPolarHBondContact O-CB 3.47Å; H314-L318 PolarHBondContact O-N 2.94Å; V316-L318 VanDerWaalsContact C-N 3.35Å; V316-L318 PolarHBondContact O-N 3.48Å; L318-Q320 VanDerWaalsContact C-N 3.28Å; L318-Q320 PolarHBondContact O-N 2.94Å; L318-L321 PolarHBondContact O-N 3.19Å; L318-Q322 HydrophobicContact CD1-CG 4.18Å; L318-Q322 HydrophobicContact CG-CG 4.44Å; L318-Q322 WeakPolarHBondContact O-CB 3.25Å; L318-Q322 VanDerWaalsContact O-CG 3.32Å; L318-Q322 WeakPolarHBondContact O-CG 3.17Å; L318-Q322 PolarHBondContact O-N 3.33Å
319	S	97.1	Very high	96.4	Very high	41 Å²	41	83.2 Å²	83.2	29%	0.287	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-35.4	178.7	83.2	0	0	0	0	112.6	K315 V316 E317 R323	K315-S319 PolarHBondContact O-N 2.96Å; K315-S319 VanDerWaalsContact O-N 3.09Å; V316-S319 WeakPolarHBondContact O-CB 3.46Å; V316-S319 PolarHBondContact O-N 3.26Å; V316-S319 VanDerWaalsContact O-N 3.14Å; V316-S319 PolarHBondContact O-OG 3.43Å; E317-S319 VanDerWaalsContact C-N 3.34Å; E317-S319 PolarHBondContact O-N 3.01Å; S319-R323 VanDerWaalsContact O-CG 3.32Å; S319-R323 WeakPolarHBondContact O-CG 3.42Å; S319-R323 PolarHBondContact O-N 3.34Å; S319-R323 PolarHBondContact O-NE 3.09Å; S319-R323 PolarHBondContact OG-NH2 3.44Å
320	Q	95.4	Very high	96.4	Very high	56 Å²	56	82.6 Å²	82.6	26%	0.262	43%	0.425	S	S	.	.	H	α-helix	trans	-75.1	-38.2	179.7	-168.3	172.8	-2.6	0	0	111	M297 V316 E317 L318 R323 S324	M297-Q320 HydrophobicContact CE-CB 4.21Å; M297-Q320 HydrophobicContact CE-CG 3.56Å; M297-Q320 HydrophobicContact SD-CG 4.47Å; V316-Q320 PolarHBondContact O-N 2.97Å; V316-Q320 VanDerWaalsContact O-N 3.08Å; E317-Q320 PolarHBondContact O-N 3.09Å; E317-Q320 VanDerWaalsContact O-N 3.17Å; L318-Q320 VanDerWaalsContact C-N 3.28Å; L318-Q320 PolarHBondContact O-N 2.94Å; Q320-R323 PolarHBondContact O-N 2.97Å; Q320-S324 PolarHBondContact O-N 3.47Å; Q320-S324 PolarHBondContact O-OG 3.35Å
321	L	95.8	Very high	96.2	Very high	32 Å²	32	75.2 Å²	75.2	17%	0.168	39%	0.393	C	S	.	.	H	α-helix	trans	-65.5	-45.8	175.8	-158.7	118.4	0	0	0	111.7	L294 I301 E317 L318 R323 S324 Y325	L294-L321 HydrophobicContact CD1-CG 4.27Å; I301-L321 HydrophobicContact CD1-CD1 3.66Å; E317-L321 WeakPolarHBondContact O-CB 3.16Å; E317-L321 PolarHBondContact O-N 3.48Å; L318-L321 PolarHBondContact O-N 3.19Å; L321-R323 VanDerWaalsContact C-N 3.34Å; L321-R323 PolarHBondContact O-N 3.18Å; L321-S324 PolarHBondContact O-N 2.96Å; L321-Y325 PolarHBondContact O-N 2.91Å
322	Q	97.1	Very high	96	Very high	112 Å²	112	69.1 Å²	69.1	52%	0.523	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-41.4	175.8	-75.8	177.2	-19.3	0	0	112.1	L318 Y325 A326	L318-Q322 HydrophobicContact CD1-CG 4.18Å; L318-Q322 HydrophobicContact CG-CG 4.44Å; L318-Q322 WeakPolarHBondContact O-CB 3.25Å; L318-Q322 VanDerWaalsContact O-CG 3.32Å; L318-Q322 WeakPolarHBondContact O-CG 3.17Å; L318-Q322 PolarHBondContact O-N 3.33Å; Q322-Y325 PolarHBondContact O-N 3.46Å; Q322-A326 WeakPolarHBondContact O-CB 3.49Å; Q322-A326 PolarHBondContact O-N 2.99Å
323	R	96.4	Very high	95.9	Very high	157 Å²	157	71.3 Å²	71.3	59%	0.592	37%	0.372	S	S	*	.	H	α-helix	trans	-60.5	-45.2	174.3	-80.7	179	-81.6	154.7	-10.1	112.1	S319 Q320 L321 A326 S327	S319-R323 VanDerWaalsContact O-CG 3.32Å; S319-R323 WeakPolarHBondContact O-CG 3.42Å; S319-R323 PolarHBondContact O-N 3.34Å; S319-R323 PolarHBondContact O-NE 3.09Å; S319-R323 PolarHBondContact OG-NH2 3.44Å; Q320-R323 PolarHBondContact O-N 2.97Å; L321-R323 VanDerWaalsContact C-N 3.34Å; L321-R323 PolarHBondContact O-N 3.18Å; R323-A326 PolarHBondContact O-N 2.91Å; R323-S327 PolarHBondContact O-N 2.78Å; R323-S327 VanDerWaalsContact O-N 3.1Å
324	S	94.4	Very high	95.7	Very high	30 Å²	30	74.3 Å²	74.3	21%	0.21	38%	0.38	C	S	.	.	H	α-helix	trans	-64	-42.8	178.5	-56	0	0	0	0	111.4	Q320 L321 S327 L328	Q320-S324 PolarHBondContact O-N 3.47Å; Q320-S324 PolarHBondContact O-OG 3.35Å; L321-S324 PolarHBondContact O-N 2.96Å; S324-S327 WeakPolarHBondContact O-CB 3.32Å; S324-S327 PolarHBondContact O-N 3.48Å; S324-L328 PolarHBondContact O-N 3.25Å; S324-L328 VanDerWaalsContact O-N 3.16Å
325	Y	97.2	Very high	95.3	Very high	139 Å²	139	69.2 Å²	69.2	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-66.3	-41.3	176	-177.8	-103.5	0	0	0	112.9	L294 L321 Q322 S327 L328 S329	L294-Y325 HydrophobicContact CD2-CD2 3.93Å; L321-Y325 PolarHBondContact O-N 2.91Å; Q322-Y325 PolarHBondContact O-N 3.46Å; Y325-S327 VanDerWaalsContact C-N 3.29Å; Y325-S327 PolarHBondContact O-N 2.87Å; Y325-L328 PolarHBondContact O-N 3.02Å; Y325-S329 WeakPolarHBondContact O-CB 3.42Å; Y325-S329 PolarHBondContact O-N 3.34Å
326	A	97.2	Very high	94.9	Very high	57 Å²	57	66.6 Å²	66.6	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-60.9	-39.6	176.6	0	0	0	0	0	111.7	Q322 R323 S329 S330	Q322-A326 WeakPolarHBondContact O-CB 3.49Å; Q322-A326 PolarHBondContact O-N 2.99Å; R323-A326 PolarHBondContact O-N 2.91Å; A326-S329 PolarHBondContact O-N 2.96Å; A326-S330 WeakPolarHBondContact O-CB 3.47Å; A326-S330 PolarHBondContact O-N 2.81Å
327	S	95.6	Very high	94.7	Very high	53 Å²	53	66.5 Å²	66.5	37%	0.371	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-43.1	173.6	-178.3	0	0	0	0	112.5	R290 R323 S324 Y325 Q331	R290-S327 PolarHBondContact NH1-O 2.83Å; R323-S327 PolarHBondContact O-N 2.78Å; R323-S327 VanDerWaalsContact O-N 3.1Å; S324-S327 WeakPolarHBondContact O-CB 3.32Å; S324-S327 PolarHBondContact O-N 3.48Å; Y325-S327 VanDerWaalsContact C-N 3.29Å; Y325-S327 PolarHBondContact O-N 2.87Å; S327-Q331 PolarHBondContact O-N 3.18Å
328	L	95.4	Very high	94.4	Very high	14 Å²	14	69.5 Å²	69.5	7%	0.073	36%	0.358	C	S	.	.	H	α-helix	trans	-64.6	-47.8	174.8	176.6	61.7	0	0	0	111.6	E287 R290 K291 L294 S324 Y325 S330 Q331 I332	E287-L328 HydrophobicContact CG-CD1 4.33Å; R290-L328 HydrophobicContact CB-CB 4.31Å; R290-L328 HydrophobicContact CB-CD1 3.97Å; K291-L328 HydrophobicContact CB-CD1 4.27Å; K291-L328 HydrophobicContact CB-CD2 4.48Å; L294-L328 HydrophobicContact CD2-CD2 3.85Å; S324-L328 PolarHBondContact O-N 3.25Å; S324-L328 VanDerWaalsContact O-N 3.16Å; Y325-L328 PolarHBondContact O-N 3.02Å; L328-S330 VanDerWaalsContact C-N 3.34Å; L328-S330 PolarHBondContact O-N 3.27Å; L328-Q331 WeakPolarHBondContact O-CB 3.37Å; L328-Q331 PolarHBondContact O-N 3.19Å; L328-Q331 VanDerWaalsContact O-N 3.1Å; L328-I332 HydrophobicContact CD1-CD1 4.01Å; L328-I332 HydrophobicContact CD1-CG1 4.31Å; L328-I332 HydrophobicContact CG-CD1 3.91Å; L328-I332 WeakPolarHBondContact O-CG1 3Å; L328-I332 PolarHBondContact O-N 3.48Å
329	S	96.8	Very high	93.9	Very high	56 Å²	56	69.5 Å²	69.5	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-58.6	-44.1	179.7	-178.4	0	0	0	0	112	Y325 A326 Q331 I332 H333	Y325-S329 WeakPolarHBondContact O-CB 3.42Å; Y325-S329 PolarHBondContact O-N 3.34Å; A326-S329 PolarHBondContact O-N 2.96Å; S329-Q331 VanDerWaalsContact C-N 3.32Å; S329-Q331 PolarHBondContact O-N 2.9Å; S329-I332 PolarHBondContact O-N 3.48Å; S329-H333 WeakPolarHBondContact O-CB 2.96Å; S329-H333 PolarHBondContact O-N 2.77Å
330	S	95.7	Very high	93.5	Very high	60 Å²	60	73 Å²	73	42%	0.42	37%	0.367	S	S	.	.	H	α-helix	trans	-59.1	-41	175.1	-174.6	0	0	0	0	112.2	A326 L328 H333 Q334	A326-S330 WeakPolarHBondContact O-CB 3.47Å; A326-S330 PolarHBondContact O-N 2.81Å; L328-S330 VanDerWaalsContact C-N 3.34Å; L328-S330 PolarHBondContact O-N 3.27Å; S330-H333 PolarHBondContact O-N 3.5Å; S330-Q334 WeakPolarHBondContact O-CG 3.37Å; S330-Q334 PolarHBondContact O-N 2.71Å; S330-Q334 VanDerWaalsContact O-N 3.08Å
331	Q	93.8	Very high	93.2	Very high	1 Å²	1	79 Å²	79	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-49.2	176.2	-167.9	64.5	4.3	0	0	111.8	L283 E286 E287 R290 S327 L328 S329 H333 Q334 I335	L283-Q331 PolarHBondContact O-NE2 2.84Å; E286-Q331 PolarHBondContact OE2-NE2 3.13Å; E287-Q331 HydrophobicContact CB-CG 4.32Å; R290-Q331 VanDerWaalsContact CZ-OE1 3.26Å; S327-Q331 PolarHBondContact O-N 3.18Å; L328-Q331 WeakPolarHBondContact O-CB 3.37Å; L328-Q331 PolarHBondContact O-N 3.19Å; L328-Q331 VanDerWaalsContact O-N 3.1Å; S329-Q331 VanDerWaalsContact C-N 3.32Å; S329-Q331 PolarHBondContact O-N 2.9Å; Q331-H333 VanDerWaalsContact C-N 3.26Å; Q331-H333 PolarHBondContact O-N 3.1Å; Q331-Q334 PolarHBondContact O-N 3.43Å; Q331-I335 HydrophobicContact CG-CD1 4.08Å; Q331-I335 WeakPolarHBondContact O-CG1 3.33Å; Q331-I335 PolarHBondContact O-N 3.31Å
332	I	91.8	Very high	92.8	Very high	64 Å²	64	78.9 Å²	78.9	33%	0.328	38%	0.384	S	S	.	.	H	α-helix	trans	-59.6	-43.3	-179.3	-67.4	170.2	0	0	0	109.4	E287 L328 S329 Q334 I335 L336	E287-I332 HydrophobicContact CG-CG1 4.32Å; L328-I332 HydrophobicContact CD1-CD1 4.01Å; L328-I332 HydrophobicContact CD1-CG1 4.31Å; L328-I332 HydrophobicContact CG-CD1 3.91Å; L328-I332 WeakPolarHBondContact O-CG1 3Å; L328-I332 PolarHBondContact O-N 3.48Å; S329-I332 PolarHBondContact O-N 3.48Å; I332-Q334 PolarHBondContact O-N 3.49Å; I332-I335 WeakPolarHBondContact O-CB 3.16Å; I332-I335 PolarHBondContact O-N 2.94Å; I332-L336 HydrophobicContact CG2-CD1 4.03Å; I332-L336 HydrophobicContact CG2-CG 4.35Å; I332-L336 VanDerWaalsContact O-CG 3.32Å; I332-L336 WeakPolarHBondContact O-CG 3.43Å; I332-L336 PolarHBondContact O-N 3.46Å
333	H	95.1	Very high	92.2	Very high	109 Å²	109	76.2 Å²	76.2	51%	0.505	38%	0.376	S	S	.	.	H	α-helix	trans	-59.3	-44.7	176.9	-171.5	78.4	0	0	0	112.5	S329 S330 Q331 I335 L336 L337	S329-H333 WeakPolarHBondContact O-CB 2.96Å; S329-H333 PolarHBondContact O-N 2.77Å; S330-H333 PolarHBondContact O-N 3.5Å; Q331-H333 VanDerWaalsContact C-N 3.26Å; Q331-H333 PolarHBondContact O-N 3.1Å; H333-I335 VanDerWaalsContact C-N 3.33Å; H333-I335 PolarHBondContact O-N 3.34Å; H333-L336 PolarHBondContact O-N 3.21Å; H333-L337 WeakPolarHBondContact NE2-CD1 3.35Å; H333-L337 PolarHBondContact O-N 3.49Å
334	Q	92.4	Very high	91.9	Very high	83 Å²	83	74 Å²	74	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-62.6	-38.4	175.7	-70.4	-176.8	16.6	0	0	112.7	S330 Q331 I332 K338	S330-Q334 WeakPolarHBondContact O-CG 3.37Å; S330-Q334 PolarHBondContact O-N 2.71Å; S330-Q334 VanDerWaalsContact O-N 3.08Å; Q331-Q334 PolarHBondContact O-N 3.43Å; I332-Q334 PolarHBondContact O-N 3.49Å; Q334-K338 WeakPolarHBondContact O-CG 3.46Å; Q334-K338 PolarHBondContact O-N 2.86Å; Q334-K338 VanDerWaalsContact O-N 3.14Å
335	I	88.2	Confident	91.6	Very high	10 Å²	10	74.7 Å²	74.7	5%	0.051	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-45.2	176.4	-68.7	170.6	0	0	0	110.5	L283 E287 Q331 I332 H333 K338 R339	L283-I335 HydrophobicContact CB-CD1 4.1Å; L283-I335 HydrophobicContact CB-CG1 3.91Å; L283-I335 HydrophobicContact CD1-CG1 4.47Å; E287-I335 HydrophobicContact CB-CD1 4.01Å; E287-I335 HydrophobicContact CG-CD1 4.47Å; E287-I335 WeakPolarHBondContact OE2-CD1 3.45Å; Q331-I335 HydrophobicContact CG-CD1 4.08Å; Q331-I335 WeakPolarHBondContact O-CG1 3.33Å; Q331-I335 PolarHBondContact O-N 3.31Å; I332-I335 WeakPolarHBondContact O-CB 3.16Å; I332-I335 PolarHBondContact O-N 2.94Å; H333-I335 VanDerWaalsContact C-N 3.33Å; H333-I335 PolarHBondContact O-N 3.34Å; I335-K338 PolarHBondContact O-N 3.26Å; I335-R339 VanDerWaalsContact O-CB 3.27Å; I335-R339 WeakPolarHBondContact O-CB 3.38Å; I335-R339 PolarHBondContact O-N 3.46Å
336	L	89.1	Confident	91	Very high	103 Å²	103	68.9 Å²	68.9	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-60.6	-46.7	178.8	-70.2	172.3	0	0	0	111.8	I332 H333 K338 R339 L340	I332-L336 HydrophobicContact CG2-CD1 4.03Å; I332-L336 HydrophobicContact CG2-CG 4.35Å; I332-L336 VanDerWaalsContact O-CG 3.32Å; I332-L336 WeakPolarHBondContact O-CG 3.43Å; I332-L336 PolarHBondContact O-N 3.46Å; H333-L336 PolarHBondContact O-N 3.21Å; L336-K338 PolarHBondContact O-N 2.88Å; L336-R339 PolarHBondContact O-N 2.98Å; L336-L340 PolarHBondContact O-N 3.36Å
337	L	91.9	Very high	90.4	Very high	91 Å²	91	68.5 Å²	68.5	48%	0.476	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-43.2	178.3	-74	176.1	0	0	0	112.7	H333	H333-L337 WeakPolarHBondContact NE2-CD1 3.35Å; H333-L337 PolarHBondContact O-N 3.49Å
338	K	89.1	Confident	90.1	Very high	96 Å²	96	71.6 Å²	71.6	42%	0.417	35%	0.348	S	S	.	.	H	α-helix	trans	-68.1	-38.2	177.2	-72.5	176.4	-179	172	0	111.9	L283 Q334 I335 L336 Y342	L283-K338 HydrophobicContact CD1-CD 3.83Å; Q334-K338 WeakPolarHBondContact O-CG 3.46Å; Q334-K338 PolarHBondContact O-N 2.86Å; Q334-K338 VanDerWaalsContact O-N 3.14Å; I335-K338 PolarHBondContact O-N 3.26Å; L336-K338 PolarHBondContact O-N 2.88Å; K338-Y342 PolarHBondContact O-N 2.7Å
339	R	86.6	Confident	89.6	Confident	95 Å²	95	72 Å²	72	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-40.1	178.7	-176.2	-178.1	-81.6	-176.3	8.2	111.6	F280 I335 L336 W341 Y342 V343	F280-R339 HydrophobicContact CE1-CB 4.4Å; I335-R339 VanDerWaalsContact O-CB 3.27Å; I335-R339 WeakPolarHBondContact O-CB 3.38Å; I335-R339 PolarHBondContact O-N 3.46Å; L336-R339 PolarHBondContact O-N 2.98Å; R339-W341 PolarHBondContact O-N 3.35Å; R339-Y342 PolarHBondContact O-N 2.95Å; R339-V343 HydrophobicContact CG-CG2 3.62Å; R339-V343 WeakPolarHBondContact O-CB 3.17Å; R339-V343 VanDerWaalsContact O-CG2 3.3Å; R339-V343 WeakPolarHBondContact O-CG2 3.2Å; R339-V343 PolarHBondContact O-N 3.42Å
340	L	88.3	Confident	88.7	Confident	116 Å²	116	69.5 Å²	69.5	61%	0.607	33%	0.332	S	S	*	.	H	α-helix	trans	-53.2	-53.5	-178.1	-180	66	0	0	0	112.5	L336 M344	L336-L340 PolarHBondContact O-N 3.36Å; L340-M344 WeakPolarHBondContact O-CB 3.43Å; L340-M344 PolarHBondContact O-N 3.2Å
341	W	89.7	Confident	87.9	Confident	180 Å²	180	71.5 Å²	71.5	68%	0.682	33%	0.333	S	S	*	.	H	α-helix	trans	-65.9	-41	-178.3	-73.7	106.7	0	0	0	113	R339 M344 L345	R339-W341 PolarHBondContact O-N 3.35Å; W341-M344 HydrophobicContact CE3-CE 3.71Å; W341-M344 HydrophobicContact CE3-SD 4.47Å; W341-M344 HydrophobicContact CZ3-CE 3.79Å; W341-M344 HydrophobicContact CZ3-SD 4.38Å; W341-L345 PolarHBondContact O-N 2.86Å; W341-L345 VanDerWaalsContact O-N 3.15Å
342	Y	86.9	Confident	87.5	Confident	30 Å²	30	79.2 Å²	79.2	12%	0.118	36%	0.364	C	S	.	.	H	α-helix	trans	-65.6	-49	179.4	178.6	-94.4	0	0	0	111.5	F280 K338 R339 M344 L345 E346	F280-Y342 AromaticContact CE2-CD1 3.86Å; F280-Y342 HydrophobicContact CE2-CD1 3.86Å; F280-Y342 HydrophobicContact CE2-CE1 4.11Å; F280-Y342 HydrophobicContact CE2-CG 4.07Å; F280-Y342 AromaticContact CZ-CD1 3.98Å; F280-Y342 HydrophobicContact CZ-CD1 3.98Å; F280-Y342 HydrophobicContact CZ-CG 4.12Å; K338-Y342 PolarHBondContact O-N 2.7Å; R339-Y342 PolarHBondContact O-N 2.95Å; Y342-M344 VanDerWaalsContact C-N 3.32Å; Y342-M344 PolarHBondContact O-N 3.44Å; Y342-L345 PolarHBondContact O-N 3.42Å; Y342-E346 WeakPolarHBondContact CE1-OE2 3.37Å; Y342-E346 WeakPolarHBondContact O-CB 3.37Å; Y342-E346 PolarHBondContact O-N 2.75Å
343	V	85.6	Confident	87.1	Confident	57 Å²	57	78.6 Å²	78.6	35%	0.345	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-39	179.7	172.3	0	0	0	0	110.9	R339 L345 E346 Q347	R339-V343 HydrophobicContact CG-CG2 3.62Å; R339-V343 WeakPolarHBondContact O-CB 3.17Å; R339-V343 VanDerWaalsContact O-CG2 3.3Å; R339-V343 WeakPolarHBondContact O-CG2 3.2Å; R339-V343 PolarHBondContact O-N 3.42Å; V343-L345 PolarHBondContact O-N 3.37Å; V343-E346 PolarHBondContact O-N 3.35Å; V343-Q347 HydrophobicContact CG1-CG 4.02Å; V343-Q347 WeakPolarHBondContact O-CB 3.36Å; V343-Q347 WeakPolarHBondContact O-CG 3.3Å; V343-Q347 PolarHBondContact O-N 3.03Å
344	M	89.9	Confident	86.4	Confident	109 Å²	109	74.7 Å²	74.7	54%	0.537	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-46.8	175.2	-175	-163.1	72.4	0	0	111.8	L340 W341 Y342 F348	L340-M344 WeakPolarHBondContact O-CB 3.43Å; L340-M344 PolarHBondContact O-N 3.2Å; W341-M344 HydrophobicContact CE3-CE 3.71Å; W341-M344 HydrophobicContact CE3-SD 4.47Å; W341-M344 HydrophobicContact CZ3-CE 3.79Å; W341-M344 HydrophobicContact CZ3-SD 4.38Å; Y342-M344 VanDerWaalsContact C-N 3.32Å; Y342-M344 PolarHBondContact O-N 3.44Å; M344-F348 WeakPolarHBondContact O-CB 3.43Å; M344-F348 PolarHBondContact O-N 2.91Å
345	L	88.4	Confident	85.7	Confident	46 Å²	46	73 Å²	73	24%	0.241	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-44.3	177.5	177.9	65.8	0	0	0	111.7	V272 L273 C276 W341 Y342 V343 F348 L349	V272-L345 HydrophobicContact CG1-CD2 4.46Å; L273-L345 HydrophobicContact CD2-CG 4.42Å; C276-L345 HydrophobicContact CB-CD2 3.74Å; W341-L345 PolarHBondContact O-N 2.86Å; W341-L345 VanDerWaalsContact O-N 3.15Å; Y342-L345 PolarHBondContact O-N 3.42Å; V343-L345 PolarHBondContact O-N 3.37Å; L345-F348 PolarHBondContact O-N 3.36Å; L345-L349 HydrophobicContact CD1-CD1 4.02Å; L345-L349 HydrophobicContact CD1-CG 4.31Å; L345-L349 HydrophobicContact CG-CD1 4.07Å; L345-L349 WeakPolarHBondContact O-CG 3.29Å; L345-L349 PolarHBondContact O-N 2.98Å
346	E	83.9	Confident	85.4	Confident	17 Å²	17	75.1 Å²	75.1	8%	0.079	36%	0.36	C	S	.	.	H	α-helix	trans	-57.7	-53.1	176.8	-179.5	178.2	-166.6	0	0	111.7	L273 Y342 V343 F348 L349 M350	L273-E346 HydrophobicContact CD2-CB 4.1Å; Y342-E346 WeakPolarHBondContact CE1-OE2 3.37Å; Y342-E346 WeakPolarHBondContact O-CB 3.37Å; Y342-E346 PolarHBondContact O-N 2.75Å; V343-E346 PolarHBondContact O-N 3.35Å; E346-F348 VanDerWaalsContact C-N 3.32Å; E346-F348 PolarHBondContact O-N 3.45Å; E346-L349 PolarHBondContact O-N 3.36Å; E346-M350 HydrophobicContact CG-CG 4.41Å; E346-M350 WeakPolarHBondContact O-CB 3.43Å; E346-M350 WeakPolarHBondContact O-CG 3.43Å; E346-M350 PolarHBondContact O-N 2.77Å
347	Q	84.6	Confident	85	Confident	49 Å²	49	71 Å²	71	23%	0.229	34%	0.34	C	S	.	.	H	α-helix	trans	-63	-38.5	180	-68	-69.7	-53.1	0	0	111.9	V343 K351 E415	V343-Q347 HydrophobicContact CG1-CG 4.02Å; V343-Q347 WeakPolarHBondContact O-CB 3.36Å; V343-Q347 WeakPolarHBondContact O-CG 3.3Å; V343-Q347 PolarHBondContact O-N 3.03Å; Q347-K351 VanDerWaalsContact O-CB 3.29Å; Q347-K351 WeakPolarHBondContact O-CB 3.28Å; Q347-K351 PolarHBondContact O-N 3.43Å; Q347-K351 VanDerWaalsContact OE1-CD 3.31Å; Q347-E415 PolarHBondContact NE2-OE1 3.47Å
348	F	87.9	Confident	84.3	Confident	118 Å²	118	67.1 Å²	67.1	52%	0.518	32%	0.321	S	S	.	.	I	π-helix	trans	-61.2	-48.5	176	174.7	-103.4	0	0	0	112.1	M344 L345 E346 Y352 V353	M344-F348 WeakPolarHBondContact O-CB 3.43Å; M344-F348 PolarHBondContact O-N 2.91Å; L345-F348 PolarHBondContact O-N 3.36Å; E346-F348 VanDerWaalsContact C-N 3.32Å; E346-F348 PolarHBondContact O-N 3.45Å; F348-Y352 HydrophobicContact CD2-CD2 4.21Å; F348-Y352 WeakPolarHBondContact O-CB 3.33Å; F348-Y352 PolarHBondContact O-N 2.91Å; F348-V353 HydrophobicContact CD1-CG2 4.47Å; F348-V353 HydrophobicContact CE1-CG2 4.01Å; F348-V353 HydrophobicContact CZ-CG2 4.36Å; F348-V353 PolarHBondContact O-N 3.41Å
349	L	85.5	Confident	83.8	Confident	22 Å²	22	66 Å²	66	12%	0.115	32%	0.319	C	S	.	.	I	π-helix	trans	-67.8	-46.3	-179.4	-67.1	172.9	0	0	0	111.6	T269 V272 L273 L345 E346 V353 W354	T269-L349 HydrophobicContact CG2-CB 3.85Å; T269-L349 HydrophobicContact CG2-CD1 4.16Å; V272-L349 HydrophobicContact CB-CD1 4.47Å; V272-L349 HydrophobicContact CG1-CD1 3.98Å; L273-L349 HydrophobicContact CD2-CD1 3.97Å; L273-L349 HydrophobicContact CG-CD1 4.04Å; L345-L349 HydrophobicContact CD1-CD1 4.02Å; L345-L349 HydrophobicContact CD1-CG 4.31Å; L345-L349 HydrophobicContact CG-CD1 4.07Å; L345-L349 WeakPolarHBondContact O-CG 3.29Å; L345-L349 PolarHBondContact O-N 2.98Å; E346-L349 PolarHBondContact O-N 3.36Å; L349-V353 HydrophobicContact CD2-CG2 4.09Å; L349-V353 WeakPolarHBondContact O-CB 3.27Å; L349-V353 PolarHBondContact O-N 3.36Å; L349-W354 PolarHBondContact O-N 2.99Å
350	M	78.6	Confident	83.3	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.02	32%	0.323	C	S	.	.	I	π-helix	trans	-72.5	-42.5	-176.3	-67.2	-62.2	-164	0	0	113.1	L273 E346 W354 E415 M418	L273-M350 HydrophobicContact CD1-CE 4.01Å; E346-M350 HydrophobicContact CG-CG 4.41Å; E346-M350 WeakPolarHBondContact O-CB 3.43Å; E346-M350 WeakPolarHBondContact O-CG 3.43Å; E346-M350 PolarHBondContact O-N 2.77Å; M350-W354 HydrophobicContact CE-CZ2 4.44Å; M350-W354 WeakPolarHBondContact O-CB 3.37Å; M350-W354 HydrophobicContact SD-CD2 4.1Å; M350-W354 HydrophobicContact SD-CE3 4.38Å; M350-W354 HydrophobicContact SD-CH2 4.17Å; M350-W354 HydrophobicContact SD-CZ2 3.82Å; M350-W354 HydrophobicContact SD-CZ3 4.44Å; M350-E415 HydrophobicContact CB-CG 4.5Å; M350-M418 HydrophobicContact CE-CB 3.5Å; M350-M418 VanDerWaalsContact CE-CB 3.5Å; M350-M418 HydrophobicContact CE-CE 3.48Å; M350-M418 VanDerWaalsContact CE-CE 3.48Å; M350-M418 HydrophobicContact CE-CG 3.53Å; M350-M418 HydrophobicContact CE-SD 4.36Å
351	K	79.4	Confident	82.7	Confident	101 Å²	101	61.4 Å²	61.4	44%	0.439	30%	0.304	S	S	.	.	I	π-helix	trans	-84.5	-41.8	-175	-68.7	-178	169.1	166.8	0	113.3	Q347 S355	Q347-K351 VanDerWaalsContact O-CB 3.29Å; Q347-K351 WeakPolarHBondContact O-CB 3.28Å; Q347-K351 PolarHBondContact O-N 3.43Å; Q347-K351 VanDerWaalsContact OE1-CD 3.31Å; K351-S355 WeakPolarHBondContact O-CB 3.08Å
352	Y	84	Confident	81.9	Confident	164 Å²	164	53.3 Å²	53.3	64%	0.643	28%	0.275	S	S	*	.	I	π-helix	trans	-98.3	-47.9	-171.3	-61.4	-82.5	0	0	0	112.7	F348 A356	F348-Y352 HydrophobicContact CD2-CD2 4.21Å; F348-Y352 WeakPolarHBondContact O-CB 3.33Å; F348-Y352 PolarHBondContact O-N 2.91Å; Y352-A356 VanDerWaalsContact O-CB 3.31Å; Y352-A356 WeakPolarHBondContact O-CB 3.26Å; Y352-A356 PolarHBondContact O-N 3.41Å
353	V	84.4	Confident	81.3	Confident	50 Å²	50	53.3 Å²	53.3	30%	0.303	28%	0.281	S	S	.	.	I	π-helix	trans	-68.5	-41.1	-177.4	-179.4	0	0	0	0	110.9	V265 F348 L349 S357	V265-V353 HydrophobicContact CG1-CG1 4.09Å; F348-V353 HydrophobicContact CD1-CG2 4.47Å; F348-V353 HydrophobicContact CE1-CG2 4.01Å; F348-V353 HydrophobicContact CZ-CG2 4.36Å; F348-V353 PolarHBondContact O-N 3.41Å; L349-V353 HydrophobicContact CD2-CG2 4.09Å; L349-V353 WeakPolarHBondContact O-CB 3.27Å; L349-V353 PolarHBondContact O-N 3.36Å; V353-S357 WeakPolarHBondContact O-CB 3.48Å; V353-S357 PolarHBondContact O-N 3.49Å
354	W	79.2	Confident	80.7	Confident	28 Å²	28	53.4 Å²	53.4	11%	0.106	28%	0.282	C	S	.	.	H	α-helix	trans	-73.6	-39.8	178.9	-70.7	28.3	0	0	0	112.7	V266 T269 L349 M350 A356 S357 G358 V414	V266-W354 HydrophobicContact CB-CH2 4.32Å; V266-W354 HydrophobicContact CB-CZ2 4.11Å; V266-W354 HydrophobicContact CG1-CH2 3.95Å; V266-W354 HydrophobicContact CG1-CZ2 4Å; V266-W354 HydrophobicContact CG2-CH2 3.69Å; V266-W354 HydrophobicContact CG2-CZ2 3.72Å; V266-W354 HydrophobicContact CG2-CZ3 4.21Å; T269-W354 HydrophobicContact CG2-CZ2 4.32Å; T269-W354 PolarHBondContact OG1-NE1 3.47Å; T269-W354 VanDerWaalsContact OG1-NE1 3.11Å; L349-W354 PolarHBondContact O-N 2.99Å; M350-W354 HydrophobicContact CE-CZ2 4.44Å; M350-W354 WeakPolarHBondContact O-CB 3.37Å; M350-W354 HydrophobicContact SD-CD2 4.1Å; M350-W354 HydrophobicContact SD-CE3 4.38Å; M350-W354 HydrophobicContact SD-CH2 4.17Å; M350-W354 HydrophobicContact SD-CZ2 3.82Å; M350-W354 HydrophobicContact SD-CZ3 4.44Å; W354-A356 VanDerWaalsContact C-N 3.29Å; W354-A356 PolarHBondContact O-N 2.95Å; W354-S357 PolarHBondContact O-N 2.92Å; W354-G358 PolarHBondContact O-N 3.43Å; W354-V414 HydrophobicContact CH2-CB 3.93Å; W354-V414 HydrophobicContact CH2-CG1 3.25Å; W354-V414 HydrophobicContact CH2-CG2 4.4Å; W354-V414 HydrophobicContact CZ2-CG1 4.41Å; W354-V414 HydrophobicContact CZ3-CB 3.5Å; W354-V414 VanDerWaalsContact CZ3-CB 3.5Å; W354-V414 HydrophobicContact CZ3-CG1 3.41Å; W354-V414 VanDerWaalsContact CZ3-CG1 3.41Å; W354-V414 HydrophobicContact CZ3-CG2 3.88Å
355	S	78.9	Confident	79.6	Confident	46 Å²	46	49 Å²	49	32%	0.322	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-41.7	174	-174.3	0	0	0	0	111.2	K351 G358 L359	K351-S355 WeakPolarHBondContact O-CB 3.08Å; S355-G358 PolarHBondContact O-N 2.98Å; S355-L359 WeakPolarHBondContact O-CB 3.42Å; S355-L359 WeakPolarHBondContact O-CG 3.12Å; S355-L359 PolarHBondContact O-N 3.04Å
356	A	81.8	Confident	78.7	Confident	55 Å²	55	48.9 Å²	48.9	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-45.5	173.9	0	0	0	0	0	112.1	Y352 W354 L359 V360	Y352-A356 VanDerWaalsContact O-CB 3.31Å; Y352-A356 WeakPolarHBondContact O-CB 3.26Å; Y352-A356 PolarHBondContact O-N 3.41Å; W354-A356 VanDerWaalsContact C-N 3.29Å; W354-A356 PolarHBondContact O-N 2.95Å; A356-L359 PolarHBondContact O-N 3.06Å; A356-V360 WeakPolarHBondContact O-CG2 3.41Å; A356-V360 PolarHBondContact O-N 2.84Å; A356-V360 VanDerWaalsContact O-N 3.14Å
357	S	80.5	Confident	78	Confident	18 Å²	18	54.8 Å²	54.8	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-63.8	-40.9	176.6	-172.8	0	0	0	0	112.4	V353 W354 V360 M361	V353-S357 WeakPolarHBondContact O-CB 3.48Å; V353-S357 PolarHBondContact O-N 3.49Å; W354-S357 PolarHBondContact O-N 2.92Å; S357-V360 PolarHBondContact O-N 2.76Å; S357-M361 PolarHBondContact O-N 3.01Å
358	G	77.5	Confident	77.1	Confident	8 Å²	8	56.6 Å²	56.6	8%	0.082	31%	0.305	C	S	.	.	H	α-helix	trans	-65.9	-41.5	177.6	0	0	0	0	0	112.2	W354 S355 V360 M361 V362 L407	W354-G358 PolarHBondContact O-N 3.43Å; S355-G358 PolarHBondContact O-N 2.98Å; G358-V360 VanDerWaalsContact C-N 3.31Å; G358-V360 PolarHBondContact O-N 2.67Å; G358-M361 WeakPolarHBondContact O-CA 3.49Å; G358-M361 VanDerWaalsContact O-CB 3.3Å; G358-M361 WeakPolarHBondContact O-CB 3.46Å; G358-M361 PolarHBondContact O-N 3.4Å; G358-V362 PolarHBondContact O-N 3.32Å; G358-L407 WeakPolarHBondContact O-CD1 3.17Å
359	L	77.3	Confident	75.9	Confident	73 Å²	73	52.3 Å²	52.3	38%	0.382	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-41.8	173.9	-78	167.7	0	0	0	111.6	S355 A356 M361 V362 A363 F400	S355-L359 WeakPolarHBondContact O-CB 3.42Å; S355-L359 WeakPolarHBondContact O-CG 3.12Å; S355-L359 PolarHBondContact O-N 3.04Å; A356-L359 PolarHBondContact O-N 3.06Å; L359-M361 VanDerWaalsContact C-N 3.3Å; L359-M361 PolarHBondContact O-N 3.33Å; L359-V362 PolarHBondContact O-N 2.93Å; L359-A363 WeakPolarHBondContact O-CB 3.49Å; L359-A363 PolarHBondContact O-N 2.99Å; L359-F400 HydrophobicContact CD2-CE2 4.44Å; L359-F400 HydrophobicContact CD2-CZ 4.09Å
360	V	77.6	Confident	74.5	Confident	72 Å²	72	56.8 Å²	56.8	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-62	-41.1	172.8	174.2	0	0	0	0	110.7	A356 S357 G358 V362 A363 V364	A356-V360 WeakPolarHBondContact O-CG2 3.41Å; A356-V360 PolarHBondContact O-N 2.84Å; A356-V360 VanDerWaalsContact O-N 3.14Å; S357-V360 PolarHBondContact O-N 2.76Å; G358-V360 VanDerWaalsContact C-N 3.31Å; G358-V360 PolarHBondContact O-N 2.67Å; V360-V362 VanDerWaalsContact C-N 3.31Å; V360-V362 PolarHBondContact O-N 2.79Å; V360-A363 PolarHBondContact O-N 3.32Å; V360-V364 HydrophobicContact CG1-CG2 4.08Å; V360-V364 WeakPolarHBondContact O-CB 3.2Å; V360-V364 VanDerWaalsContact O-CG2 3.29Å; V360-V364 WeakPolarHBondContact O-CG2 3.48Å; V360-V364 PolarHBondContact O-N 2.74Å; V360-V364 VanDerWaalsContact O-N 3.08Å
361	M	74.5	Confident	73.3	Confident	42 Å²	42	58.6 Å²	58.6	21%	0.207	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-36.2	178.8	-167.8	-169.9	81.8	0	0	113.2	L244 P258 A262 S357 G358 L359 P365 L407	L244-M361 HydrophobicContact CD1-CE 3.93Å; P258-M361 HydrophobicContact CB-CG 3.94Å; A262-M361 HydrophobicContact CB-SD 4.26Å; S357-M361 PolarHBondContact O-N 3.01Å; G358-M361 WeakPolarHBondContact O-CA 3.49Å; G358-M361 VanDerWaalsContact O-CB 3.3Å; G358-M361 WeakPolarHBondContact O-CB 3.46Å; G358-M361 PolarHBondContact O-N 3.4Å; L359-M361 VanDerWaalsContact C-N 3.3Å; L359-M361 PolarHBondContact O-N 3.33Å; M361-P365 WeakPolarHBondContact O-CD 3.39Å; M361-P365 WeakPolarHBondContact O-CG 3.48Å; M361-L407 HydrophobicContact CE-CD1 4.11Å; M361-L407 HydrophobicContact CE-CD2 3.54Å; M361-L407 HydrophobicContact CE-CG 4.05Å
362	V	73.4	Confident	72.1	Confident	11 Å²	11	55.4 Å²	55.4	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-86.6	-37.9	178.9	170.9	0	0	0	0	112.1	G358 L359 V360 I366 F400 A403 L407	G358-V362 PolarHBondContact O-N 3.32Å; L359-V362 PolarHBondContact O-N 2.93Å; V360-V362 VanDerWaalsContact C-N 3.31Å; V360-V362 PolarHBondContact O-N 2.79Å; V362-I366 HydrophobicContact CG1-CD1 3.77Å; V362-I366 WeakPolarHBondContact O-CD1 3.4Å; V362-I366 WeakPolarHBondContact O-CG1 3.34Å; V362-F400 HydrophobicContact CG1-CD2 3.72Å; V362-F400 HydrophobicContact CG1-CE2 4.17Å; V362-A403 HydrophobicContact CB-CB 4.41Å; V362-A403 HydrophobicContact CG1-CB 3.75Å; V362-A403 HydrophobicContact CG2-CB 3.66Å; V362-L407 HydrophobicContact CB-CD1 4.41Å; V362-L407 HydrophobicContact CG2-CD1 3.36Å; V362-L407 HydrophobicContact CG2-CG 4.25Å
363	A	74.5	Confident	70.6	Confident	30 Å²	30	48.6 Å²	48.6	25%	0.248	30%	0.302	C	S	.	.	H	α-helix	trans	-68.2	-40.9	-177.7	0	0	0	0	0	112.2	L359 V360 I366 I367	L359-A363 WeakPolarHBondContact O-CB 3.49Å; L359-A363 PolarHBondContact O-N 2.99Å; V360-A363 PolarHBondContact O-N 3.32Å; A363-I366 PolarHBondContact O-N 3.3Å; A363-I367 HydrophobicContact CB-CD1 4.2Å; A363-I367 WeakPolarHBondContact O-CB 3.37Å; A363-I367 WeakPolarHBondContact O-CD1 3.47Å; A363-I367 WeakPolarHBondContact O-CG1 3.34Å; A363-I367 PolarHBondContact O-N 3.08Å
364	V	71.9	Confident	69.1	Low	59 Å²	59	54.9 Å²	54.9	36%	0.358	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-55.4	-176.4	169.4	0	0	0	0	111.6	P258 V360 I366 I367 T368	P258-V364 HydrophobicContact CG-CB 4.4Å; P258-V364 HydrophobicContact CG-CG1 4.1Å; V360-V364 HydrophobicContact CG1-CG2 4.08Å; V360-V364 WeakPolarHBondContact O-CB 3.2Å; V360-V364 VanDerWaalsContact O-CG2 3.29Å; V360-V364 WeakPolarHBondContact O-CG2 3.48Å; V360-V364 PolarHBondContact O-N 2.74Å; V360-V364 VanDerWaalsContact O-N 3.08Å; V364-I366 VanDerWaalsContact C-N 3.28Å; V364-I366 PolarHBondContact O-N 2.9Å; V364-I367 PolarHBondContact O-N 2.91Å; V364-T368 HydrophobicContact CG1-CG2 4.27Å; V364-T368 WeakPolarHBondContact O-CB 3.32Å; V364-T368 WeakPolarHBondContact O-CG2 3.3Å; V364-T368 PolarHBondContact O-N 3.13Å; V364-T368 PolarHBondContact O-OG1 2.7Å
365	P	68.6	Low	67.8	Low	17 Å²	17	60.8 Å²	60.8	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-57.1	-36.3	176.2	-28.1	37.2	0	0	0	114.2	A253 P258 M361 A369	A253-P365 HydrophobicContact CB-CB 3.71Å; P258-P365 HydrophobicContact CG-CG 4.38Å; M361-P365 WeakPolarHBondContact O-CD 3.39Å; M361-P365 WeakPolarHBondContact O-CG 3.48Å; P365-A369 WeakPolarHBondContact O-CA 3.45Å; P365-A369 WeakPolarHBondContact O-CB 3.41Å; P365-A369 PolarHBondContact O-N 3Å
366	I	68.5	Low	66.8	Low	43 Å²	43	61.2 Å²	61.2	22%	0.221	36%	0.357	C	S	.	.	H	α-helix	trans	-73.1	-35.2	-179.5	-66.1	173.7	0	0	0	111.4	V362 A363 V364 R396 F400	V362-I366 HydrophobicContact CG1-CD1 3.77Å; V362-I366 WeakPolarHBondContact O-CD1 3.4Å; V362-I366 WeakPolarHBondContact O-CG1 3.34Å; A363-I366 PolarHBondContact O-N 3.3Å; V364-I366 VanDerWaalsContact C-N 3.28Å; V364-I366 PolarHBondContact O-N 2.9Å; I366-R396 HydrophobicContact CG2-CB 4.42Å; I366-R396 HydrophobicContact CG2-CG 4.45Å; I366-F400 HydrophobicContact CD1-CB 3.82Å; I366-F400 HydrophobicContact CD1-CD2 4.01Å; I366-F400 HydrophobicContact CD1-CG 4.44Å
367	I	70.3	Confident	65.5	Low	140 Å²	140	61.6 Å²	61.6	72%	0.718	36%	0.357	S	S	*	.	H	α-helix	trans	-75.5	-35.5	176.7	-66.7	165.8	0	0	0	111	A363 V364	A363-I367 HydrophobicContact CB-CD1 4.2Å; A363-I367 WeakPolarHBondContact O-CB 3.37Å; A363-I367 WeakPolarHBondContact O-CD1 3.47Å; A363-I367 WeakPolarHBondContact O-CG1 3.34Å; A363-I367 PolarHBondContact O-N 3.08Å; V364-I367 PolarHBondContact O-N 2.91Å
368	T	65.8	Low	64.4	Low	88 Å²	88	66.5 Å²	66.5	54%	0.54	38%	0.377	S	S	.	.	H	α-helix	trans	-94.3	-8.3	-177.7	62.9	0	0	0	0	114	V364 T370	V364-T368 HydrophobicContact CG1-CG2 4.27Å; V364-T368 WeakPolarHBondContact O-CB 3.32Å; V364-T368 WeakPolarHBondContact O-CG2 3.3Å; V364-T368 PolarHBondContact O-N 3.13Å; V364-T368 PolarHBondContact O-OG1 2.7Å; T368-T370 PolarHBondContact O-N 3.18Å
369	A	61.9	Low	63.3	Low	27 Å²	27	73.8 Å²	73.8	22%	0.223	41%	0.409	C	S	.	.			trans	-66.4	126.1	179.4	0	0	0	0	0	110.8	P365 G371	P365-A369 WeakPolarHBondContact O-CA 3.45Å; P365-A369 WeakPolarHBondContact O-CB 3.41Å; P365-A369 PolarHBondContact O-N 3Å; A369-G371 PolarHBondContact O-N 3.28Å
370	T	55.6	Low	62.3	Low	117 Å²	117	73.6 Å²	73.6	72%	0.718	41%	0.411	S	S	*	.			trans	-79.1	-3.2	175.8	50	0	0	0	0	113.2	T368	T368-T370 PolarHBondContact O-N 3.18Å
371	G	53.8	Low	61.3	Low	42 Å²	42	73.1 Å²	73.1	43%	0.433	40%	0.403	S	S	.	.	S	Bend	trans	92.9	-2.3	177.1	0	0	0	0	0	115.6	A369	A369-G371 PolarHBondContact O-N 3.28Å
372	Y	54.2	Low	60.4	Low	34 Å²	34	79.8 Å²	79.8	13%	0.133	43%	0.426	C	S	.	.	S	Bend	trans	-144.9	149.6	-179.2	-62.6	-69.2	0	0	0	113.5	V380 K381 A384 M385	Y372-V380 WeakPolarHBondContact CE1-O 3.22Å; Y372-V380 PolarHBondContact OH-O 2.89Å; Y372-K381 HydrophobicContact CD1-CG 4.33Å; Y372-K381 VanDerWaalsContact CE1-CA 3.46Å; Y372-K381 WeakPolarHBondContact CE2-O 3.22Å; Y372-K381 HydrophobicContact CG-CG 4.25Å; Y372-K381 PolarHBondContact OH-O 2.85Å; Y372-A384 HydrophobicContact CD1-CB 4.25Å; Y372-A384 HydrophobicContact CE1-CB 3.14Å; Y372-A384 HydrophobicContact CE2-CB 4.25Å; Y372-A384 WeakPolarHBondContact OH-CA 3.33Å; Y372-A384 WeakPolarHBondContact OH-CB 3.36Å; Y372-A384 PolarHBondContact OH-N 2.7Å; Y372-M385 HydrophobicContact CE2-CG 4.08Å; Y372-M385 PolarHBondContact OH-N 2.73Å
373	S	53.4	Low	59.6	Low	21 Å²	21	82 Å²	82	15%	0.147	45%	0.446	C	S	.	.			trans	-79.9	148.1	170.4	-172.2	0	0	0	0	111.3	N375 D376	S373-N375 PolarHBondContact O-N 3.32Å; S373-D376 WeakPolarHBondContact CB-OD2 3.37Å; S373-D376 PolarHBondContact N-OD2 3.38Å; S373-D376 PolarHBondContact O-N 3.07Å
374	K	51.2	Low	58.8	Low	182 Å²	182	81.8 Å²	81.8	79%	0.791	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.4	174.5	-78.9	179.4	178.6	169.9	0	113.1
375	N	53.2	Low	58	Low	151 Å²	151	86.4 Å²	86.4	81%	0.807	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	1.4	-177.4	-67.3	-2.6	0	0	0	114.5	S373	S373-N375 PolarHBondContact O-N 3.32Å
376	D	56.8	Low	57.4	Low	55 Å²	55	91.4 Å²	91.4	29%	0.294	49%	0.493	S	S	.	.	S	Bend	trans	-76.4	146.6	-178.5	-67.2	-25.5	0	0	0	111.8	S373 V380 K381	S373-D376 WeakPolarHBondContact CB-OD2 3.37Å; S373-D376 PolarHBondContact N-OD2 3.38Å; S373-D376 PolarHBondContact O-N 3.07Å; D376-V380 HydrophobicContact CB-CB 4.23Å; D376-V380 HydrophobicContact CB-CG1 4.1Å; D376-K381 VanDerWaalsContact O-CE 3.22Å; D376-K381 WeakPolarHBondContact O-CE 3.33Å
377	S	55.4	Low	57.1	Low	64 Å²	64	92.2 Å²	92.2	45%	0.448	50%	0.497	S	S	.	.			trans	-65.2	153.1	176.4	72.1	0	0	0	0	111.4	E379 V380 K381	S377-E379 PolarHBondContact O-N 3.42Å; S377-E379 VanDerWaalsContact O-N 3.09Å; S377-V380 PolarHBondContact O-N 3.23Å; S377-V380 WeakPolarHBondContact OG-CG2 3.26Å; S377-K381 PolarHBondContact O-N 3.46Å; S377-K381 VanDerWaalsContact O-N 3.1Å
378	E	56.6	Low	56.7	Low	120 Å²	120	92.7 Å²	92.7	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-57.9	-24.5	-179.8	-76.8	-62.7	129.4	0	0	113.4	K381 R382	E378-K381 WeakPolarHBondContact OE1-CD 3.38Å; E378-K381 IonicContact OE1-NZ 3.32Å; E378-K381 PolarHBondContact OE1-NZ 3.4Å; E378-R382 WeakPolarHBondContact O-CG 3.21Å; E378-R382 PolarHBondContact O-N 3.02Å
379	E	54.1	Low	56.6	Low	161 Å²	161	96.2 Å²	96.2	75%	0.752	50%	0.504	S	S	*	.	H	α-helix	trans	-71.3	-42.2	174.8	-65.6	179	169.8	0	0	112.3	S377 K381 R382 A383	S377-E379 PolarHBondContact O-N 3.42Å; S377-E379 VanDerWaalsContact O-N 3.09Å; E379-K381 VanDerWaalsContact C-N 3.32Å; E379-R382 PolarHBondContact O-N 3.48Å; E379-A383 PolarHBondContact O-N 2.91Å
380	V	57.2	Low	56.6	Low	70 Å²	70	102.5 Å²	102.5	42%	0.424	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-40.1	175.6	176.4	0	0	0	0	109.8	Y372 D376 S377 R382 A383 A384	Y372-V380 WeakPolarHBondContact CE1-O 3.22Å; Y372-V380 PolarHBondContact OH-O 2.89Å; D376-V380 HydrophobicContact CB-CB 4.23Å; D376-V380 HydrophobicContact CB-CG1 4.1Å; S377-V380 PolarHBondContact O-N 3.23Å; S377-V380 WeakPolarHBondContact OG-CG2 3.26Å; V380-R382 VanDerWaalsContact C-N 3.25Å; V380-R382 PolarHBondContact O-N 3Å; V380-A383 PolarHBondContact O-N 2.88Å; V380-A383 VanDerWaalsContact O-N 3.13Å; V380-A384 PolarHBondContact O-N 3.26Å
381	K	56.6	Low	57.1	Low	61 Å²	61	99.9 Å²	99.9	27%	0.265	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-22.5	174.3	-67.3	-176.6	-164.1	161.7	0	114.9	Y372 D376 S377 E378 E379	Y372-K381 HydrophobicContact CD1-CG 4.33Å; Y372-K381 VanDerWaalsContact CE1-CA 3.46Å; Y372-K381 WeakPolarHBondContact CE2-O 3.22Å; Y372-K381 HydrophobicContact CG-CG 4.25Å; Y372-K381 PolarHBondContact OH-O 2.85Å; D376-K381 VanDerWaalsContact O-CE 3.22Å; D376-K381 WeakPolarHBondContact O-CE 3.33Å; S377-K381 PolarHBondContact O-N 3.46Å; S377-K381 VanDerWaalsContact O-N 3.1Å; E378-K381 WeakPolarHBondContact OE1-CD 3.38Å; E378-K381 IonicContact OE1-NZ 3.32Å; E378-K381 PolarHBondContact OE1-NZ 3.4Å; E379-K381 VanDerWaalsContact C-N 3.32Å
382	R	55.1	Low	57.8	Low	182 Å²	182	100 Å²	100	69%	0.687	50%	0.501	S	S	*	.	H	α-helix	trans	-85.1	-37.2	170.6	-73.9	179.9	-176.3	-175.1	1.5	111.4	E378 E379 V380 M385 V386	E378-R382 WeakPolarHBondContact O-CG 3.21Å; E378-R382 PolarHBondContact O-N 3.02Å; E379-R382 PolarHBondContact O-N 3.48Å; V380-R382 VanDerWaalsContact C-N 3.25Å; V380-R382 PolarHBondContact O-N 3Å; R382-M385 PolarHBondContact O-N 2.88Å; R382-V386 WeakPolarHBondContact O-CG2 3.5Å; R382-V386 PolarHBondContact O-N 2.91Å
383	A	56.3	Low	58.7	Low	58 Å²	58	101.8 Å²	101.8	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-44.8	-176.9	0	0	0	0	0	114	E379 V380 M385 V386 M387	E379-A383 PolarHBondContact O-N 2.91Å; V380-A383 PolarHBondContact O-N 2.88Å; V380-A383 VanDerWaalsContact O-N 3.13Å; A383-M385 VanDerWaalsContact C-N 3.32Å; A383-M385 PolarHBondContact O-N 2.76Å; A383-V386 PolarHBondContact O-N 3.38Å; A383-M387 PolarHBondContact O-N 2.9Å
384	A	57.6	Low	59.7	Low	25 Å²	25	100.8 Å²	100.8	21%	0.207	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.4	177.2	0	0	0	0	0	115.4	Y372 V380 V386 M387	Y372-A384 HydrophobicContact CD1-CB 4.25Å; Y372-A384 HydrophobicContact CE1-CB 3.14Å; Y372-A384 HydrophobicContact CE2-CB 4.25Å; Y372-A384 WeakPolarHBondContact OH-CA 3.33Å; Y372-A384 WeakPolarHBondContact OH-CB 3.36Å; Y372-A384 PolarHBondContact OH-N 2.7Å; V380-A384 PolarHBondContact O-N 3.26Å; A384-V386 VanDerWaalsContact C-N 3.32Å; A384-M387 HydrophobicContact CB-CG 4.39Å; A384-M387 HydrophobicContact CB-SD 3.73Å
385	M	55.6	Low	60.7	Low	157 Å²	157	95.5 Å²	95.5	77%	0.773	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-20.4	169.8	-83.4	-171.4	-179.8	0	0	109.6	Y372 R382 A383	Y372-M385 HydrophobicContact CE2-CG 4.08Å; Y372-M385 PolarHBondContact OH-N 2.73Å; R382-M385 PolarHBondContact O-N 2.88Å; A383-M385 VanDerWaalsContact C-N 3.32Å; A383-M385 PolarHBondContact O-N 2.76Å
386	V	56.9	Low	61.7	Low	121 Å²	121	94.2 Å²	94.2	73%	0.733	47%	0.47	S	S	*	.	S	Bend	trans	-99.3	-7.9	178.1	-178.7	0	0	0	0	111.8	R382 A383 A384 K388	R382-V386 WeakPolarHBondContact O-CG2 3.5Å; R382-V386 PolarHBondContact O-N 2.91Å; A383-V386 PolarHBondContact O-N 3.38Å; A384-V386 VanDerWaalsContact C-N 3.32Å; V386-K388 PolarHBondContact O-N 3.26Å
387	M	61.7	Low	62.8	Low	61 Å²	61	93.6 Å²	93.6	30%	0.3	47%	0.468	S	S	.	.	S	Bend	trans	-63	135	175.6	-78.6	178	86.2	0	0	111.5	A383 A384 D391 L392	A383-M387 PolarHBondContact O-N 2.9Å; A384-M387 HydrophobicContact CB-CG 4.39Å; A384-M387 HydrophobicContact CB-SD 3.73Å; M387-D391 HydrophobicContact CE-CB 4.15Å; M387-L392 HydrophobicContact CB-CD1 4.4Å; M387-L392 HydrophobicContact CB-CD2 4.2Å; M387-L392 HydrophobicContact CB-CG 4.04Å; M387-L392 HydrophobicContact SD-CD2 4.4Å
388	K	61.7	Low	63.9	Low	149 Å²	149	92.5 Å²	92.5	65%	0.648	46%	0.456	S	S	*	.			trans	-62.9	145.9	176.1	-72.4	179	177.9	177.6	0	110.4	V386 E390 D391 L392	V386-K388 PolarHBondContact O-N 3.26Å; K388-E390 PolarHBondContact O-N 3.21Å; K388-E390 VanDerWaalsContact O-N 3.16Å; K388-D391 PolarHBondContact O-N 2.88Å; K388-L392 PolarHBondContact O-N 2.85Å; K388-L392 VanDerWaalsContact O-N 3.16Å
389	E	63.5	Low	64.7	Low	163 Å²	163	87.6 Å²	87.6	76%	0.762	44%	0.436	S	S	*	.	H	α-helix	trans	-56.3	-34.2	-180	-162	171.1	-170.8	0	0	112.1	L392 V393	E389-L392 PolarHBondContact O-N 3.18Å; E389-V393 VanDerWaalsContact O-CG2 3.24Å; E389-V393 WeakPolarHBondContact O-CG2 3.47Å; E389-V393 PolarHBondContact O-N 3.44Å
390	E	62.4	Low	66	Low	159 Å²	159	83.2 Å²	83.2	74%	0.743	41%	0.414	S	S	*	.	H	α-helix	trans	-62.4	-40	174.9	-62.7	-177.9	162.5	0	0	113.2	K388 S394	K388-E390 PolarHBondContact O-N 3.21Å; K388-E390 VanDerWaalsContact O-N 3.16Å; E390-S394 PolarHBondContact O-N 3.49Å; E390-S394 VanDerWaalsContact O-N 3.09Å
391	D	65.9	Low	67.1	Low	62 Å²	62	80.3 Å²	80.3	33%	0.332	40%	0.397	S	S	.	.	H	α-helix	trans	-73.7	-37.8	179.5	-71.5	-43.5	0	0	0	111.6	M387 K388 S394 E395	M387-D391 HydrophobicContact CE-CB 4.15Å; K388-D391 PolarHBondContact O-N 2.88Å; D391-S394 PolarHBondContact O-N 3.4Å; D391-E395 PolarHBondContact O-N 3.43Å
392	L	68.8	Low	68.3	Low	45 Å²	45	78.7 Å²	78.7	24%	0.236	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-41.3	174.2	-70.9	167.4	0	0	0	111.9	M387 K388 E389 S394 R396	M387-L392 HydrophobicContact CB-CD1 4.4Å; M387-L392 HydrophobicContact CB-CD2 4.2Å; M387-L392 HydrophobicContact CB-CG 4.04Å; M387-L392 HydrophobicContact SD-CD2 4.4Å; K388-L392 PolarHBondContact O-N 2.85Å; K388-L392 VanDerWaalsContact O-N 3.16Å; E389-L392 PolarHBondContact O-N 3.18Å; L392-S394 VanDerWaalsContact C-N 3.34Å; L392-R396 WeakPolarHBondContact O-CB 3.33Å; L392-R396 VanDerWaalsContact O-CG 3.24Å; L392-R396 WeakPolarHBondContact O-CG 3.19Å; L392-R396 PolarHBondContact O-N 3.45Å; L392-R396 VanDerWaalsContact O-N 3.08Å
393	V	72.7	Confident	69.4	Low	71 Å²	71	70.6 Å²	70.6	43%	0.43	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-40.3	175.6	170.8	0	0	0	0	110.7	E389 T397	E389-V393 VanDerWaalsContact O-CG2 3.24Å; E389-V393 WeakPolarHBondContact O-CG2 3.47Å; E389-V393 PolarHBondContact O-N 3.44Å; V393-T397 WeakPolarHBondContact O-CB 3.42Å; V393-T397 PolarHBondContact O-N 3.43Å; V393-T397 PolarHBondContact O-OG1 3.34Å
394	S	73.3	Confident	70.6	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63.6	-46.1	177.5	-169.4	0	0	0	0	112.7	R135 Q139 E390 D391 L392 T397 Q398	R135-S394 WeakPolarHBondContact CG-OG 3.38Å; Q139-S394 WeakPolarHBondContact CG-OG 3.4Å; E390-S394 PolarHBondContact O-N 3.49Å; E390-S394 VanDerWaalsContact O-N 3.09Å; D391-S394 PolarHBondContact O-N 3.4Å; L392-S394 VanDerWaalsContact C-N 3.34Å; S394-T397 PolarHBondContact O-N 3.15Å; S394-Q398 PolarHBondContact O-N 3.25Å
395	E	72.6	Confident	71.8	Confident	71 Å²	71	73.5 Å²	73.5	33%	0.332	36%	0.36	S	S	.	.	H	α-helix	trans	-69.4	-35.1	179.4	-71.5	-166.1	165.8	0	0	113.8	R135 D391 T397 A399	R135-E395 IonicContact CZ-OE1 3.92Å; R135-E395 IonicContact NH1-OE1 3.8Å; R135-E395 IonicContact NH2-OE1 3.21Å; R135-E395 PolarHBondContact NH2-OE1 3Å; D391-E395 PolarHBondContact O-N 3.43Å; E395-T397 VanDerWaalsContact C-N 3.33Å; E395-A399 WeakPolarHBondContact O-CB 3.4Å; E395-A399 PolarHBondContact O-N 3.29Å
396	R	74.5	Confident	73.1	Confident	123 Å²	123	66.4 Å²	66.4	46%	0.464	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-40	171.6	-71.6	173.2	-173.8	178.5	2.1	110.9	I366 L392 A399 F400	I366-R396 HydrophobicContact CG2-CB 4.42Å; I366-R396 HydrophobicContact CG2-CG 4.45Å; L392-R396 WeakPolarHBondContact O-CB 3.33Å; L392-R396 VanDerWaalsContact O-CG 3.24Å; L392-R396 WeakPolarHBondContact O-CG 3.19Å; L392-R396 PolarHBondContact O-N 3.45Å; L392-R396 VanDerWaalsContact O-N 3.08Å; R396-A399 PolarHBondContact O-N 3.38Å; R396-F400 WeakPolarHBondContact O-CB 3.42Å; R396-F400 PolarHBondContact O-N 3.37Å
397	T	79.4	Confident	74.2	Confident	42 Å²	42	62.1 Å²	62.1	26%	0.258	30%	0.298	S	S	.	.	H	α-helix	trans	-68.3	-41.6	178.6	-54.4	0	0	0	0	112	V134 V138 V393 S394 E395 T401	V134-T397 HydrophobicContact CG1-CG2 3.91Å; V138-T397 HydrophobicContact CG2-CG2 4.07Å; V393-T397 WeakPolarHBondContact O-CB 3.42Å; V393-T397 PolarHBondContact O-N 3.43Å; V393-T397 PolarHBondContact O-OG1 3.34Å; S394-T397 PolarHBondContact O-N 3.15Å; E395-T397 VanDerWaalsContact C-N 3.33Å; T397-T401 WeakPolarHBondContact O-CB 3.49Å; T397-T401 PolarHBondContact O-N 3.43Å; T397-T401 PolarHBondContact O-OG1 3.37Å
398	Q	78.8	Confident	75	Confident	42 Å²	42	62.5 Å²	62.5	20%	0.196	30%	0.301	C	S	.	.	H	α-helix	trans	-57.7	-54.5	172.8	178.6	-179.5	1.3	0	0	110.5	R135 S394 F400 T401 T402	R135-Q398 HydrophobicContact CB-CB 4.19Å; R135-Q398 HydrophobicContact CG-CB 4.45Å; S394-Q398 PolarHBondContact O-N 3.25Å; Q398-F400 VanDerWaalsContact C-N 3.34Å; Q398-F400 PolarHBondContact O-N 3.27Å; Q398-T401 PolarHBondContact O-N 2.89Å; Q398-T402 PolarHBondContact O-N 3.01Å; Q398-T402 PolarHBondContact O-OG1 3Å; Q398-T402 VanDerWaalsContact O-OG1 3.12Å
399	A	73.9	Confident	76	Confident	16 Å²	16	57.5 Å²	57.5	13%	0.132	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-37.2	-176.8	0	0	0	0	0	112.9	E395 R396 A403	E395-A399 WeakPolarHBondContact O-CB 3.4Å; E395-A399 PolarHBondContact O-N 3.29Å; R396-A399 PolarHBondContact O-N 3.38Å; A399-A403 WeakPolarHBondContact O-CB 3.38Å; A399-A403 PolarHBondContact O-N 2.95Å
400	F	80.5	Confident	76.8	Confident	69 Å²	69	50.6 Å²	50.6	30%	0.303	26%	0.259	S	S	.	.	H	α-helix	trans	-61	-47.6	172.4	178	-99.1	0	0	0	111.3	L359 V362 I366 R396 Q398 A403 R404	L359-F400 HydrophobicContact CD2-CE2 4.44Å; L359-F400 HydrophobicContact CD2-CZ 4.09Å; V362-F400 HydrophobicContact CG1-CD2 3.72Å; V362-F400 HydrophobicContact CG1-CE2 4.17Å; I366-F400 HydrophobicContact CD1-CB 3.82Å; I366-F400 HydrophobicContact CD1-CD2 4.01Å; I366-F400 HydrophobicContact CD1-CG 4.44Å; R396-F400 WeakPolarHBondContact O-CB 3.42Å; R396-F400 PolarHBondContact O-N 3.37Å; Q398-F400 VanDerWaalsContact C-N 3.34Å; Q398-F400 PolarHBondContact O-N 3.27Å; F400-A403 PolarHBondContact O-N 2.77Å; F400-R404 VanDerWaalsContact O-CB 3.23Å; F400-R404 WeakPolarHBondContact O-CB 3.4Å; F400-R404 PolarHBondContact O-N 2.9Å
401	T	81	Confident	77.6	Confident	9 Å²	9	44.1 Å²	44.1	6%	0.055	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-46.5	-178.4	-57.3	0	0	0	0	111.4	V134 T397 Q398 R404 N405	V134-T401 HydrophobicContact CB-CG2 4.39Å; V134-T401 HydrophobicContact CG2-CG2 4.02Å; T397-T401 WeakPolarHBondContact O-CB 3.49Å; T397-T401 PolarHBondContact O-N 3.43Å; T397-T401 PolarHBondContact O-OG1 3.37Å; Q398-T401 PolarHBondContact O-N 2.89Å; T401-R404 PolarHBondContact O-N 2.9Å; T401-N405 WeakPolarHBondContact O-CB 3.13Å; T401-N405 PolarHBondContact O-N 3.39Å; T401-N405 PolarHBondContact O-OD1 3.07Å
402	T	81.1	Confident	78.3	Confident	27 Å²	27	45.1 Å²	45.1	17%	0.166	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-46	176.8	-57.4	0	0	0	0	111.1	Q398 R404 N405 L406	Q398-T402 PolarHBondContact O-N 3.01Å; Q398-T402 PolarHBondContact O-OG1 3Å; Q398-T402 VanDerWaalsContact O-OG1 3.12Å; T402-R404 PolarHBondContact O-N 3Å; T402-N405 PolarHBondContact O-N 2.86Å; T402-L406 HydrophobicContact CG2-CD1 4.09Å; T402-L406 HydrophobicContact CG2-CG 4.45Å; T402-L406 WeakPolarHBondContact O-CB 3.37Å; T402-L406 VanDerWaalsContact O-CG 3.27Å; T402-L406 WeakPolarHBondContact O-CG 3.26Å; T402-L406 PolarHBondContact O-N 3.16Å
403	A	79.6	Confident	79.1	Confident	13 Å²	13	43.1 Å²	43.1	11%	0.107	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-36.7	178.7	0	0	0	0	0	112.7	L244 V362 A399 F400 L407	L244-A403 HydrophobicContact CD2-CB 3.85Å; V362-A403 HydrophobicContact CB-CB 4.41Å; V362-A403 HydrophobicContact CG1-CB 3.75Å; V362-A403 HydrophobicContact CG2-CB 3.66Å; A399-A403 WeakPolarHBondContact O-CB 3.38Å; A399-A403 PolarHBondContact O-N 2.95Å; F400-A403 PolarHBondContact O-N 2.77Å; A403-L407 WeakPolarHBondContact O-CB 3.48Å; A403-L407 WeakPolarHBondContact O-CG 3.33Å; A403-L407 PolarHBondContact O-N 3.39Å
404	R	80.7	Confident	79.5	Confident	108 Å²	108	41.1 Å²	41.1	41%	0.408	22%	0.216	S	C	.	.	H	α-helix	trans	-64.1	-46.1	173.5	-176.2	-173.1	69.1	162.4	-0.7	111.9	F400 T401 T402 L407 N408	F400-R404 VanDerWaalsContact O-CB 3.23Å; F400-R404 WeakPolarHBondContact O-CB 3.4Å; F400-R404 PolarHBondContact O-N 2.9Å; T401-R404 PolarHBondContact O-N 2.9Å; T402-R404 PolarHBondContact O-N 3Å; R404-L407 PolarHBondContact O-N 2.92Å; R404-N408 PolarHBondContact O-N 3.41Å
405	N	82.6	Confident	79.8	Confident	36 Å²	36	42.9 Å²	42.9	19%	0.193	22%	0.224	C	C	.	.	H	α-helix	trans	-66.1	-40.9	179.8	-71.7	3.6	0	0	0	111.3	A127 D130 T401 T402 N408 A409	A127-N405 HydrophobicContact CB-CB 4.41Å; D130-N405 PolarHBondContact OD2-ND2 3.49Å; T401-N405 WeakPolarHBondContact O-CB 3.13Å; T401-N405 PolarHBondContact O-N 3.39Å; T401-N405 PolarHBondContact O-OD1 3.07Å; T402-N405 PolarHBondContact O-N 2.86Å; N405-N408 PolarHBondContact O-N 2.88Å; N405-A409 PolarHBondContact O-N 3.15Å
406	L	82.8	Confident	80.3	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-45.2	172.7	-75.7	177.6	0	0	0	111.8	I124 A127 T240 T243 L244 T402 N408 A409 A410	I124-L406 HydrophobicContact CG1-CD2 4.37Å; A127-L406 HydrophobicContact CB-CD2 4.1Å; A127-L406 HydrophobicContact CB-CG 4.41Å; T240-L406 HydrophobicContact CG2-CB 3.79Å; T240-L406 HydrophobicContact CG2-CD2 4.27Å; T240-L406 WeakPolarHBondContact CG2-O 3.32Å; T243-L406 HydrophobicContact CG2-CD1 3.97Å; L244-L406 HydrophobicContact CD2-CB 4.26Å; L244-L406 HydrophobicContact CD2-CD1 4.28Å; L244-L406 HydrophobicContact CG-CB 4.46Å; T402-L406 HydrophobicContact CG2-CD1 4.09Å; T402-L406 HydrophobicContact CG2-CG 4.45Å; T402-L406 WeakPolarHBondContact O-CB 3.37Å; T402-L406 VanDerWaalsContact O-CG 3.27Å; T402-L406 WeakPolarHBondContact O-CG 3.26Å; T402-L406 PolarHBondContact O-N 3.16Å; L406-N408 PolarHBondContact O-N 2.96Å; L406-A409 PolarHBondContact O-N 3.45Å; L406-A410 PolarHBondContact O-N 3.46Å
407	L	79.9	Confident	80.8	Confident	31 Å²	31	41.3 Å²	41.3	16%	0.162	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-42.2	176	-89.5	179.2	0	0	0	113.5	L244 G358 M361 V362 A403 R404 A409 A410 A411	L244-L407 HydrophobicContact CD1-CD2 3.99Å; L244-L407 HydrophobicContact CD1-CG 4.14Å; G358-L407 WeakPolarHBondContact O-CD1 3.17Å; M361-L407 HydrophobicContact CE-CD1 4.11Å; M361-L407 HydrophobicContact CE-CD2 3.54Å; M361-L407 HydrophobicContact CE-CG 4.05Å; V362-L407 HydrophobicContact CB-CD1 4.41Å; V362-L407 HydrophobicContact CG2-CD1 3.36Å; V362-L407 HydrophobicContact CG2-CG 4.25Å; A403-L407 WeakPolarHBondContact O-CB 3.48Å; A403-L407 WeakPolarHBondContact O-CG 3.33Å; A403-L407 PolarHBondContact O-N 3.39Å; R404-L407 PolarHBondContact O-N 2.92Å; L407-A409 VanDerWaalsContact C-N 3.34Å; L407-A410 PolarHBondContact O-N 3.08Å; L407-A411 WeakPolarHBondContact O-CB 3.45Å; L407-A411 PolarHBondContact O-N 3.42Å
408	N	80.1	Confident	80.6	Confident	68 Å²	68	41.8 Å²	41.8	36%	0.364	22%	0.218	S	C	.	.	H	α-helix	trans	-62.7	-43.3	175.7	-72.5	-16	0	0	0	110.8	R404 N405 L406 A410 A411 D412	R404-N408 PolarHBondContact O-N 3.41Å; N405-N408 PolarHBondContact O-N 2.88Å; L406-N408 PolarHBondContact O-N 2.96Å; N408-A410 VanDerWaalsContact C-N 3.34Å; N408-A410 PolarHBondContact O-N 3.29Å; N408-A411 PolarHBondContact O-N 3.13Å; N408-D412 PolarHBondContact O-N 2.83Å
409	A	81.3	Confident	80.3	Confident	45 Å²	45	42.1 Å²	42.1	37%	0.372	23%	0.225	S	C	.	.	H	α-helix	trans	-62.5	-39.3	175.6	0	0	0	0	0	112.6	N405 L406 L407 A413	N405-A409 PolarHBondContact O-N 3.15Å; L406-A409 PolarHBondContact O-N 3.45Å; L407-A409 VanDerWaalsContact C-N 3.34Å; A409-A413 WeakPolarHBondContact O-CB 3.35Å; A409-A413 PolarHBondContact O-N 3.23Å
410	A	80.2	Confident	80.8	Confident	18 Å²	18	41.4 Å²	41.4	15%	0.149	22%	0.219	C	C	.	.	H	α-helix	trans	-67.4	-40.4	174.5	0	0	0	0	0	112.2	T240 L406 L407 N408 A413 V414	T240-A410 HydrophobicContact CG2-CB 3.88Å; L406-A410 PolarHBondContact O-N 3.46Å; L407-A410 PolarHBondContact O-N 3.08Å; N408-A410 VanDerWaalsContact C-N 3.34Å; N408-A410 PolarHBondContact O-N 3.29Å; A410-A413 PolarHBondContact O-N 3.36Å; A410-V414 WeakPolarHBondContact O-CG2 3.48Å; A410-V414 PolarHBondContact O-N 2.94Å
411	A	79.7	Confident	80.6	Confident	22 Å²	22	44.5 Å²	44.5	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-62.7	-46.3	175.5	0	0	0	0	0	111.1	L407 N408 A413 V414 E415	L407-A411 WeakPolarHBondContact O-CB 3.45Å; L407-A411 PolarHBondContact O-N 3.42Å; N408-A411 PolarHBondContact O-N 3.13Å; A411-A413 VanDerWaalsContact C-N 3.3Å; A411-A413 PolarHBondContact O-N 2.75Å; A411-V414 PolarHBondContact O-N 3.14Å; A411-E415 WeakPolarHBondContact O-CB 3.22Å; A411-E415 PolarHBondContact O-N 3.04Å
412	D	81.8	Confident	80.2	Confident	84 Å²	84	47.4 Å²	47.4	45%	0.449	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-40.5	174.6	-74.2	-13	0	0	0	111.7	N408 E415 R416	N408-D412 PolarHBondContact O-N 2.83Å; D412-E415 PolarHBondContact O-N 3.45Å; D412-R416 WeakPolarHBondContact O-CG 3.41Å; D412-R416 PolarHBondContact O-N 2.91Å
413	A	84.9	Confident	80.2	Confident	2 Å²	2	48.3 Å²	48.3	2%	0.017	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-46.6	176.5	0	0	0	0	0	111.4	P233 D236 V237 A409 A410 A411 E415 R416 I417	P233-A413 HydrophobicContact CB-CB 3.9Å; P233-A413 WeakPolarHBondContact CB-O 3.04Å; D236-A413 HydrophobicContact CB-CB 3.91Å; V237-A413 HydrophobicContact CG2-CB 3.76Å; A409-A413 WeakPolarHBondContact O-CB 3.35Å; A409-A413 PolarHBondContact O-N 3.23Å; A410-A413 PolarHBondContact O-N 3.36Å; A411-A413 VanDerWaalsContact C-N 3.3Å; A411-A413 PolarHBondContact O-N 2.75Å; A413-E415 PolarHBondContact O-N 3.37Å; A413-R416 WeakPolarHBondContact O-CB 3.33Å; A413-R416 PolarHBondContact O-N 2.99Å; A413-I417 WeakPolarHBondContact O-CG1 3.43Å; A413-I417 PolarHBondContact O-N 3.36Å
414	V	80.8	Confident	80.5	Confident	30 Å²	30	49 Å²	49	18%	0.182	25%	0.247	C	C	.	.	H	α-helix	trans	-68.9	-35	177.9	-176.9	0	0	0	0	112.4	V237 W354 A410 A411 R416 I417 M418	V237-V414 HydrophobicContact CG1-CG2 4.43Å; V237-V414 HydrophobicContact CG2-CG2 3.46Å; V237-V414 VanDerWaalsContact CG2-CG2 3.46Å; W354-V414 HydrophobicContact CH2-CB 3.93Å; W354-V414 HydrophobicContact CH2-CG1 3.25Å; W354-V414 HydrophobicContact CH2-CG2 4.4Å; W354-V414 HydrophobicContact CZ2-CG1 4.41Å; W354-V414 HydrophobicContact CZ3-CB 3.5Å; W354-V414 VanDerWaalsContact CZ3-CB 3.5Å; W354-V414 HydrophobicContact CZ3-CG1 3.41Å; W354-V414 VanDerWaalsContact CZ3-CG1 3.41Å; W354-V414 HydrophobicContact CZ3-CG2 3.88Å; A410-V414 WeakPolarHBondContact O-CG2 3.48Å; A410-V414 PolarHBondContact O-N 2.94Å; A411-V414 PolarHBondContact O-N 3.14Å; V414-R416 VanDerWaalsContact C-N 3.27Å; V414-R416 PolarHBondContact O-N 3.45Å; V414-I417 PolarHBondContact O-N 2.93Å; V414-M418 PolarHBondContact O-N 3.43Å
415	E	79.1	Confident	80.4	Confident	36 Å²	36	44.7 Å²	44.7	17%	0.168	23%	0.232	C	C	.	.	H	α-helix	trans	-55.4	-46.2	170.9	-175.4	178.6	162	0	0	110.1	Q347 M350 A411 D412 A413 I417 M418 S419	Q347-E415 PolarHBondContact NE2-OE1 3.47Å; M350-E415 HydrophobicContact CB-CG 4.5Å; A411-E415 WeakPolarHBondContact O-CB 3.22Å; A411-E415 PolarHBondContact O-N 3.04Å; D412-E415 PolarHBondContact O-N 3.45Å; A413-E415 PolarHBondContact O-N 3.37Å; E415-I417 PolarHBondContact O-N 3.05Å; E415-M418 PolarHBondContact O-N 2.92Å; E415-S419 PolarHBondContact O-N 2.9Å; E415-S419 PolarHBondContact O-OG 3.45Å
416	R	84.1	Confident	80.3	Confident	110 Å²	110	45.2 Å²	45.2	42%	0.415	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-40	175.8	-71.5	179.3	-170.6	170.9	7.1	113.6	P233 D412 A413 V414 M418 S419 S420	P233-R416 HydrophobicContact CB-CB 4.44Å; P233-R416 HydrophobicContact CG-CB 3.92Å; D412-R416 WeakPolarHBondContact O-CG 3.41Å; D412-R416 PolarHBondContact O-N 2.91Å; A413-R416 WeakPolarHBondContact O-CB 3.33Å; A413-R416 PolarHBondContact O-N 2.99Å; V414-R416 VanDerWaalsContact C-N 3.27Å; V414-R416 PolarHBondContact O-N 3.45Å; R416-M418 VanDerWaalsContact C-N 3.31Å; R416-M418 PolarHBondContact O-N 3.31Å; R416-S419 WeakPolarHBondContact CA-OG 3.49Å; R416-S419 PolarHBondContact O-N 3.45Å; R416-S419 PolarHBondContact O-OG 2.83Å; R416-S420 WeakPolarHBondContact O-CB 3.43Å; R416-S420 PolarHBondContact O-N 3.37Å; R416-S420 PolarHBondContact O-OG 3.48Å
417	I	84	Confident	80.5	Confident	52 Å²	52	45 Å²	45	27%	0.267	23%	0.232	S	C	.	.	H	α-helix	trans	-61.8	-43.4	175.4	-65.7	170.1	0	0	0	110	L230 P233 I234 V237 A413 V414 E415 S420	L230-I417 HydrophobicContact CD1-CG2 4.4Å; P233-I417 HydrophobicContact CB-CD1 3.99Å; P233-I417 HydrophobicContact CB-CG1 3.61Å; I234-I417 HydrophobicContact CG1-CD1 3.94Å; I234-I417 HydrophobicContact CG1-CG1 4.46Å; V237-I417 HydrophobicContact CG2-CD1 4.23Å; A413-I417 WeakPolarHBondContact O-CG1 3.43Å; A413-I417 PolarHBondContact O-N 3.36Å; V414-I417 PolarHBondContact O-N 2.93Å; E415-I417 PolarHBondContact O-N 3.05Å; I417-S420 WeakPolarHBondContact O-CB 3.33Å; I417-S420 PolarHBondContact O-N 3.07Å
418	M	75.3	Confident	80.7	Confident	51 Å²	51	43.7 Å²	43.7	25%	0.251	23%	0.226	S	C	.	.	H	α-helix	trans	-66	-43.7	179.3	-166.3	69.5	74.6	0	0	111.3	L273 M350 V414 E415 R416 S420 Y421	L273-M418 HydrophobicContact CD1-CE 4.04Å; L273-M418 HydrophobicContact CD1-CG 4.3Å; L273-M418 HydrophobicContact CD1-SD 4.37Å; M350-M418 HydrophobicContact CE-CB 3.5Å; M350-M418 VanDerWaalsContact CE-CB 3.5Å; M350-M418 HydrophobicContact CE-CE 3.48Å; M350-M418 VanDerWaalsContact CE-CE 3.48Å; M350-M418 HydrophobicContact CE-CG 3.53Å; M350-M418 HydrophobicContact CE-SD 4.36Å; V414-M418 PolarHBondContact O-N 3.43Å; E415-M418 PolarHBondContact O-N 2.92Å; R416-M418 VanDerWaalsContact C-N 3.31Å; R416-M418 PolarHBondContact O-N 3.31Å; M418-S420 PolarHBondContact O-N 3.49Å; M418-Y421 WeakPolarHBondContact O-CB 3.29Å; M418-Y421 PolarHBondContact O-N 2.97Å
419	S	73.9	Confident	80.7	Confident	49 Å²	49	40.9 Å²	40.9	34%	0.343	21%	0.214	S	C	.	.	H	α-helix	trans	-65.7	-29.1	176.5	66.5	0	0	0	0	112.5	E415 R416 Y421 K422	E415-S419 PolarHBondContact O-N 2.9Å; E415-S419 PolarHBondContact O-OG 3.45Å; R416-S419 WeakPolarHBondContact CA-OG 3.49Å; R416-S419 PolarHBondContact O-N 3.45Å; R416-S419 PolarHBondContact O-OG 2.83Å; S419-Y421 PolarHBondContact O-N 2.9Å; S419-K422 WeakPolarHBondContact O-CB 3.26Å; S419-K422 PolarHBondContact O-N 3.46Å
420	S	83.1	Confident	81	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-21.4	176.5	-60.5	0	0	0	0	112.8	N229 R416 I417 M418 K422 E423 V424	N229-S420 PolarHBondContact ND2-OG 3.36Å; R416-S420 WeakPolarHBondContact O-CB 3.43Å; R416-S420 PolarHBondContact O-N 3.37Å; R416-S420 PolarHBondContact O-OG 3.48Å; I417-S420 WeakPolarHBondContact O-CB 3.33Å; I417-S420 PolarHBondContact O-N 3.07Å; M418-S420 PolarHBondContact O-N 3.49Å; S420-K422 PolarHBondContact O-N 3.41Å; S420-E423 WeakPolarHBondContact O-CB 3.09Å; S420-E423 PolarHBondContact O-N 3.27Å; S420-V424 WeakPolarHBondContact O-CG2 3.24Å; S420-V424 PolarHBondContact O-N 3.05Å
421	Y	76.3	Confident	81.5	Confident	135 Å²	135	39.8 Å²	39.8	53%	0.529	20%	0.197	S	C	.	.	H	α-helix	trans	-56.9	-35.9	175.4	178.3	-100.5	0	0	0	112.8	M418 S419 V424 T425	M418-Y421 WeakPolarHBondContact O-CB 3.29Å; M418-Y421 PolarHBondContact O-N 2.97Å; S419-Y421 PolarHBondContact O-N 2.9Å; Y421-V424 PolarHBondContact O-N 3.14Å; Y421-T425 PolarHBondContact O-N 2.97Å; Y421-T425 PolarHBondContact O-OG1 2.84Å
422	K	72.8	Confident	81.8	Confident	70 Å²	70	39.8 Å²	39.8	30%	0.304	20%	0.195	S	C	.	.	H	α-helix	trans	-64.3	-44.8	175	179.9	178	175.6	-72.3	0	111.3	S419 S420 V424 T425 E426	S419-K422 WeakPolarHBondContact O-CB 3.26Å; S419-K422 PolarHBondContact O-N 3.46Å; S420-K422 PolarHBondContact O-N 3.41Å; K422-V424 VanDerWaalsContact C-N 3.33Å; K422-V424 PolarHBondContact O-N 3.49Å; K422-T425 WeakPolarHBondContact O-CB 3.24Å; K422-T425 PolarHBondContact O-N 3.32Å; K422-T425 VanDerWaalsContact O-N 3.14Å; K422-E426 WeakPolarHBondContact CE-OE1 3.33Å; K422-E426 IonicContact NZ-OE1 2.8Å; K422-E426 PolarHBondContact NZ-OE1 3.44Å; K422-E426 WeakPolarHBondContact O-CG 3.13Å; K422-E426 PolarHBondContact O-N 3.44Å
423	E	82.1	Confident	82	Confident	45 Å²	45	39.5 Å²	39.5	21%	0.21	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-40.1	176.7	-61.4	174.6	-164.3	0	0	111.1	H225 L226 N229 S420 T425 E426 L427	H225-E423 IonicContact CE1-OE1 2.75Å; H225-E423 PolarHBondContact CE1-OE1 2.94Å; H225-E423 IonicContact CE1-OE2 2.91Å; H225-E423 PolarHBondContact CE1-OE2 3.4Å; H225-E423 VanDerWaalsContact CE1-OE2 3.26Å; H225-E423 IonicContact ND1-OE1 2.7Å; H225-E423 IonicContact ND1-OE2 3.09Å; H225-E423 PolarHBondContact ND1-OE2 3.32Å; L226-E423 HydrophobicContact CD1-CB 4.28Å; N229-E423 VanDerWaalsContact ND2-CD 3.27Å; N229-E423 PolarHBondContact ND2-OE1 3.13Å; N229-E423 PolarHBondContact ND2-OE2 3.08Å; S420-E423 WeakPolarHBondContact O-CB 3.09Å; S420-E423 PolarHBondContact O-N 3.27Å; E423-T425 VanDerWaalsContact C-N 3.32Å; E423-T425 PolarHBondContact O-N 3.15Å; E423-E426 PolarHBondContact O-N 2.81Å; E423-L427 VanDerWaalsContact O-CB 3.29Å; E423-L427 WeakPolarHBondContact O-CB 3.47Å; E423-L427 PolarHBondContact O-N 2.9Å
424	V	84.7	Confident	82.4	Confident	28 Å²	28	39.4 Å²	39.4	17%	0.17	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-39.5	173.9	178.4	0	0	0	0	111.4	V82 F86 L226 S420 Y421 K422 L427 A428	V82-V424 HydrophobicContact CG1-CG1 4.26Å; V82-V424 HydrophobicContact CG2-CG1 3.85Å; F86-V424 HydrophobicContact CE1-CG1 4.41Å; F86-V424 HydrophobicContact CZ-CG1 4.49Å; L226-V424 HydrophobicContact CD1-CG2 3.68Å; L226-V424 HydrophobicContact CD2-CG2 3.87Å; L226-V424 HydrophobicContact CG-CG2 4.43Å; S420-V424 WeakPolarHBondContact O-CG2 3.24Å; S420-V424 PolarHBondContact O-N 3.05Å; Y421-V424 PolarHBondContact O-N 3.14Å; K422-V424 VanDerWaalsContact C-N 3.33Å; K422-V424 PolarHBondContact O-N 3.49Å; V424-L427 PolarHBondContact O-N 3.37Å; V424-A428 PolarHBondContact O-N 3.44Å
425	T	78.7	Confident	82.9	Confident	17 Å²	17	41.4 Å²	41.4	10%	0.104	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-40.7	178.6	-52.3	0	0	0	0	111.4	Y421 K422 E423 A428 G429	Y421-T425 PolarHBondContact O-N 2.97Å; Y421-T425 PolarHBondContact O-OG1 2.84Å; K422-T425 WeakPolarHBondContact O-CB 3.24Å; K422-T425 PolarHBondContact O-N 3.32Å; K422-T425 VanDerWaalsContact O-N 3.14Å; E423-T425 VanDerWaalsContact C-N 3.32Å; E423-T425 PolarHBondContact O-N 3.15Å; T425-A428 WeakPolarHBondContact O-CB 3.32Å; T425-A428 PolarHBondContact O-N 2.89Å; T425-G429 PolarHBondContact O-N 2.83Å
426	E	79.9	Confident	83.4	Confident	47 Å²	47	43.2 Å²	43.2	22%	0.22	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-44.5	173.4	-72.5	172	-169.4	0	0	111.1	V284 K422 E423 A428 G429 Y430	V284-E426 HydrophobicContact CG1-CG 4.42Å; K422-E426 WeakPolarHBondContact CE-OE1 3.33Å; K422-E426 IonicContact NZ-OE1 2.8Å; K422-E426 PolarHBondContact NZ-OE1 3.44Å; K422-E426 WeakPolarHBondContact O-CG 3.13Å; K422-E426 PolarHBondContact O-N 3.44Å; E423-E426 PolarHBondContact O-N 2.81Å; E426-A428 VanDerWaalsContact C-N 3.27Å; E426-A428 PolarHBondContact O-N 3.46Å; E426-G429 WeakPolarHBondContact O-CA 3.45Å; E426-G429 PolarHBondContact O-N 3.26Å; E426-Y430 HydrophobicContact CB-CE2 4.18Å; E426-Y430 VanDerWaalsContact O-CD2 3.26Å; E426-Y430 WeakPolarHBondContact O-CD2 2.98Å; E426-Y430 PolarHBondContact O-N 2.95Å; E426-Y430 VanDerWaalsContact O-N 3.08Å
427	L	87.1	Confident	83.8	Confident	3 Å²	3	38 Å²	38	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-57.6	-38.9	174.2	177.9	62.7	0	0	0	111.8	F86 F219 V223 L226 E423 V424 G429 Y430 T431	F86-L427 HydrophobicContact CE2-CG 4.35Å; F86-L427 HydrophobicContact CZ-CD2 4.39Å; F86-L427 HydrophobicContact CZ-CG 4.47Å; F219-L427 HydrophobicContact CD2-CD1 3.69Å; F219-L427 HydrophobicContact CE2-CD1 3.82Å; V223-L427 HydrophobicContact CG2-CD1 3.58Å; V223-L427 HydrophobicContact CG2-CD2 4.34Å; L226-L427 HydrophobicContact CD2-CD2 3.5Å; L226-L427 VanDerWaalsContact CD2-CD2 3.5Å; E423-L427 VanDerWaalsContact O-CB 3.29Å; E423-L427 WeakPolarHBondContact O-CB 3.47Å; E423-L427 PolarHBondContact O-N 2.9Å; V424-L427 PolarHBondContact O-N 3.37Å; L427-G429 VanDerWaalsContact C-N 3.27Å; L427-G429 PolarHBondContact O-N 2.94Å; L427-Y430 PolarHBondContact O-N 3.36Å; L427-T431 WeakPolarHBondContact O-CB 3.38Å; L427-T431 PolarHBondContact O-N 3.15Å; L427-T431 PolarHBondContact O-OG1 3.19Å
428	A	83.9	Confident	84.3	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-36.9	175.7	0	0	0	0	0	112.4	V82 F86 V424 T425 E426 S432	V82-A428 HydrophobicContact CG2-CB 4.38Å; F86-A428 VanDerWaalsContact CD2-CA 3.49Å; F86-A428 HydrophobicContact CD2-CB 3.55Å; F86-A428 VanDerWaalsContact CE2-CA 3.48Å; F86-A428 HydrophobicContact CE2-CB 3.79Å; F86-A428 HydrophobicContact CG-CB 4.03Å; F86-A428 HydrophobicContact CZ-CB 4.46Å; V424-A428 PolarHBondContact O-N 3.44Å; T425-A428 WeakPolarHBondContact O-CB 3.32Å; T425-A428 PolarHBondContact O-N 2.89Å; E426-A428 VanDerWaalsContact C-N 3.27Å; E426-A428 PolarHBondContact O-N 3.46Å; A428-S432 WeakPolarHBondContact O-CB 3.17Å; A428-S432 PolarHBondContact O-N 3.11Å
429	G	81.9	Confident	85.1	Confident	10 Å²	10	34.9 Å²	34.9	10%	0.103	17%	0.166	C	C	.	.	H	α-helix	trans	-61.5	-53.2	171.7	0	0	0	0	0	112.4	T425 E426 L427 S432 R433	T425-G429 PolarHBondContact O-N 2.83Å; E426-G429 WeakPolarHBondContact O-CA 3.45Å; E426-G429 PolarHBondContact O-N 3.26Å; L427-G429 VanDerWaalsContact C-N 3.27Å; L427-G429 PolarHBondContact O-N 2.94Å; G429-S432 PolarHBondContact O-N 3.05Å; G429-R433 PolarHBondContact O-N 2.87Å
430	Y	86.3	Confident	85.9	Confident	39 Å²	39	32.7 Å²	32.7	15%	0.153	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-44.2	178.7	-58.9	-53.1	0	0	0	112.1	M218 E426 L427 S432 R433 V434	M218-Y430 HydrophobicContact CB-CD1 3.67Å; M218-Y430 HydrophobicContact CB-CD2 4.16Å; M218-Y430 HydrophobicContact CB-CE1 3.46Å; M218-Y430 VanDerWaalsContact CB-CE1 3.46Å; M218-Y430 HydrophobicContact CB-CE2 3.96Å; M218-Y430 HydrophobicContact CB-CG 4.07Å; M218-Y430 HydrophobicContact CG-CE1 3.92Å; E426-Y430 HydrophobicContact CB-CE2 4.18Å; E426-Y430 VanDerWaalsContact O-CD2 3.26Å; E426-Y430 WeakPolarHBondContact O-CD2 2.98Å; E426-Y430 PolarHBondContact O-N 2.95Å; E426-Y430 VanDerWaalsContact O-N 3.08Å; L427-Y430 PolarHBondContact O-N 3.36Å; Y430-S432 VanDerWaalsContact C-N 3.28Å; Y430-S432 PolarHBondContact O-N 3.16Å; Y430-R433 PolarHBondContact O-N 2.99Å; Y430-V434 WeakPolarHBondContact O-CB 3.45Å; Y430-V434 WeakPolarHBondContact O-CG2 3.43Å; Y430-V434 PolarHBondContact O-N 3.43Å
431	T	90.8	Very high	86.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-43.4	176.7	-58.8	0	0	0	0	110.9	F86 R89 L90 L93 F219 L427 W435	F86-T431 HydrophobicContact CD2-CG2 4.07Å; F86-T431 HydrophobicContact CE2-CG2 4.2Å; R89-T431 HydrophobicContact CB-CG2 3.85Å; L90-T431 HydrophobicContact CB-CG2 4.05Å; L93-T431 HydrophobicContact CD1-CG2 4.01Å; F219-T431 WeakPolarHBondContact CE2-OG1 3.49Å; L427-T431 WeakPolarHBondContact O-CB 3.38Å; L427-T431 PolarHBondContact O-N 3.15Å; L427-T431 PolarHBondContact O-OG1 3.19Å; T431-W435 WeakPolarHBondContact O-CB 3.26Å; T431-W435 PolarHBondContact O-N 3.37Å
432	S	86.4	Confident	87.1	Confident	21 Å²	21	28.8 Å²	28.8	15%	0.147	14%	0.137	C	C	.	.	H	α-helix	trans	-62.1	-47.5	178.1	-169	0	0	0	0	111.7	R89 A428 G429 Y430 E436	R89-S432 PolarHBondContact NH1-OG 2.96Å; A428-S432 WeakPolarHBondContact O-CB 3.17Å; A428-S432 PolarHBondContact O-N 3.11Å; G429-S432 PolarHBondContact O-N 3.05Å; Y430-S432 VanDerWaalsContact C-N 3.28Å; Y430-S432 PolarHBondContact O-N 3.16Å; S432-E436 VanDerWaalsContact O-CB 3.22Å; S432-E436 WeakPolarHBondContact O-CB 3.3Å; S432-E436 PolarHBondContact O-N 3.13Å
433	R	86.6	Confident	87.9	Confident	78 Å²	78	26.6 Å²	26.6	29%	0.294	13%	0.129	S	C	.	.	H	α-helix	trans	-68.4	-45.7	-177.5	-66.4	-164.1	-63.4	-93.1	4.9	112.4	D215 G429 Y430 W435 E436 M437	D215-R433 IonicContact OD1-CZ 3.47Å; D215-R433 VanDerWaalsContact OD1-CZ 3.25Å; D215-R433 IonicContact OD1-NE 2.82Å; D215-R433 PolarHBondContact OD1-NE 3.16Å; D215-R433 IonicContact OD1-NH2 2.76Å; D215-R433 PolarHBondContact OD1-NH2 3.4Å; D215-R433 WeakPolarHBondContact OD2-CB 3.38Å; D215-R433 WeakPolarHBondContact OD2-CD 3.25Å; D215-R433 IonicContact OD2-CZ 3.57Å; D215-R433 IonicContact OD2-NE 3.37Å; D215-R433 PolarHBondContact OD2-NE 3.38Å; G429-R433 PolarHBondContact O-N 2.87Å; Y430-R433 PolarHBondContact O-N 2.99Å; R433-W435 PolarHBondContact O-N 2.62Å; R433-E436 PolarHBondContact O-N 3.21Å; R433-M437 WeakPolarHBondContact O-CB 3.48Å; R433-M437 PolarHBondContact O-N 3.47Å
434	V	91.9	Very high	88.3	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-42.1	177.8	175	0	0	0	0	111.2	L93 D215 I216 F219 Y430 M437 F438	L93-V434 HydrophobicContact CD1-CB 4.18Å; L93-V434 HydrophobicContact CD1-CG1 3.97Å; L93-V434 HydrophobicContact CD2-CG1 4.08Å; D215-V434 HydrophobicContact CB-CG2 4Å; I216-V434 HydrophobicContact CG1-CG2 4.45Å; F219-V434 HydrophobicContact CB-CG2 3.96Å; F219-V434 HydrophobicContact CG-CG2 4.35Å; Y430-V434 WeakPolarHBondContact O-CB 3.45Å; Y430-V434 WeakPolarHBondContact O-CG2 3.43Å; Y430-V434 PolarHBondContact O-N 3.43Å; V434-M437 WeakPolarHBondContact O-CB 3.43Å; V434-M437 PolarHBondContact O-N 2.91Å; V434-F438 HydrophobicContact CG1-CD2 3.83Å; V434-F438 HydrophobicContact CG1-CE2 3.53Å; V434-F438 WeakPolarHBondContact O-CD2 3.4Å; V434-F438 PolarHBondContact O-N 3.14Å; V434-F438 VanDerWaalsContact O-N 3.11Å
435	W	92.8	Very high	88.5	Confident	73 Å²	73	24.1 Å²	24.1	28%	0.277	12%	0.117	S	C	.	.	H	α-helix	trans	-65.3	-45.2	176.4	-179.3	88.2	0	0	0	112.1	R89 L93 T431 R433 M437 F438 V439	R89-W435 HydrophobicContact CB-CB 4.18Å; R89-W435 HydrophobicContact CB-CD2 4.38Å; R89-W435 HydrophobicContact CB-CG 3.89Å; R89-W435 HydrophobicContact CG-CB 4.3Å; R89-W435 HydrophobicContact CG-CD2 3.65Å; R89-W435 HydrophobicContact CG-CE3 4.15Å; R89-W435 HydrophobicContact CG-CG 3.7Å; L93-W435 HydrophobicContact CD1-CB 4.4Å; T431-W435 WeakPolarHBondContact O-CB 3.26Å; T431-W435 PolarHBondContact O-N 3.37Å; R433-W435 PolarHBondContact O-N 2.62Å; W435-M437 VanDerWaalsContact C-N 3.29Å; W435-M437 PolarHBondContact O-N 3.09Å; W435-F438 PolarHBondContact O-N 3.1Å; W435-V439 HydrophobicContact CD2-CG2 3.86Å; W435-V439 HydrophobicContact CE3-CG2 4.09Å; W435-V439 HydrophobicContact CH2-CG2 3.81Å; W435-V439 HydrophobicContact CZ2-CG2 3.56Å; W435-V439 HydrophobicContact CZ3-CG2 4.06Å; W435-V439 WeakPolarHBondContact O-CG2 3.46Å; W435-V439 PolarHBondContact O-N 3.45Å
436	E	89.7	Confident	88.8	Confident	74 Å²	74	31.9 Å²	31.9	35%	0.346	15%	0.145	S	C	.	.	H	α-helix	trans	-60.3	-41.1	177	-177.3	168	-159.9	0	0	111.2	L205 S432 R433 V439 V440	L205-E436 HydrophobicContact CD2-CG 4.31Å; S432-E436 VanDerWaalsContact O-CB 3.22Å; S432-E436 WeakPolarHBondContact O-CB 3.3Å; S432-E436 PolarHBondContact O-N 3.13Å; R433-E436 PolarHBondContact O-N 3.21Å; E436-V439 PolarHBondContact O-N 3.43Å; E436-V440 HydrophobicContact CG-CG2 4.33Å; E436-V440 WeakPolarHBondContact O-CB 3.37Å; E436-V440 WeakPolarHBondContact O-CG2 3.31Å; E436-V440 PolarHBondContact O-N 2.81Å
437	M	92.3	Very high	88.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.6	-53.3	173.9	-177.9	-161.6	71.5	0	0	111.8	A185 L205 S211 L212 I216 R433 V434 W435 V439 V440 F441	A185-M437 HydrophobicContact CB-CE 4.16Å; L205-M437 HydrophobicContact CD1-CG 4.38Å; S211-M437 VanDerWaalsContact CB-SD 3.58Å; L212-M437 HydrophobicContact CD2-SD 4.05Å; L212-M437 HydrophobicContact CG-SD 4.11Å; I216-M437 HydrophobicContact CD1-CE 3.97Å; I216-M437 HydrophobicContact CG1-CE 4.27Å; R433-M437 WeakPolarHBondContact O-CB 3.48Å; R433-M437 PolarHBondContact O-N 3.47Å; V434-M437 WeakPolarHBondContact O-CB 3.43Å; V434-M437 PolarHBondContact O-N 2.91Å; W435-M437 VanDerWaalsContact C-N 3.29Å; W435-M437 PolarHBondContact O-N 3.09Å; M437-V439 PolarHBondContact O-N 3.49Å; M437-V440 PolarHBondContact O-N 3.5Å; M437-F441 HydrophobicContact CE-CE2 4.42Å; M437-F441 HydrophobicContact CG-CD1 4.14Å; M437-F441 HydrophobicContact CG-CD2 4.39Å; M437-F441 HydrophobicContact CG-CE1 3.59Å; M437-F441 HydrophobicContact CG-CE2 3.87Å; M437-F441 HydrophobicContact CG-CZ 3.45Å; M437-F441 VanDerWaalsContact CG-CZ 3.45Å; M437-F441 WeakPolarHBondContact O-CB 3.42Å; M437-F441 WeakPolarHBondContact O-CD1 3.49Å; M437-F441 VanDerWaalsContact O-CG 3.26Å; M437-F441 WeakPolarHBondContact O-CG 3.25Å; M437-F441 PolarHBondContact O-N 3.18Å; M437-F441 HydrophobicContact SD-CE2 4.11Å; M437-F441 HydrophobicContact SD-CZ 3.95Å
438	F	93.8	Very high	88.7	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-61	-43	179.3	-77.7	-61.5	0	0	0	112.6	L93 L96 L181 H184 A185 L188 V434 W435 V440 F441 E442	L93-F438 HydrophobicContact CD2-CD2 3.77Å; L93-F438 HydrophobicContact CD2-CE2 4.04Å; L96-F438 HydrophobicContact CD1-CD2 4.47Å; L96-F438 HydrophobicContact CD1-CE2 4.38Å; L181-F438 HydrophobicContact CD2-CE2 4.29Å; L181-F438 HydrophobicContact CD2-CZ 4.35Å; H184-F438 AromaticContact CD2-CE1 3.54Å; A185-F438 HydrophobicContact CB-CE1 3.75Å; A185-F438 HydrophobicContact CB-CZ 4.01Å; L188-F438 HydrophobicContact CD2-CD1 4.16Å; V434-F438 HydrophobicContact CG1-CD2 3.83Å; V434-F438 HydrophobicContact CG1-CE2 3.53Å; V434-F438 WeakPolarHBondContact O-CD2 3.4Å; V434-F438 PolarHBondContact O-N 3.14Å; V434-F438 VanDerWaalsContact O-N 3.11Å; W435-F438 PolarHBondContact O-N 3.1Å; F438-V440 PolarHBondContact O-N 3.14Å; F438-F441 PolarHBondContact O-N 3.31Å; F438-E442 WeakPolarHBondContact O-CG 3.37Å; F438-E442 PolarHBondContact O-N 3.22Å
439	V	92.3	Very high	88.7	Confident	36 Å²	36	34.2 Å²	34.2	22%	0.218	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-43.1	177.9	170.2	0	0	0	0	111.5	W435 E436 M437 F441 E442 D443	W435-V439 HydrophobicContact CD2-CG2 3.86Å; W435-V439 HydrophobicContact CE3-CG2 4.09Å; W435-V439 HydrophobicContact CH2-CG2 3.81Å; W435-V439 HydrophobicContact CZ2-CG2 3.56Å; W435-V439 HydrophobicContact CZ3-CG2 4.06Å; W435-V439 WeakPolarHBondContact O-CG2 3.46Å; W435-V439 PolarHBondContact O-N 3.45Å; E436-V439 PolarHBondContact O-N 3.43Å; M437-V439 PolarHBondContact O-N 3.49Å; V439-F441 VanDerWaalsContact C-N 3.33Å; V439-E442 PolarHBondContact O-N 2.96Å; V439-D443 VanDerWaalsContact O-CB 3.32Å; V439-D443 WeakPolarHBondContact O-CB 3.49Å; V439-D443 VanDerWaalsContact O-CG 3.27Å; V439-D443 PolarHBondContact O-N 3.3Å
440	V	90.9	Very high	88.4	Confident	2 Å²	2	40 Å²	40	1%	0.012	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-42	177.3	172.1	0	0	0	0	110.3	R204 L205 E436 M437 F438 D443 V444	R204-V440 HydrophobicContact CB-CG2 4.1Å; L205-V440 HydrophobicContact CD1-CB 3.74Å; L205-V440 HydrophobicContact CD1-CG1 3.6Å; L205-V440 HydrophobicContact CD1-CG2 4.24Å; L205-V440 HydrophobicContact CD2-CG2 4.42Å; L205-V440 HydrophobicContact CG-CB 4.06Å; L205-V440 HydrophobicContact CG-CG1 3.91Å; L205-V440 HydrophobicContact CG-CG2 4.01Å; E436-V440 HydrophobicContact CG-CG2 4.33Å; E436-V440 WeakPolarHBondContact O-CB 3.37Å; E436-V440 WeakPolarHBondContact O-CG2 3.31Å; E436-V440 PolarHBondContact O-N 2.81Å; M437-V440 PolarHBondContact O-N 3.5Å; F438-V440 PolarHBondContact O-N 3.14Å; V440-D443 PolarHBondContact O-N 2.98Å; V440-V444 HydrophobicContact CG1-CG2 4.16Å; V440-V444 VanDerWaalsContact O-CB 3.27Å; V440-V444 WeakPolarHBondContact O-CB 3.29Å; V440-V444 WeakPolarHBondContact O-CG2 3.3Å; V440-V444 PolarHBondContact O-N 3.44Å
441	F	92.7	Very high	87.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-43.5	177.7	-70.6	12.8	0	0	0	111.2	L188 Y189 T194 I198 L205 L212 M437 F438 V439 S445	L188-F441 HydrophobicContact CD2-CB 3.35Å; L188-F441 HydrophobicContact CD2-CD2 4.25Å; L188-F441 HydrophobicContact CD2-CG 4.33Å; L188-F441 HydrophobicContact CG-CB 3.73Å; L188-F441 HydrophobicContact CG-CD2 4.47Å; Y189-F441 HydrophobicContact CD2-CD2 4.36Å; Y189-F441 HydrophobicContact CD2-CE1 4.16Å; Y189-F441 AromaticContact CD2-CE2 3.7Å; Y189-F441 HydrophobicContact CD2-CE2 3.7Å; Y189-F441 AromaticContact CD2-CZ 3.56Å; Y189-F441 HydrophobicContact CD2-CZ 3.56Å; Y189-F441 HydrophobicContact CE2-CZ 4.13Å; Y189-F441 HydrophobicContact CG-CE2 4.21Å; Y189-F441 HydrophobicContact CG-CZ 4.45Å; T194-F441 HydrophobicContact CG2-CB 4.33Å; I198-F441 HydrophobicContact CD1-CD1 3.17Å; I198-F441 HydrophobicContact CD1-CE1 3.29Å; I198-F441 HydrophobicContact CD1-CG 3.91Å; I198-F441 HydrophobicContact CD1-CZ 4.1Å; I198-F441 HydrophobicContact CG1-CD1 4.1Å; I198-F441 HydrophobicContact CG1-CE1 4.34Å; L205-F441 HydrophobicContact CD1-CD1 4.06Å; L205-F441 HydrophobicContact CD1-CE1 3.7Å; L212-F441 HydrophobicContact CD1-CZ 4.26Å; L212-F441 HydrophobicContact CD2-CE2 4.02Å; L212-F441 HydrophobicContact CD2-CZ 4.35Å; L212-F441 HydrophobicContact CG-CE2 4.4Å; L212-F441 HydrophobicContact CG-CZ 4.23Å; M437-F441 HydrophobicContact CE-CE2 4.42Å; M437-F441 HydrophobicContact CG-CD1 4.14Å; M437-F441 HydrophobicContact CG-CD2 4.39Å; M437-F441 HydrophobicContact CG-CE1 3.59Å; M437-F441 HydrophobicContact CG-CE2 3.87Å; M437-F441 HydrophobicContact CG-CZ 3.45Å; M437-F441 VanDerWaalsContact CG-CZ 3.45Å; M437-F441 WeakPolarHBondContact O-CB 3.42Å; M437-F441 WeakPolarHBondContact O-CD1 3.49Å; M437-F441 VanDerWaalsContact O-CG 3.26Å; M437-F441 WeakPolarHBondContact O-CG 3.25Å; M437-F441 PolarHBondContact O-N 3.18Å; M437-F441 HydrophobicContact SD-CE2 4.11Å; M437-F441 HydrophobicContact SD-CZ 3.95Å; F438-F441 PolarHBondContact O-N 3.31Å; V439-F441 VanDerWaalsContact C-N 3.33Å; F441-S445 VanDerWaalsContact O-CB 3.28Å; F441-S445 WeakPolarHBondContact O-CB 3.34Å; F441-S445 PolarHBondContact O-N 3.4Å; F441-S445 PolarHBondContact O-OG 3.09Å
442	E	91.9	Very high	85.7	Confident	55 Å²	55	47.3 Å²	47.3	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-48.8	175.1	-76	-176.9	-160.8	0	0	111.8	L188 F438 V439 V444 S445 R446	L188-E442 HydrophobicContact CD1-CG 4.24Å; L188-E442 HydrophobicContact CD2-CG 3.83Å; F438-E442 WeakPolarHBondContact O-CG 3.37Å; F438-E442 PolarHBondContact O-N 3.22Å; V439-E442 PolarHBondContact O-N 2.96Å; E442-V444 VanDerWaalsContact C-N 3.34Å; E442-V444 PolarHBondContact O-N 3.22Å; E442-S445 PolarHBondContact O-N 3.33Å; E442-S445 PolarHBondContact O-OG 3.39Å; E442-R446 WeakPolarHBondContact O-CG 3.28Å; E442-R446 PolarHBondContact O-N 3Å; E442-R446 VanDerWaalsContact O-N 3.12Å
443	D	89.9	Confident	83.8	Confident	24 Å²	24	49.7 Å²	49.7	13%	0.128	24%	0.241	C	C	.	.	H	α-helix	trans	-56.9	-47.9	177.9	-79.2	-13.8	0	0	0	111	R204 V439 V440 R446 G447 I448	R204-D443 IonicContact CZ-OD2 2.74Å; R204-D443 IonicContact NH1-OD2 2.9Å; R204-D443 PolarHBondContact NH1-OD2 3.07Å; R204-D443 IonicContact NH2-OD2 3.97Å; R204-D443 PolarHBondContact NH2-OD2 3.5Å; V439-D443 VanDerWaalsContact O-CB 3.32Å; V439-D443 WeakPolarHBondContact O-CB 3.49Å; V439-D443 VanDerWaalsContact O-CG 3.27Å; V439-D443 PolarHBondContact O-N 3.3Å; V440-D443 PolarHBondContact O-N 2.98Å; D443-R446 CarbonylContact O-C 3.55Å; D443-R446 PolarHBondContact O-N 3.32Å; D443-G447 PolarHBondContact O-N 3.35Å; D443-I448 CarbonylContact C-O 3.3Å; D443-I448 HydrophobicContact CB-CB 4.25Å; D443-I448 WeakPolarHBondContact O-CB 3.19Å; D443-I448 PolarHBondContact O-N 3.22Å
444	V	89.1	Confident	81.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-39.5	-179.4	169	0	0	0	0	111.5	T194 R197 I198 D202 V440 E442 R446 G447 Y449	T194-V444 HydrophobicContact CG2-CB 4.33Å; T194-V444 HydrophobicContact CG2-CG1 4Å; R197-V444 HydrophobicContact CB-CG1 3.34Å; R197-V444 HydrophobicContact CG-CG1 4.4Å; I198-V444 HydrophobicContact CG1-CB 4.23Å; I198-V444 HydrophobicContact CG1-CG1 4.04Å; I198-V444 HydrophobicContact CG1-CG2 4.12Å; D202-V444 HydrophobicContact CB-CG2 3.9Å; V440-V444 HydrophobicContact CG1-CG2 4.16Å; V440-V444 VanDerWaalsContact O-CB 3.27Å; V440-V444 WeakPolarHBondContact O-CB 3.29Å; V440-V444 WeakPolarHBondContact O-CG2 3.3Å; V440-V444 PolarHBondContact O-N 3.44Å; E442-V444 VanDerWaalsContact C-N 3.34Å; E442-V444 PolarHBondContact O-N 3.22Å; V444-R446 PolarHBondContact O-N 3.28Å; V444-G447 PolarHBondContact O-N 2.85Å; V444-Y449 HydrophobicContact CG1-CE1 4.08Å; V444-Y449 HydrophobicContact CG2-CD1 4.39Å
445	S	88.5	Confident	79.3	Confident	20 Å²	20	54 Å²	54	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-28.5	176	76.9	0	0	0	0	112.5	N192 F441 E442	N192-S445 PolarHBondContact ND2-O 2.95Å; F441-S445 VanDerWaalsContact O-CB 3.28Å; F441-S445 WeakPolarHBondContact O-CB 3.34Å; F441-S445 PolarHBondContact O-N 3.4Å; F441-S445 PolarHBondContact O-OG 3.09Å; E442-S445 PolarHBondContact O-N 3.33Å; E442-S445 PolarHBondContact O-OG 3.39Å
446	R	86.7	Confident	76.7	Confident	180 Å²	180	60 Å²	60	68%	0.679	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.9	174.6	-65.9	176.7	-174.1	178.7	7.6	113.7	E442 D443 V444	E442-R446 WeakPolarHBondContact O-CG 3.28Å; E442-R446 PolarHBondContact O-N 3Å; E442-R446 VanDerWaalsContact O-N 3.12Å; D443-R446 CarbonylContact O-C 3.55Å; D443-R446 PolarHBondContact O-N 3.32Å; V444-R446 PolarHBondContact O-N 3.28Å
447	G	82.2	Confident	74.2	Confident	12 Å²	12	63.9 Å²	63.9	12%	0.124	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	19.4	-179.6	0	0	0	0	0	114.9	D443 V444 Y449 I478	D443-G447 PolarHBondContact O-N 3.35Å; V444-G447 PolarHBondContact O-N 2.85Å; G447-Y449 WeakPolarHBondContact O-CD2 3.43Å; G447-Y449 VanDerWaalsContact O-CE2 3.32Å; G447-Y449 WeakPolarHBondContact O-CE2 3.44Å; G447-I478 WeakPolarHBondContact O-CD1 3.44Å
448	I	82.8	Confident	71.4	Confident	76 Å²	76	69 Å²	69	39%	0.39	36%	0.358	S	S	.	.			trans	-96.8	106.8	176.4	-55.2	172.8	0	0	0	108.9	D443	D443-I448 CarbonylContact C-O 3.3Å; D443-I448 HydrophobicContact CB-CB 4.25Å; D443-I448 WeakPolarHBondContact O-CB 3.19Å; D443-I448 PolarHBondContact O-N 3.22Å
449	Y	82.7	Confident	68.7	Low	15 Å²	15	74.1 Å²	74.1	6%	0.059	40%	0.401	C	S	.	.			trans	-105.1	137.5	-179	-47.9	-70.9	0	0	0	111.3	R197 M201 V444 G447 I478 P540	R197-Y449 HydrophobicContact CB-CE1 4.08Å; R197-Y449 WeakPolarHBondContact CD-OH 3.11Å; R197-Y449 HydrophobicContact CG-CE1 4.38Å; M201-Y449 HydrophobicContact CB-CD1 3.85Å; M201-Y449 HydrophobicContact CB-CE1 4.16Å; M201-Y449 HydrophobicContact CB-CG 4.34Å; M201-Y449 HydrophobicContact CE-CD1 4.08Å; M201-Y449 HydrophobicContact CE-CD2 3.67Å; M201-Y449 HydrophobicContact CE-CE1 3.82Å; M201-Y449 HydrophobicContact CE-CE2 3.38Å; M201-Y449 HydrophobicContact CE-CG 4.01Å; M201-Y449 VanDerWaalsContact CE-CZ 3.46Å; M201-Y449 HydrophobicContact SD-CD1 4.42Å; M201-Y449 HydrophobicContact SD-CE1 3.86Å; M201-Y449 HydrophobicContact SD-CE2 4.37Å; V444-Y449 HydrophobicContact CG1-CE1 4.08Å; V444-Y449 HydrophobicContact CG2-CD1 4.39Å; G447-Y449 WeakPolarHBondContact O-CD2 3.43Å; G447-Y449 VanDerWaalsContact O-CE2 3.32Å; G447-Y449 WeakPolarHBondContact O-CE2 3.44Å; Y449-I478 HydrophobicContact CE2-CD1 4.01Å; Y449-P540 HydrophobicContact CE2-CG 4.01Å
450	R	75.6	Confident	65.8	Low	133 Å²	133	78.3 Å²	78.3	50%	0.502	43%	0.427	S	S	.	.			trans	-133.9	138.4	174.1	-61.4	-179.5	-178.6	157.4	3.7	110.4	D202 G203 R204	D202-R450 VanDerWaalsContact CG-O 3.22Å; D202-R450 PolarHBondContact OD2-N 2.82Å; G203-R450 PolarHBondContact N-O 3.41Å; G203-R450 VanDerWaalsContact N-O 3.11Å; R204-R450 HydrophobicContact CG-CB 4.28Å
451	R	67.4	Low	63.2	Low	95 Å²	95	88.9 Å²	88.9	36%	0.358	47%	0.466	S	S	.	.			trans	-115.1	144.1	173.5	-77.2	-169.9	168.8	-158.1	-0.6	111.4	N200 M201 A453 P499	N200-R451 PolarHBondContact O-NH2 3.47Å; M201-R451 PolarHBondContact O-NE 3.47Å; R451-A453 PolarHBondContact O-N 2.99Å; R451-A453 VanDerWaalsContact O-N 3.13Å; R451-P499 PolarHBondContact NE-O 3.08Å
452	S	54.2	Low	60.6	Low	97 Å²	97	101 Å²	101	68%	0.678	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	4.3	-174.7	-59.5	0	0	0	0	114.7	G203	G203-S452 PolarHBondContact O-OG 2.92Å
453	A	46.1	Very low	58.2	Low	71 Å²	71	101.9 Å²	101.9	59%	0.587	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-3	-169.5	0	0	0	0	0	115.5	R451 P455	R451-A453 PolarHBondContact O-N 2.99Å; R451-A453 VanDerWaalsContact O-N 3.13Å; A453-P455 WeakPolarHBondContact O-CD 3.38Å
454	D	43	Very low	55.9	Low	62 Å²	62	104.1 Å²	104.1	33%	0.332	56%	0.558	S	S	.	*			trans	-97.5	115.3	-179.8	-70.1	-7.2	0	0	0	110.1	E456 G474	D454-E456 PolarHBondContact O-N 3.16Å; D454-G474 PolarHBondContact OD2-N 3.21Å
455	P	41.6	Very low	54	Low	107 Å²	107	107.6 Å²	107.6	70%	0.695	59%	0.587	S	S	*	*			trans	-55.6	136.6	155.3	-10.3	24.4	0	0	0	107.5	A453 E457	A453-P455 WeakPolarHBondContact O-CD 3.38Å; P455-E457 PolarHBondContact O-N 3.34Å
456	E	38	Very low	52.5	Low	200 Å²	200	109.6 Å²	109.6	94%	0.935	60%	0.598	S	S	*	*			trans	-61.7	82	169.5	-70.5	-178.5	160.6	0	0	109.3	D454	D454-E456 PolarHBondContact O-N 3.16Å
457	E	35.7	Very low	51	Low	154 Å²	154	105.9 Å²	105.9	72%	0.72	59%	0.591	S	S	*	*			trans	-74	136.1	160.3	-76.7	-166.4	165.3	0	0	108.4	P455 A459	P455-E457 PolarHBondContact O-N 3.34Å; E457-A459 PolarHBondContact O-N 3.06Å
458	P	34.8	Very low	49.5	Very low	107 Å²	107	109.7 Å²	109.7	70%	0.695	61%	0.606	S	S	*	*			trans	-61.2	133.5	-177.9	25	-31.6	0	0	0	109.5	T460	P458-T460 VanDerWaalsContact C-N 3.3Å; P458-T460 PolarHBondContact O-N 3.43Å; P458-T460 PolarHBondContact O-OG1 2.99Å
459	A	35.6	Very low	48.4	Very low	110 Å²	110	109.5 Å²	109.5	91%	0.909	62%	0.622	S	S	*	*			trans	-57.1	86.6	178	0	0	0	0	0	111.7	E457	E457-A459 PolarHBondContact O-N 3.06Å
460	T	33.2	Very low	47.5	Very low	125 Å²	125	113.9 Å²	113.9	77%	0.767	64%	0.643	S	S	*	*			trans	-92	124.1	168.9	20.9	0	0	0	0	110.3	P458	P458-T460 VanDerWaalsContact C-N 3.3Å; P458-T460 PolarHBondContact O-N 3.43Å; P458-T460 PolarHBondContact O-OG1 2.99Å
461	R	36.6	Very low	47.1	Very low	223 Å²	223	114 Å²	114	84%	0.842	64%	0.644	S	S	*	*			trans	83.2	84	171	-57.1	-176.3	-178.5	178.5	1.2	116.7	G463	R461-G463 PolarHBondContact O-N 2.94Å
462	R	37.1	Very low	47.1	Very low	254 Å²	254	112.5 Å²	112.5	96%	0.958	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	112.6	147.8	-80.6	178.9	172	175.4	-3.2	108.3
463	G	40.9	Very low	47.1	Very low	75 Å²	75	112.2 Å²	112.2	77%	0.773	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	113.7	10.9	169.4	0	0	0	0	0	117.3	R461 A465	R461-G463 PolarHBondContact O-N 2.94Å; G463-A465 PolarHBondContact O-N 3.46Å
464	A	41.5	Very low	47.8	Very low	71 Å²	71	110 Å²	110	59%	0.587	63%	0.625	S	S	*	*			trans	-67.8	125.8	171.7	0	0	0	0	0	110.3
465	A	50.6	Low	48.7	Very low	72 Å²	72	111.8 Å²	111.8	60%	0.595	64%	0.64	S	S	*	*			trans	-54.4	140.4	170.4	0	0	0	0	0	109.7	G463 L467	G463-A465 PolarHBondContact O-N 3.46Å; A465-L467 VanDerWaalsContact C-N 3.3Å; A465-L467 PolarHBondContact O-N 3.31Å
466	V	56	Low	50.1	Low	63 Å²	63	108.1 Å²	108.1	38%	0.382	61%	0.614	S	S	.	*			trans	-67.1	92.3	175.8	179.9	0	0	0	0	107.5	P495 I497 V503	V466-P495 HydrophobicContact CG1-CB 4.38Å; V466-I497 HydrophobicContact CG1-CD1 4.39Å; V466-V503 HydrophobicContact CG1-CB 4.28Å; V466-V503 HydrophobicContact CG1-CG1 3.64Å; V466-V503 HydrophobicContact CG1-CG2 3.58Å
467	L	54.9	Low	51.8	Low	101 Å²	101	104.1 Å²	104.1	53%	0.529	60%	0.595	S	S	.	*			trans	-86.7	138.9	179.5	-74.1	161.4	0	0	0	109.5	A465 Q470	A465-L467 VanDerWaalsContact C-N 3.3Å; A465-L467 PolarHBondContact O-N 3.31Å; L467-Q470 HydrophobicContact CB-CG 4.35Å; L467-Q470 PolarHBondContact O-N 3.06Å
468	Q	51.4	Low	54.1	Low	93 Å²	93	100.3 Å²	100.3	44%	0.435	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.8	145.1	-178.2	-172.9	-168.2	-39	0	0	112.2	Q470 E691	Q468-Q470 PolarHBondContact O-N 2.92Å; Q468-Q470 VanDerWaalsContact O-N 3.07Å; Q468-E691 VanDerWaalsContact CD-O 3.28Å; Q468-E691 PolarHBondContact NE2-O 2.87Å; Q468-E691 PolarHBondContact OE1-O 3.19Å
469	G	58.6	Low	56.4	Low	71 Å²	71	103.4 Å²	103.4	73%	0.732	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	71	-2	177.4	0	0	0	0	0	114.5	V503	G469-V503 PolarHBondContact N-O 3.04Å
470	Q	65.6	Low	58.7	Low	107 Å²	107	99 Å²	99	50%	0.5	54%	0.542	S	S	.	.			trans	-83.7	138.4	169.2	-71.7	-171.5	-19.2	0	0	110.4	L467 Q468 V503	L467-Q470 HydrophobicContact CB-CG 4.35Å; L467-Q470 PolarHBondContact O-N 3.06Å; Q468-Q470 PolarHBondContact O-N 2.92Å; Q468-Q470 VanDerWaalsContact O-N 3.07Å; Q470-V503 PolarHBondContact O-N 3.46Å
471	R	66.1	Low	61.5	Low	136 Å²	136	99.1 Å²	99.1	51%	0.513	53%	0.534	S	S	.	.	B	Isolated β-bridge	trans	-87.7	123.1	167.6	-168.9	170.7	179.6	-150.9	-10.3	108.6	S473 T500 G501	R471-S473 PolarHBondContact O-N 3.49Å; R471-T500 PolarHBondContact NE-O 2.99Å; R471-G501 WeakPolarHBondContact CA-O 3.28Å
472	I	67.3	Low	64.1	Low	64 Å²	64	92.3 Å²	92.3	33%	0.328	52%	0.517	S	S	.	.			trans	-74.7	108	175.1	-58	174.7	0	0	0	107.6	L476 I497 G501 V503	I472-L476 HydrophobicContact CB-CD2 4.05Å; I472-L476 HydrophobicContact CD1-CD2 4.2Å; I472-L476 HydrophobicContact CG2-CD2 4.13Å; I472-I497 HydrophobicContact CD1-CD1 3.88Å; I472-G501 PolarHBondContact N-O 2.68Å; I472-V503 HydrophobicContact CD1-CG2 4.18Å; I472-V503 HydrophobicContact CG1-CG2 4.28Å
473	S	54.9	Low	66.8	Low	90 Å²	90	82.8 Å²	82.8	63%	0.629	49%	0.485	S	S	*	.			trans	-75.8	128.7	173.4	-59.6	0	0	0	0	110.4	R471	R471-S473 PolarHBondContact O-N 3.49Å
474	G	59.5	Low	69.2	Low	26 Å²	26	82.3 Å²	82.3	27%	0.268	47%	0.469	S	S	.	.	S	Bend	trans	105.8	-176.5	178	0	0	0	0	0	114.9	D454 L476	D454-G474 PolarHBondContact OD2-N 3.21Å; G474-L476 PolarHBondContact O-N 2.69Å
475	P	62.7	Low	71.7	Confident	99 Å²	99	80.8 Å²	80.8	64%	0.643	45%	0.453	S	S	*	.			trans	-67.4	118.6	-174.4	26.6	-32.8	0	0	0	111.1	Q477	P475-Q477 PolarHBondContact O-N 3.19Å; P475-Q477 VanDerWaalsContact O-N 3.14Å
476	L	70.3	Confident	73.4	Confident	30 Å²	30	85.2 Å²	85.2	16%	0.157	46%	0.461	C	S	.	.			trans	-63.1	112.9	175	-66.5	169.4	0	0	0	109.7	I472 G474 I497 Y542	I472-L476 HydrophobicContact CB-CD2 4.05Å; I472-L476 HydrophobicContact CD1-CD2 4.2Å; I472-L476 HydrophobicContact CG2-CD2 4.13Å; G474-L476 PolarHBondContact O-N 2.69Å; L476-I497 HydrophobicContact CD2-CG2 4.39Å; L476-Y542 HydrophobicContact CB-CD1 4.1Å; L476-Y542 HydrophobicContact CB-CE1 3.49Å; L476-Y542 VanDerWaalsContact CB-CE1 3.49Å; L476-Y542 HydrophobicContact CD1-CE1 4.23Å; L476-Y542 HydrophobicContact CD1-CE2 4.48Å; L476-Y542 HydrophobicContact CG-CE1 4.36Å
477	Q	74.7	Confident	74.8	Confident	115 Å²	115	86 Å²	86	54%	0.537	46%	0.463	S	S	.	.			trans	-90.1	125.7	177.4	-69.2	-179.2	-5.8	0	0	110.1	P475 R479	P475-Q477 PolarHBondContact O-N 3.19Å; P475-Q477 VanDerWaalsContact O-N 3.14Å; Q477-R479 HydrophobicContact CB-CG 4.23Å; Q477-R479 PolarHBondContact O-N 3.35Å; Q477-R479 VanDerWaalsContact O-N 3.15Å
478	I	82.8	Confident	76.5	Confident	75 Å²	75	81.8 Å²	81.8	39%	0.385	44%	0.444	S	S	.	.			trans	-72.2	104.5	172.4	-50.9	174.8	0	0	0	107.8	G447 Y449 P540 V541 Y542	G447-I478 WeakPolarHBondContact O-CD1 3.44Å; Y449-I478 HydrophobicContact CE2-CD1 4.01Å; I478-P540 HydrophobicContact CD1-CB 3.67Å; I478-P540 HydrophobicContact CD1-CG 4.21Å; I478-P540 HydrophobicContact CG1-CB 3.82Å; I478-P540 HydrophobicContact CG1-CG 4.16Å; I478-P540 HydrophobicContact CG2-CB 4.1Å; I478-V541 WeakPolarHBondContact CG2-O 3.39Å; I478-Y542 HydrophobicContact CG1-CE1 4.38Å
479	R	83.7	Confident	78.6	Confident	172 Å²	172	77.4 Å²	77.4	65%	0.649	42%	0.423	S	S	*	.			trans	-114.3	-9.1	178.6	-61.2	-178.1	178.6	168.2	3.4	114	Q477 Y542	Q477-R479 HydrophobicContact CB-CG 4.23Å; Q477-R479 PolarHBondContact O-N 3.35Å; Q477-R479 VanDerWaalsContact O-N 3.15Å; R479-Y542 WeakPolarHBondContact CB-O 3.31Å; R479-Y542 PolarHBondContact N-O 2.95Å
480	G	84.9	Confident	80.3	Confident	17 Å²	17	78.5 Å²	78.5	18%	0.175	41%	0.406	C	S	.	.			trans	-82.4	163.9	179.6	0	0	0	0	0	112.8	V541 G544	G480-V541 WeakPolarHBondContact CA-O 3.49Å; G480-V541 PolarHBondContact N-O 3.29Å; G480-G544 WeakPolarHBondContact CA-O 3.29Å
481	Q	90.8	Very high	81.8	Confident	127 Å²	127	73.5 Å²	73.5	59%	0.593	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.1	-177.6	-61.7	-178.7	20	0	0	110.3	G544 A545 L546	Q481-G544 PolarHBondContact N-O 3.32Å; Q481-A545 CarbonylContact O-C 3.59Å; Q481-A545 WeakPolarHBondContact O-CA 3.24Å; Q481-L546 PolarHBondContact O-N 3.35Å
482	V	92.1	Very high	83.1	Confident	80 Å²	80	70.1 Å²	70.1	49%	0.485	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.2	171	-176.6	0	0	0	0	107.2	V541 L546 R548	V482-V541 HydrophobicContact CG2-CB 4.18Å; V482-V541 HydrophobicContact CG2-CG2 3.58Å; V482-L546 CarbonylContact C-O 3.6Å; V482-L546 WeakPolarHBondContact CA-O 3.44Å; V482-R548 HydrophobicContact CG1-CG 4.44Å
483	I	93.4	Very high	84.3	Confident	55 Å²	55	71.8 Å²	71.8	28%	0.282	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.4	-175.7	-60.4	165.9	0	0	0	107.4	V485 L546 Y547 R548	I483-V485 HydrophobicContact CG2-CG1 4.34Å; I483-L546 PolarHBondContact N-O 2.92Å; I483-Y547 HydrophobicContact CB-CD1 3.75Å; I483-Y547 HydrophobicContact CB-CE1 4.07Å; I483-Y547 HydrophobicContact CB-CG 4.4Å; I483-Y547 HydrophobicContact CD1-CD1 3.96Å; I483-Y547 HydrophobicContact CD1-CE1 3.35Å; I483-Y547 HydrophobicContact CD1-CE2 4.46Å; I483-Y547 HydrophobicContact CG1-CD1 4.45Å; I483-Y547 HydrophobicContact CG1-CE1 4.29Å; I483-Y547 HydrophobicContact CG2-CD1 3.79Å; I483-Y547 HydrophobicContact CG2-CE1 4.06Å; I483-Y547 VanDerWaalsContact O-CA 3.31Å; I483-Y547 WeakPolarHBondContact O-CA 3.46Å; I483-R548 PolarHBondContact O-N 3.04Å; I483-R548 VanDerWaalsContact O-N 3.07Å
484	S	91.9	Very high	86.2	Confident	64 Å²	64	67.5 Å²	67.5	45%	0.448	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.1	174.6	-163.8	0	0	0	0	109.1	R548 E550	S484-R548 WeakPolarHBondContact CA-O 3.44Å; S484-E550 WeakPolarHBondContact CB-OE1 3.47Å; S484-E550 PolarHBondContact OG-OE1 3.23Å
485	V	92.8	Very high	87.7	Confident	40 Å²	40	66.6 Å²	66.6	24%	0.242	34%	0.341	C	S	.	.			trans	-124.3	155.5	177.2	-66.1	0	0	0	0	109.9	I483 G488 Y547 R548 P549	I483-V485 HydrophobicContact CG2-CG1 4.34Å; V485-G488 WeakPolarHBondContact CG2-O 3.13Å; V485-Y547 HydrophobicContact CG1-CD1 3.91Å; V485-Y547 HydrophobicContact CG1-CG 4.43Å; V485-R548 PolarHBondContact N-O 3.21Å; V485-P549 VanDerWaalsContact O-CA 3.29Å; V485-P549 WeakPolarHBondContact O-CA 3.07Å
486	E	86.4	Confident	89.1	Confident	165 Å²	165	61.9 Å²	61.9	77%	0.771	31%	0.311	S	S	*	.	S	Bend	trans	-69.4	-43.1	179.1	-67.4	-174.8	170.8	0	0	111.9
487	N	86.8	Confident	90	Very high	79 Å²	79	60.7 Å²	60.7	42%	0.422	30%	0.304	S	S	.	.	S	Bend	trans	-135.3	148.5	-172	-62.1	-8.9	0	0	0	110.9	D514 R639	N487-D514 VanDerWaalsContact CB-OD2 3.3Å; N487-D514 WeakPolarHBondContact CB-OD2 3.44Å; N487-D514 PolarHBondContact ND2-OD2 3.44Å; N487-R639 PolarHBondContact OD1-NH1 2.64Å
488	G	89.9	Confident	90.6	Very high	12 Å²	12	56.2 Å²	56.2	12%	0.124	29%	0.285	C	S	.	.			trans	80.4	158.5	176.5	0	0	0	0	0	115.7	V485 V512 D514 P549 Y640	V485-G488 WeakPolarHBondContact CG2-O 3.13Å; G488-V512 CarbonylContact C-O 3.48Å; G488-V512 WeakPolarHBondContact CA-O 3.32Å; G488-D514 PolarHBondContact N-OD1 2.92Å; G488-P549 WeakPolarHBondContact O-CD 3.5Å; G488-Y640 WeakPolarHBondContact CA-OH 3.24Å; G488-Y640 PolarHBondContact N-OH 3.4Å
489	I	94.8	Very high	90.5	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.4	170	-60	169.5	0	0	0	107.8	Q511 V512 L535 Y547 M554 Y640 L670	I489-Q511 CarbonylContact O-C 3.6Å; I489-Q511 WeakPolarHBondContact O-CA 3.48Å; I489-V512 HydrophobicContact CB-CB 4.22Å; I489-V512 PolarHBondContact N-O 3.39Å; I489-V512 PolarHBondContact O-N 3.16Å; I489-L535 HydrophobicContact CG2-CD2 3.8Å; I489-Y547 WeakPolarHBondContact CA-O 3.35Å; I489-M554 HydrophobicContact CD1-CE 4.01Å; I489-Y640 HydrophobicContact CD1-CD1 3.99Å; I489-Y640 HydrophobicContact CD1-CE1 4.38Å; I489-Y640 HydrophobicContact CD1-CG 4.29Å; I489-Y640 HydrophobicContact CG1-CE1 4.49Å; I489-L670 HydrophobicContact CD1-CD2 3.94Å
490	R	95.6	Very high	90.2	Very high	95 Å²	95	48 Å²	48	36%	0.358	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.9	176.4	-173.3	-174.4	-68.7	160.6	3.6	110.9	E492 I510 Q511 Y547	R490-E492 VanDerWaalsContact CD-OE1 3.24Å; R490-E492 WeakPolarHBondContact CD-OE1 3.12Å; R490-E492 HydrophobicContact CG-CG 4.17Å; R490-E492 IonicContact NH1-OE1 3.82Å; R490-I510 CarbonylContact C-O 3.55Å; R490-I510 WeakPolarHBondContact CA-O 3.43Å; R490-Q511 HydrophobicContact CG-CB 4.5Å; R490-Q511 VanDerWaalsContact NH2-OE1 3.1Å; R490-Y547 HydrophobicContact CB-CD2 3.92Å; R490-Y547 HydrophobicContact CB-CG 4.25Å; R490-Y547 HydrophobicContact CG-CD2 4.19Å; R490-Y547 PolarHBondContact N-O 2.92Å; R490-Y547 PolarHBondContact O-N 3Å
491	C	95.6	Very high	89.8	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.6	170.9	-58.8	0	0	0	0	108.2	L494 N509 I510	C491-L494 HydrophobicContact CB-CB 3.92Å; C491-L494 HydrophobicContact CB-CD2 3.94Å; C491-L494 VanDerWaalsContact SG-CD2 3.57Å; C491-N509 VanDerWaalsContact O-CA 3.29Å; C491-N509 WeakPolarHBondContact O-CA 3.43Å; C491-I510 HydrophobicContact CB-CG1 3.72Å; C491-I510 PolarHBondContact N-O 2.95Å; C491-I510 PolarHBondContact O-N 3.2Å; C491-I510 VanDerWaalsContact SG-CG1 3.59Å
492	E	94.8	Very high	89.5	Confident	65 Å²	65	44.3 Å²	44.3	30%	0.304	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	111.9	176	-71.1	177.3	-177.5	0	0	109.2	R490 L494 G544 A545 Y547	R490-E492 VanDerWaalsContact CD-OE1 3.24Å; R490-E492 WeakPolarHBondContact CD-OE1 3.12Å; R490-E492 HydrophobicContact CG-CG 4.17Å; R490-E492 IonicContact NH1-OE1 3.82Å; E492-L494 PolarHBondContact O-N 3.43Å; E492-G544 CarbonylContact O-C 3.49Å; E492-G544 VanDerWaalsContact O-CA 3.23Å; E492-G544 WeakPolarHBondContact O-CA 3.44Å; E492-A545 HydrophobicContact CB-CB 4.32Å; E492-A545 PolarHBondContact N-O 3.45Å; E492-A545 PolarHBondContact O-N 3.49Å; E492-Y547 HydrophobicContact CB-CE2 4.41Å; E492-Y547 HydrophobicContact CG-CE2 3.89Å; E492-Y547 WeakPolarHBondContact OE1-CE2 3.26Å; E492-Y547 VanDerWaalsContact OE2-CE2 3.31Å; E492-Y547 WeakPolarHBondContact OE2-CE2 3.2Å; E492-Y547 PolarHBondContact OE2-OH 3.41Å
493	N	92.5	Very high	89.2	Confident	98 Å²	98	40.9 Å²	40.9	52%	0.524	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	47.6	43.7	-176.4	-62.5	-55.6	0	0	0	113.7	P495 S507 L508 N509 G544	N493-P495 VanDerWaalsContact O-CD 3.24Å; N493-P495 WeakPolarHBondContact O-CD 3.4Å; N493-S507 VanDerWaalsContact CA-OG 3.29Å; N493-S507 WeakPolarHBondContact CA-OG 3.27Å; N493-S507 PolarHBondContact OD1-OG 3.31Å; N493-L508 PolarHBondContact N-O 2.89Å; N493-N509 PolarHBondContact N-OD1 2.93Å; N493-N509 PolarHBondContact OD1-ND2 2.93Å; N493-G544 WeakPolarHBondContact O-CA 3.28Å
494	L	93.5	Very high	89	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	112.3	-173.2	-178.2	71.2	0	0	0	110.7	C491 E492 L508 L531 I534 V541 L546	C491-L494 HydrophobicContact CB-CB 3.92Å; C491-L494 HydrophobicContact CB-CD2 3.94Å; C491-L494 VanDerWaalsContact SG-CD2 3.57Å; E492-L494 PolarHBondContact O-N 3.43Å; L494-L508 HydrophobicContact CB-CB 4.3Å; L494-L508 PolarHBondContact N-O 3.21Å; L494-L508 VanDerWaalsContact O-CB 3.29Å; L494-L508 WeakPolarHBondContact O-CB 3.46Å; L494-L508 PolarHBondContact O-N 3.34Å; L494-L531 HydrophobicContact CD2-CD1 4.38Å; L494-I534 HydrophobicContact CD1-CG2 4.39Å; L494-I534 HydrophobicContact CD2-CG2 4.21Å; L494-V541 HydrophobicContact CD1-CB 4.45Å; L494-V541 HydrophobicContact CD1-CG1 3.42Å; L494-V541 VanDerWaalsContact CD1-CG1 3.42Å; L494-V541 HydrophobicContact CD1-CG2 4.27Å; L494-L546 HydrophobicContact CD1-CB 4.49Å
495	P	92.6	Very high	88.9	Confident	7 Å²	7	36.5 Å²	36.5	5%	0.045	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	137.9	173.1	33.1	-30.5	0	0	0	110.5	V466 N493 I497 V505 S506 G543	V466-P495 HydrophobicContact CG1-CB 4.38Å; N493-P495 VanDerWaalsContact O-CD 3.24Å; N493-P495 WeakPolarHBondContact O-CD 3.4Å; P495-I497 HydrophobicContact CB-CD1 4.27Å; P495-I497 HydrophobicContact CB-CG1 4.08Å; P495-I497 HydrophobicContact CG-CD1 4.36Å; P495-V505 CarbonylContact C-O 3.58Å; P495-V505 VanDerWaalsContact CA-O 3.29Å; P495-V505 WeakPolarHBondContact CA-O 3.33Å; P495-S506 WeakPolarHBondContact CB-O 3.16Å; P495-G543 WeakPolarHBondContact CD-O 3.47Å
496	I	91.3	Very high	88.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	104.7	170.2	-56.5	-179.8	0	0	0	107.7	V504 V505 L508 L531 I534 F688	I496-V504 HydrophobicContact CB-CB 4.48Å; I496-V504 HydrophobicContact CG2-CB 4.27Å; I496-V504 PolarHBondContact O-N 3.48Å; I496-V505 HydrophobicContact CB-CB 3.97Å; I496-V505 HydrophobicContact CB-CG2 4.33Å; I496-V505 HydrophobicContact CD1-CB 4.14Å; I496-V505 HydrophobicContact CD1-CG2 3.98Å; I496-V505 HydrophobicContact CG1-CB 4.04Å; I496-V505 HydrophobicContact CG1-CG2 4.38Å; I496-V505 PolarHBondContact N-O 2.66Å; I496-V505 PolarHBondContact O-N 2.91Å; I496-L508 HydrophobicContact CD1-CD2 4.4Å; I496-L531 HydrophobicContact CD1-CB 4Å; I496-L531 HydrophobicContact CD1-CD1 4.36Å; I496-I534 HydrophobicContact CB-CD1 4.3Å; I496-I534 HydrophobicContact CG1-CD1 4.1Å; I496-I534 HydrophobicContact CG2-CD1 4.08Å; I496-F688 HydrophobicContact CD1-CE1 4.38Å
497	I	89.4	Confident	88.8	Confident	5 Å²	5	30.6 Å²	30.6	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.6	-179.9	-47.2	-178.4	0	0	0	108.6	V466 I472 L476 P495 D502 V503 Y542	V466-I497 HydrophobicContact CG1-CD1 4.39Å; I472-I497 HydrophobicContact CD1-CD1 3.88Å; L476-I497 HydrophobicContact CD2-CG2 4.39Å; P495-I497 HydrophobicContact CB-CD1 4.27Å; P495-I497 HydrophobicContact CB-CG1 4.08Å; P495-I497 HydrophobicContact CG-CD1 4.36Å; I497-D502 WeakPolarHBondContact CA-O 3.49Å; I497-V503 HydrophobicContact CG1-CG2 4.39Å; I497-Y542 HydrophobicContact CB-CD2 3.77Å; I497-Y542 HydrophobicContact CB-CE2 4.18Å; I497-Y542 HydrophobicContact CD1-CD2 4.15Å; I497-Y542 HydrophobicContact CD1-CG 4.18Å; I497-Y542 HydrophobicContact CG1-CD2 4.25Å; I497-Y542 HydrophobicContact CG2-CD2 4.47Å
498	T	87.1	Confident	89.1	Confident	22 Å²	22	26.8 Å²	26.8	14%	0.135	15%	0.149	C	C	.	.			trans	-71	158.7	176	60.8	0	0	0	0	111.4	T500 G501 D502 V504 W539	T498-T500 WeakPolarHBondContact CB-OG1 3.42Å; T498-T500 PolarHBondContact O-N 3.06Å; T498-T500 VanDerWaalsContact O-N 3.1Å; T498-T500 PolarHBondContact OG1-N 3.36Å; T498-T500 PolarHBondContact OG1-OG1 3.17Å; T498-G501 PolarHBondContact O-N 3.45Å; T498-D502 HydrophobicContact CG2-CB 4.47Å; T498-D502 PolarHBondContact N-O 3.44Å; T498-D502 WeakPolarHBondContact OG1-CB 3.28Å; T498-D502 PolarHBondContact OG1-N 3.14Å; T498-D502 PolarHBondContact OG1-O 2.97Å; T498-D502 PolarHBondContact OG1-OD2 2.91Å; T498-V504 HydrophobicContact CG2-CG2 3.56Å; T498-W539 HydrophobicContact CG2-CH2 4.39Å; T498-W539 HydrophobicContact CG2-CZ3 4.44Å
499	P	81.2	Confident	89.3	Confident	19 Å²	19	29.3 Å²	29.3	12%	0.123	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.7	169.6	-25.4	33.7	0	0	0	114.2	M201 R451 G501 W539	M201-P499 HydrophobicContact CG-CG 4.46Å; R451-P499 PolarHBondContact NE-O 3.08Å; P499-G501 VanDerWaalsContact C-N 3.25Å; P499-W539 HydrophobicContact CG-CD2 4.18Å; P499-W539 HydrophobicContact CG-CH2 4.16Å; P499-W539 HydrophobicContact CG-CZ2 3.6Å
500	T	76.1	Confident	89.3	Confident	55 Å²	55	29.9 Å²	29.9	34%	0.337	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.6	172.8	42.6	0	0	0	0	113.4	R471 T498 D502	R471-T500 PolarHBondContact NE-O 2.99Å; T498-T500 WeakPolarHBondContact CB-OG1 3.42Å; T498-T500 PolarHBondContact O-N 3.06Å; T498-T500 VanDerWaalsContact O-N 3.1Å; T498-T500 PolarHBondContact OG1-N 3.36Å; T498-T500 PolarHBondContact OG1-OG1 3.17Å; T500-D502 WeakPolarHBondContact CB-OD2 3.12Å; T500-D502 PolarHBondContact OG1-OD2 3.25Å
501	G	77.8	Confident	89.3	Confident	2 Å²	2	29 Å²	29	2%	0.021	16%	0.163	C	C	.	.	S	Bend	trans	91.3	9	-179.2	0	0	0	0	0	113.9	R471 I472 T498 P499	R471-G501 WeakPolarHBondContact CA-O 3.28Å; I472-G501 PolarHBondContact N-O 2.68Å; T498-G501 PolarHBondContact O-N 3.45Å; P499-G501 VanDerWaalsContact C-N 3.25Å
502	D	84	Confident	89.2	Confident	65 Å²	65	29 Å²	29	35%	0.348	16%	0.163	S	C	.	.	B	Isolated β-bridge	trans	-84.6	126.5	-178.3	-48.6	-52.3	0	0	0	109.9	I497 T498 T500 V504	I497-D502 WeakPolarHBondContact CA-O 3.49Å; T498-D502 HydrophobicContact CG2-CB 4.47Å; T498-D502 PolarHBondContact N-O 3.44Å; T498-D502 WeakPolarHBondContact OG1-CB 3.28Å; T498-D502 PolarHBondContact OG1-N 3.14Å; T498-D502 PolarHBondContact OG1-O 2.97Å; T498-D502 PolarHBondContact OG1-OD2 2.91Å; T500-D502 WeakPolarHBondContact CB-OD2 3.12Å; T500-D502 PolarHBondContact OG1-OD2 3.25Å; D502-V504 PolarHBondContact O-N 2.74Å
503	V	86.4	Confident	89	Confident	7 Å²	7	30.5 Å²	30.5	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	105.8	175.2	-179.3	0	0	0	0	109	V466 G469 Q470 I472 I497	V466-V503 HydrophobicContact CG1-CB 4.28Å; V466-V503 HydrophobicContact CG1-CG1 3.64Å; V466-V503 HydrophobicContact CG1-CG2 3.58Å; G469-V503 PolarHBondContact N-O 3.04Å; Q470-V503 PolarHBondContact O-N 3.46Å; I472-V503 HydrophobicContact CD1-CG2 4.18Å; I472-V503 HydrophobicContact CG1-CG2 4.28Å; I497-V503 HydrophobicContact CG1-CG2 4.39Å
504	V	88.6	Confident	88.7	Confident	28 Å²	28	29.6 Å²	29.6	17%	0.17	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-44.9	179.1	-171.2	0	0	0	0	110.8	I496 T498 D502 C526 G692	I496-V504 HydrophobicContact CB-CB 4.48Å; I496-V504 HydrophobicContact CG2-CB 4.27Å; I496-V504 PolarHBondContact O-N 3.48Å; T498-V504 HydrophobicContact CG2-CG2 3.56Å; D502-V504 PolarHBondContact O-N 2.74Å; V504-C526 VanDerWaalsContact CG1-C 3.42Å; V504-C526 VanDerWaalsContact CG1-O 3.22Å; V504-C526 WeakPolarHBondContact CG1-O 3.15Å; V504-G692 WeakPolarHBondContact O-CA 3.11Å
505	V	89.8	Confident	88.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.4	175.7	179.4	0	0	0	0	107.8	P495 I496 L508 F688	P495-V505 CarbonylContact C-O 3.58Å; P495-V505 VanDerWaalsContact CA-O 3.29Å; P495-V505 WeakPolarHBondContact CA-O 3.33Å; I496-V505 HydrophobicContact CB-CB 3.97Å; I496-V505 HydrophobicContact CB-CG2 4.33Å; I496-V505 HydrophobicContact CD1-CB 4.14Å; I496-V505 HydrophobicContact CD1-CG2 3.98Å; I496-V505 HydrophobicContact CG1-CB 4.04Å; I496-V505 HydrophobicContact CG1-CG2 4.38Å; I496-V505 PolarHBondContact N-O 2.66Å; I496-V505 PolarHBondContact O-N 2.91Å; V505-L508 HydrophobicContact CG1-CB 4.26Å; V505-F688 HydrophobicContact CG2-CD1 4.19Å; V505-F688 HydrophobicContact CG2-CE1 3.94Å
506	S	85.7	Confident	88.2	Confident	45 Å²	45	33.9 Å²	33.9	32%	0.315	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-37.4	-175.2	53.6	0	0	0	0	112.9	P495	P495-S506 WeakPolarHBondContact CB-O 3.16Å
507	S	90.9	Very high	88.4	Confident	35 Å²	35	34.7 Å²	34.7	25%	0.245	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	113.1	-179.8	-179.1	0	0	0	0	111	N493 N509 W694	N493-S507 VanDerWaalsContact CA-OG 3.29Å; N493-S507 WeakPolarHBondContact CA-OG 3.27Å; N493-S507 PolarHBondContact OD1-OG 3.31Å; S507-N509 PolarHBondContact OG-ND2 2.95Å; S507-W694 PolarHBondContact O-NE1 2.89Å
508	L	93.4	Very high	88.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.7	175.8	-177.7	69.8	0	0	0	110.2	N493 L494 I496 V505 I510 L531 L686 W694	N493-L508 PolarHBondContact N-O 2.89Å; L494-L508 HydrophobicContact CB-CB 4.3Å; L494-L508 PolarHBondContact N-O 3.21Å; L494-L508 VanDerWaalsContact O-CB 3.29Å; L494-L508 WeakPolarHBondContact O-CB 3.46Å; L494-L508 PolarHBondContact O-N 3.34Å; I496-L508 HydrophobicContact CD1-CD2 4.4Å; V505-L508 HydrophobicContact CG1-CB 4.26Å; L508-I510 HydrophobicContact CD1-CG2 3.83Å; L508-I510 HydrophobicContact CD2-CD1 4.26Å; L508-I510 HydrophobicContact CD2-CG1 4.39Å; L508-I510 HydrophobicContact CG-CG1 4.39Å; L508-I510 HydrophobicContact CG-CG2 4.14Å; L508-L531 HydrophobicContact CD2-CD1 3.62Å; L508-L531 HydrophobicContact CD2-CD2 4.15Å; L508-L686 HydrophobicContact CD1-CD1 4.45Å; L508-W694 HydrophobicContact CD1-CB 4.37Å; L508-W694 HydrophobicContact CD1-CD2 3.54Å; L508-W694 HydrophobicContact CD1-CE3 4.03Å; L508-W694 HydrophobicContact CD1-CG 3.65Å; L508-W694 HydrophobicContact CD1-CZ2 4.44Å
509	N	94.8	Very high	89.1	Confident	65 Å²	65	33.6 Å²	33.6	35%	0.348	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	99.1	177.8	-69.5	-73.3	0	0	0	110.1	C491 N493 S507 W694	C491-N509 VanDerWaalsContact O-CA 3.29Å; C491-N509 WeakPolarHBondContact O-CA 3.43Å; N493-N509 PolarHBondContact N-OD1 2.93Å; N493-N509 PolarHBondContact OD1-ND2 2.93Å; S507-N509 PolarHBondContact OG-ND2 2.95Å; N509-W694 HydrophobicContact CB-CH2 3.9Å; N509-W694 HydrophobicContact CB-CZ2 3.9Å; N509-W694 WeakPolarHBondContact O-CH2 3.33Å; N509-W694 VanDerWaalsContact O-CZ3 3.31Å; N509-W694 WeakPolarHBondContact O-CZ3 3.42Å
510	I	95	Very high	89.8	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.062	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.7	-178.7	61.5	166.7	0	0	0	110.6	R490 C491 L508 L686 W694 F696	R490-I510 CarbonylContact C-O 3.55Å; R490-I510 WeakPolarHBondContact CA-O 3.43Å; C491-I510 HydrophobicContact CB-CG1 3.72Å; C491-I510 PolarHBondContact N-O 2.95Å; C491-I510 PolarHBondContact O-N 3.2Å; C491-I510 VanDerWaalsContact SG-CG1 3.59Å; L508-I510 HydrophobicContact CD1-CG2 3.83Å; L508-I510 HydrophobicContact CD2-CD1 4.26Å; L508-I510 HydrophobicContact CD2-CG1 4.39Å; L508-I510 HydrophobicContact CG-CG1 4.39Å; L508-I510 HydrophobicContact CG-CG2 4.14Å; I510-L686 HydrophobicContact CD1-CD2 4.3Å; I510-L686 HydrophobicContact CG2-CD1 4.06Å; I510-W694 HydrophobicContact CG2-CE3 4.34Å; I510-W694 HydrophobicContact CG2-CZ3 4.1Å; I510-F696 HydrophobicContact CG2-CB 4.4Å; I510-F696 HydrophobicContact CG2-CG 4.36Å
511	Q	94.5	Very high	90.5	Very high	78 Å²	78	31.5 Å²	31.5	36%	0.364	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	122.3	172.8	177.3	167.6	-31.5	0	0	108.7	I489 R490 E513	I489-Q511 CarbonylContact O-C 3.6Å; I489-Q511 WeakPolarHBondContact O-CA 3.48Å; R490-Q511 HydrophobicContact CG-CB 4.5Å; R490-Q511 VanDerWaalsContact NH2-OE1 3.1Å; Q511-E513 HydrophobicContact CG-CG 4.24Å; Q511-E513 PolarHBondContact NE2-OE1 3.15Å
512	V	93.8	Very high	91.2	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117.5	176.2	-173.8	0	0	0	0	106.9	G488 I489 M516 V518 Y640 L670	G488-V512 CarbonylContact C-O 3.48Å; G488-V512 WeakPolarHBondContact CA-O 3.32Å; I489-V512 HydrophobicContact CB-CB 4.22Å; I489-V512 PolarHBondContact N-O 3.39Å; I489-V512 PolarHBondContact O-N 3.16Å; V512-M516 HydrophobicContact CG1-CB 3.97Å; V512-V518 HydrophobicContact CB-CG2 4.5Å; V512-V518 HydrophobicContact CG1-CG2 3.79Å; V512-V518 HydrophobicContact CG2-CG2 3.95Å; V512-Y640 HydrophobicContact CG1-CE1 4.37Å; V512-L670 HydrophobicContact CG1-CD1 4.35Å
513	E	90.6	Very high	91.4	Very high	96 Å²	96	31.8 Å²	31.8	45%	0.449	19%	0.192	S	C	.	.			trans	-94.1	167.6	178.8	-53.8	-175.8	164.9	0	0	110.7	Q511 G515 M516	Q511-E513 HydrophobicContact CG-CG 4.24Å; Q511-E513 PolarHBondContact NE2-OE1 3.15Å; E513-G515 PolarHBondContact O-N 3Å; E513-M516 HydrophobicContact CB-CE 3.76Å; E513-M516 HydrophobicContact CB-CG 4.06Å; E513-M516 HydrophobicContact CB-SD 3.8Å; E513-M516 HydrophobicContact CG-CE 3.69Å; E513-M516 HydrophobicContact CG-SD 3.98Å; E513-M516 PolarHBondContact N-SD 3.17Å; E513-M516 VanDerWaalsContact O-CB 3.3Å; E513-M516 WeakPolarHBondContact O-CB 3.46Å; E513-M516 PolarHBondContact O-N 3.1Å; E513-M516 VanDerWaalsContact O-N 3.08Å; E513-M516 WeakPolarHBondContact OE2-CE 3.35Å
514	D	85.9	Confident	91.5	Very high	80 Å²	80	38.1 Å²	38.1	43%	0.428	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	134.9	177.8	-71.7	-16.1	0	0	0	110.7	N487 G488 M516 Y640	N487-D514 VanDerWaalsContact CB-OD2 3.3Å; N487-D514 WeakPolarHBondContact CB-OD2 3.44Å; N487-D514 PolarHBondContact ND2-OD2 3.44Å; G488-D514 PolarHBondContact N-OD1 2.92Å; D514-M516 PolarHBondContact O-N 3.25Å; D514-Y640 PolarHBondContact N-OH 3.15Å; D514-Y640 PolarHBondContact OD1-OH 3.01Å
515	G	84	Confident	91.2	Very high	58 Å²	58	40.4 Å²	40.4	60%	0.598	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-6.9	-177.3	0	0	0	0	0	115.1	E513 N517	E513-G515 PolarHBondContact O-N 3Å; G515-N517 PolarHBondContact O-N 3.26Å
516	M	92.5	Very high	91.2	Very high	38 Å²	38	40.7 Å²	40.7	19%	0.187	26%	0.256	C	S	.	.			trans	-72.9	116.3	172.5	-67.8	-171.4	174.2	0	0	110.6	V512 E513 D514	V512-M516 HydrophobicContact CG1-CB 3.97Å; E513-M516 HydrophobicContact CB-CE 3.76Å; E513-M516 HydrophobicContact CB-CG 4.06Å; E513-M516 HydrophobicContact CB-SD 3.8Å; E513-M516 HydrophobicContact CG-CE 3.69Å; E513-M516 HydrophobicContact CG-SD 3.98Å; E513-M516 PolarHBondContact N-SD 3.17Å; E513-M516 VanDerWaalsContact O-CB 3.3Å; E513-M516 WeakPolarHBondContact O-CB 3.46Å; E513-M516 PolarHBondContact O-N 3.1Å; E513-M516 VanDerWaalsContact O-N 3.08Å; E513-M516 WeakPolarHBondContact OE2-CE 3.35Å; D514-M516 PolarHBondContact O-N 3.25Å
517	N	95	Very high	91.3	Very high	17 Å²	17	38.9 Å²	38.9	9%	0.091	24%	0.244	C	C	.	.			trans	-92.5	118.4	171.6	-62.6	-58.4	0	0	0	108.8	G515 L669 S683 H684	G515-N517 PolarHBondContact O-N 3.26Å; N517-L669 CarbonylContact C-O 3.56Å; N517-L669 WeakPolarHBondContact CA-O 3.47Å; N517-L669 PolarHBondContact OD1-N 3.19Å; N517-S683 PolarHBondContact N-OG 3.25Å; N517-S683 VanDerWaalsContact N-OG 3.08Å; N517-S683 PolarHBondContact O-N 3.39Å; N517-S683 PolarHBondContact O-OG 3.26Å; N517-H684 PolarHBondContact O-N 2.59Å; N517-H684 VanDerWaalsContact O-N 3.08Å
518	V	95.8	Very high	91.4	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.024	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.7	-173.3	-176.6	0	0	0	0	110.5	V512 I520 L669 L670 S671 H682 H684 L686 F696	V512-V518 HydrophobicContact CB-CG2 4.5Å; V512-V518 HydrophobicContact CG1-CG2 3.79Å; V512-V518 HydrophobicContact CG2-CG2 3.95Å; V518-I520 HydrophobicContact CG1-CG1 4.3Å; V518-L669 PolarHBondContact N-O 2.97Å; V518-L670 HydrophobicContact CB-CG 4.31Å; V518-L670 WeakPolarHBondContact O-CA 3.47Å; V518-S671 PolarHBondContact O-N 3.46Å; V518-H682 VanDerWaalsContact C-CD2 3.42Å; V518-H682 PolarHBondContact O-CD2 3.01Å; V518-H684 HydrophobicContact CG2-CB 4.35Å; V518-L686 HydrophobicContact CG1-CB 4.17Å; V518-F696 HydrophobicContact CG1-CE2 3.99Å; V518-F696 HydrophobicContact CG2-CE2 4.36Å
519	L	95.3	Very high	91.3	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	129.5	171.1	-179.5	64.3	0	0	0	109.5	T673 W679 H682 H684 L685 L686 L699	L519-T673 HydrophobicContact CD1-CG2 3.31Å; L519-W679 HydrophobicContact CD2-CG 4.06Å; L519-H682 HydrophobicContact CB-CB 3.77Å; L519-H684 PolarHBondContact N-O 3.26Å; L519-L685 HydrophobicContact CB-CD1 4.13Å; L519-L685 HydrophobicContact CD2-CD1 3.89Å; L519-L685 HydrophobicContact CG-CD1 3.97Å; L519-L685 CarbonylContact O-C 3.53Å; L519-L685 WeakPolarHBondContact O-CA 3.38Å; L519-L686 PolarHBondContact O-N 2.66Å; L519-L699 HydrophobicContact CD2-CD2 4.06Å
520	I	95.3	Very high	91.3	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.015	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.9	178.7	-53.4	-180	0	0	0	109.2	V518 K528 L531 F532 S671 I672 T673 L686 F688	V518-I520 HydrophobicContact CG1-CG1 4.3Å; I520-K528 HydrophobicContact CG2-CB 4.3Å; I520-K528 HydrophobicContact CG2-CD 4.32Å; I520-K528 HydrophobicContact CG2-CG 4.23Å; I520-L531 HydrophobicContact CD1-CD2 4.35Å; I520-F532 HydrophobicContact CD1-CD1 4.4Å; I520-F532 HydrophobicContact CD1-CE1 3.4Å; I520-F532 HydrophobicContact CD1-CZ 3.7Å; I520-S671 PolarHBondContact N-O 2.95Å; I520-I672 HydrophobicContact CB-CG1 3.87Å; I520-I672 HydrophobicContact CD1-CG1 4.24Å; I520-I672 HydrophobicContact CG2-CG1 4.08Å; I520-T673 PolarHBondContact O-N 2.89Å; I520-L686 WeakPolarHBondContact CA-O 3.15Å; I520-L686 HydrophobicContact CD1-CD2 4.43Å; I520-L686 HydrophobicContact CG1-CB 4.27Å; I520-L686 HydrophobicContact CG1-CD2 4.32Å; I520-L686 HydrophobicContact CG2-CD2 4.44Å; I520-F688 HydrophobicContact CG2-CD2 4.05Å; I520-F688 HydrophobicContact CG2-CE2 3.67Å
521	T	92.4	Very high	91.2	Very high	27 Å²	27	36.2 Å²	36.2	17%	0.166	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	163.3	-179	-160.2	0	0	0	0	112.1	L685 L686 Q687 F688	T521-L685 HydrophobicContact CG2-CD1 3.71Å; T521-L686 PolarHBondContact N-O 3.42Å; T521-Q687 HydrophobicContact CG2-CB 3.88Å; T521-Q687 HydrophobicContact CG2-CG 3.81Å; T521-Q687 WeakPolarHBondContact O-CA 3.47Å; T521-F688 PolarHBondContact O-N 2.8Å
522	G	90.7	Very high	91.3	Very high	9 Å²	9	32.5 Å²	32.5	9%	0.093	21%	0.213	C	C	.	.			trans	148	171.5	177.9	0	0	0	0	0	112.4	K528 H674 F688	G522-K528 PolarHBondContact O-NZ 3.43Å; G522-H674 PolarHBondContact O-CE1 3.32Å; G522-F688 VanDerWaalsContact CA-O 3.27Å; G522-F688 WeakPolarHBondContact CA-O 3.35Å
523	P	88.9	Confident	91.3	Very high	64 Å²	64	36.2 Å²	36.2	42%	0.416	23%	0.226	S	C	.	.			trans	-58.8	165.5	-178.3	-24.6	34.9	0	0	0	114.4	C526 K528 F688	P523-C526 PolarHBondContact O-SG 3.38Å; P523-K528 PolarHBondContact O-NZ 3.41Å; P523-F688 VanDerWaalsContact CD-O 3.31Å; P523-F688 WeakPolarHBondContact CD-O 3.06Å
524	N	88.3	Confident	91.4	Very high	140 Å²	140	31.8 Å²	31.8	75%	0.749	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	140.1	174.2	-70	-12.6	0	0	0	110.4	C526	N524-C526 VanDerWaalsContact C-N 3.32Å; N524-C526 PolarHBondContact O-N 2.72Å
525	G	83.6	Confident	91.8	Very high	75 Å²	75	28 Å²	28	77%	0.773	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	-0.8	179.2	0	0	0	0	0	116.1	G527	G525-G527 PolarHBondContact O-N 3.27Å; G525-G527 VanDerWaalsContact O-N 3.16Å
526	C	88	Confident	92.1	Very high	7 Å²	7	26.8 Å²	26.8	5%	0.047	17%	0.168	C	C	.	.	S	Bend	trans	-75.9	3.9	-179.2	70.6	0	0	0	0	115.5	V504 P523 N524 K528 F688	V504-C526 VanDerWaalsContact CG1-C 3.42Å; V504-C526 VanDerWaalsContact CG1-O 3.22Å; V504-C526 WeakPolarHBondContact CG1-O 3.15Å; P523-C526 PolarHBondContact O-SG 3.38Å; N524-C526 VanDerWaalsContact C-N 3.32Å; N524-C526 PolarHBondContact O-N 2.72Å; C526-K528 WeakPolarHBondContact SG-CG 3.4Å; C526-F688 HydrophobicContact CB-CB 4.05Å; C526-F688 WeakPolarHBondContact SG-CB 3.47Å
527	G	88.3	Confident	91.9	Very high	6 Å²	6	26 Å²	26	6%	0.062	17%	0.169	C	C	.	.	S	Bend	trans	97.9	10.5	174.8	0	0	0	0	0	116.7	G525 S530 L531	G525-G527 PolarHBondContact O-N 3.27Å; G525-G527 VanDerWaalsContact O-N 3.16Å; G527-S530 CarbonylContact O-C 3.49Å; G527-S530 WeakPolarHBondContact O-CA 3.23Å; G527-S530 VanDerWaalsContact O-CB 3.3Å; G527-S530 WeakPolarHBondContact O-CB 3.47Å; G527-S530 PolarHBondContact O-N 3.14Å; G527-S530 VanDerWaalsContact O-N 3.11Å; G527-L531 PolarHBondContact O-N 2.87Å
528	K	92.6	Very high	91.7	Very high	13 Å²	13	26.6 Å²	26.6	6%	0.057	17%	0.173	C	C	.	.	H	α-helix	trans	-53.5	-58.3	177.7	-49.7	-173.8	-66.3	-89.4	0	112.9	I520 G522 P523 C526 S530 L531 F532 I672 F688	I520-K528 HydrophobicContact CG2-CB 4.3Å; I520-K528 HydrophobicContact CG2-CD 4.32Å; I520-K528 HydrophobicContact CG2-CG 4.23Å; G522-K528 PolarHBondContact O-NZ 3.43Å; P523-K528 PolarHBondContact O-NZ 3.41Å; C526-K528 WeakPolarHBondContact SG-CG 3.4Å; K528-S530 PolarHBondContact O-N 3.18Å; K528-L531 WeakPolarHBondContact O-CB 3.47Å; K528-L531 PolarHBondContact O-N 3.3Å; K528-F532 PolarHBondContact O-N 3.11Å; K528-I672 HydrophobicContact CB-CD1 3.7Å; K528-I672 HydrophobicContact CB-CG1 4.09Å; K528-I672 HydrophobicContact CB-CG2 4.12Å; K528-I672 HydrophobicContact CD-CG2 3.93Å; K528-F688 HydrophobicContact CG-CD2 4.01Å; K528-F688 HydrophobicContact CG-CE2 4.36Å
529	S	92.9	Very high	91.5	Very high	29 Å²	29	27.2 Å²	27.2	20%	0.203	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-25.1	177.4	-45.1	0	0	0	0	112.2	F532 R533 D644	S529-F532 PolarHBondContact O-N 2.98Å; S529-R533 WeakPolarHBondContact O-CG 3.42Å; S529-R533 PolarHBondContact O-N 2.76Å; S529-D644 VanDerWaalsContact CB-OD2 3.25Å; S529-D644 WeakPolarHBondContact CB-OD2 3.35Å; S529-D644 PolarHBondContact OG-OD1 3.35Å; S529-D644 PolarHBondContact OG-OD2 3.39Å
530	S	93.4	Very high	91.2	Very high	13 Å²	13	27.9 Å²	27.9	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-66.9	-38.9	173.7	-59.3	0	0	0	0	111.8	G527 K528 F532 R533 I534 W539	G527-S530 CarbonylContact O-C 3.49Å; G527-S530 WeakPolarHBondContact O-CA 3.23Å; G527-S530 VanDerWaalsContact O-CB 3.3Å; G527-S530 WeakPolarHBondContact O-CB 3.47Å; G527-S530 PolarHBondContact O-N 3.14Å; G527-S530 VanDerWaalsContact O-N 3.11Å; K528-S530 PolarHBondContact O-N 3.18Å; S530-F532 VanDerWaalsContact C-N 3.32Å; S530-F532 PolarHBondContact O-N 3.05Å; S530-R533 PolarHBondContact O-N 3.42Å; S530-I534 WeakPolarHBondContact O-CG1 3.36Å; S530-I534 PolarHBondContact O-N 3.4Å; S530-W539 VanDerWaalsContact CB-CZ3 3.41Å; S530-W539 VanDerWaalsContact OG-CH2 3.3Å; S530-W539 WeakPolarHBondContact OG-CH2 3.42Å; S530-W539 WeakPolarHBondContact OG-CZ3 3.06Å
531	L	94.4	Very high	91	Very high	1 Å²	1	28 Å²	28	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-57.4	-47.1	171.6	176.6	61	0	0	0	110.4	L494 I496 L508 I520 G527 K528 R533 I534 L535 L686 F688	L494-L531 HydrophobicContact CD2-CD1 4.38Å; I496-L531 HydrophobicContact CD1-CB 4Å; I496-L531 HydrophobicContact CD1-CD1 4.36Å; L508-L531 HydrophobicContact CD2-CD1 3.62Å; L508-L531 HydrophobicContact CD2-CD2 4.15Å; I520-L531 HydrophobicContact CD1-CD2 4.35Å; G527-L531 PolarHBondContact O-N 2.87Å; K528-L531 WeakPolarHBondContact O-CB 3.47Å; K528-L531 PolarHBondContact O-N 3.3Å; L531-R533 VanDerWaalsContact C-N 3.32Å; L531-R533 PolarHBondContact O-N 3.44Å; L531-I534 WeakPolarHBondContact O-CB 3.39Å; L531-I534 PolarHBondContact O-N 2.67Å; L531-I534 VanDerWaalsContact O-N 3.08Å; L531-L535 HydrophobicContact CD1-CD1 4.34Å; L531-L535 HydrophobicContact CD1-CG 4.15Å; L531-L535 HydrophobicContact CG-CD1 4.11Å; L531-L535 HydrophobicContact CG-CG 4.32Å; L531-L535 WeakPolarHBondContact O-CG 3.47Å; L531-L535 PolarHBondContact O-N 3.17Å; L531-L686 HydrophobicContact CD2-CD2 3.94Å; L531-F688 HydrophobicContact CD2-CZ 4.24Å
532	F	94.9	Very high	90.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-35.2	177.3	-75.6	-1.1	0	0	0	113.5	I520 K528 S529 S530 I534 L535 S536 Y556 L642 D644 L670 I672	I520-F532 HydrophobicContact CD1-CD1 4.4Å; I520-F532 HydrophobicContact CD1-CE1 3.4Å; I520-F532 HydrophobicContact CD1-CZ 3.7Å; K528-F532 PolarHBondContact O-N 3.11Å; S529-F532 PolarHBondContact O-N 2.98Å; S530-F532 VanDerWaalsContact C-N 3.32Å; S530-F532 PolarHBondContact O-N 3.05Å; F532-I534 VanDerWaalsContact C-N 3.31Å; F532-I534 PolarHBondContact O-N 3Å; F532-L535 HydrophobicContact CD1-CD1 4.19Å; F532-L535 PolarHBondContact O-N 3.37Å; F532-S536 VanDerWaalsContact O-CB 3.31Å; F532-S536 WeakPolarHBondContact O-CB 3.47Å; F532-S536 PolarHBondContact O-N 3.28Å; F532-S536 PolarHBondContact O-OG 3.42Å; F532-Y556 HydrophobicContact CB-CD2 4.38Å; F532-Y556 HydrophobicContact CB-CE2 3.76Å; F532-Y556 HydrophobicContact CD2-CD2 4.42Å; F532-Y556 AromaticContact CD2-CE2 3.78Å; F532-Y556 HydrophobicContact CD2-CE2 3.78Å; F532-Y556 HydrophobicContact CG-CE2 4.17Å; F532-L642 HydrophobicContact CD1-CD2 3.8Å; F532-L642 HydrophobicContact CD2-CB 4.36Å; F532-L642 HydrophobicContact CE1-CB 4.44Å; F532-L642 HydrophobicContact CE1-CD2 4.13Å; F532-L642 HydrophobicContact CE1-CG 4.46Å; F532-L642 HydrophobicContact CE2-CB 4.27Å; F532-L642 HydrophobicContact CG-CB 4.47Å; F532-L642 HydrophobicContact CG-CD2 4.16Å; F532-L642 HydrophobicContact CZ-CB 4.3Å; F532-D644 HydrophobicContact CD2-CB 3.96Å; F532-D644 HydrophobicContact CE2-CB 4.26Å; F532-L670 HydrophobicContact CE1-CB 4.26Å; F532-L670 HydrophobicContact CZ-CB 4.21Å; F532-L670 VanDerWaalsContact CZ-O 3.29Å; F532-L670 WeakPolarHBondContact CZ-O 3.3Å; F532-I672 HydrophobicContact CD1-CD1 4.38Å; F532-I672 HydrophobicContact CD2-CD1 3.36Å; F532-I672 HydrophobicContact CD2-CG1 4.15Å; F532-I672 HydrophobicContact CE1-CD1 4.32Å; F532-I672 HydrophobicContact CE1-CG1 4.44Å; F532-I672 HydrophobicContact CE2-CB 4.36Å; F532-I672 HydrophobicContact CE2-CD1 3.28Å; F532-I672 HydrophobicContact CE2-CG1 3.52Å; F532-I672 HydrophobicContact CG-CD1 3.97Å; F532-I672 HydrophobicContact CZ-CD1 3.81Å; F532-I672 HydrophobicContact CZ-CG1 3.71Å
533	R	93.7	Very high	90.7	Very high	79 Å²	79	28.1 Å²	28.1	30%	0.298	18%	0.18	S	C	.	.	H	α-helix	trans	-64.5	-34.4	172.2	-69	173	-169.3	136.1	1.3	112.5	S529 S530 L531 S536 G537 L538 W539	S529-R533 WeakPolarHBondContact O-CG 3.42Å; S529-R533 PolarHBondContact O-N 2.76Å; S530-R533 PolarHBondContact O-N 3.42Å; L531-R533 VanDerWaalsContact C-N 3.32Å; L531-R533 PolarHBondContact O-N 3.44Å; R533-S536 WeakPolarHBondContact CA-OG 3.45Å; R533-S536 PolarHBondContact O-OG 3.29Å; R533-G537 PolarHBondContact O-N 3.1Å; R533-L538 HydrophobicContact CB-CB 4.22Å; R533-L538 HydrophobicContact CG-CD1 4.22Å; R533-L538 WeakPolarHBondContact O-CA 3.39Å; R533-L538 WeakPolarHBondContact O-CB 3.39Å; R533-L538 PolarHBondContact O-N 3.05Å; R533-W539 HydrophobicContact CB-CB 4.29Å; R533-W539 HydrophobicContact CB-CD2 3.95Å; R533-W539 HydrophobicContact CB-CG 3.8Å; R533-W539 VanDerWaalsContact CD-CE2 3.42Å; R533-W539 PolarHBondContact O-N 3.07Å
534	I	93.6	Very high	90.9	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-72.2	-47.9	174.7	-64.6	166.6	0	0	0	110.3	L494 I496 S530 L531 F532 S536 G537 W539 V541 L546	L494-I534 HydrophobicContact CD1-CG2 4.39Å; L494-I534 HydrophobicContact CD2-CG2 4.21Å; I496-I534 HydrophobicContact CB-CD1 4.3Å; I496-I534 HydrophobicContact CG1-CD1 4.1Å; I496-I534 HydrophobicContact CG2-CD1 4.08Å; S530-I534 WeakPolarHBondContact O-CG1 3.36Å; S530-I534 PolarHBondContact O-N 3.4Å; L531-I534 WeakPolarHBondContact O-CB 3.39Å; L531-I534 PolarHBondContact O-N 2.67Å; L531-I534 VanDerWaalsContact O-N 3.08Å; F532-I534 VanDerWaalsContact C-N 3.31Å; F532-I534 PolarHBondContact O-N 3Å; I534-S536 VanDerWaalsContact C-N 3.31Å; I534-S536 PolarHBondContact O-N 3.38Å; I534-G537 PolarHBondContact O-N 2.82Å; I534-W539 HydrophobicContact CG1-CB 3.84Å; I534-W539 HydrophobicContact CG1-CE3 4.46Å; I534-V541 HydrophobicContact CG2-CG2 3.94Å; I534-L546 HydrophobicContact CG2-CD2 4.11Å
535	L	93.2	Very high	91.2	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-61.1	-37.2	179.6	-67.1	-178.7	0	0	0	112.9	I489 L531 F532 G537 L546 R548 L642 L670	I489-L535 HydrophobicContact CG2-CD2 3.8Å; L531-L535 HydrophobicContact CD1-CD1 4.34Å; L531-L535 HydrophobicContact CD1-CG 4.15Å; L531-L535 HydrophobicContact CG-CD1 4.11Å; L531-L535 HydrophobicContact CG-CG 4.32Å; L531-L535 WeakPolarHBondContact O-CG 3.47Å; L531-L535 PolarHBondContact O-N 3.17Å; F532-L535 HydrophobicContact CD1-CD1 4.19Å; F532-L535 PolarHBondContact O-N 3.37Å; L535-G537 VanDerWaalsContact C-N 3.29Å; L535-G537 PolarHBondContact O-N 3.02Å; L535-L546 HydrophobicContact CD2-CD1 3.55Å; L535-L546 HydrophobicContact CD2-CD2 4.38Å; L535-R548 VanDerWaalsContact O-CD 3.23Å; L535-R548 WeakPolarHBondContact O-CD 3.16Å; L535-L642 HydrophobicContact CB-CD2 3.78Å; L535-L642 HydrophobicContact CD1-CD2 3.88Å; L535-L642 HydrophobicContact CG-CD2 4.49Å; L535-L670 HydrophobicContact CD1-CD2 4.39Å
536	S	90.5	Very high	91.8	Very high	31 Å²	31	17 Å²	17	22%	0.217	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.1	176	56.5	0	0	0	0	114	F532 R533 I534	F532-S536 VanDerWaalsContact O-CB 3.31Å; F532-S536 WeakPolarHBondContact O-CB 3.47Å; F532-S536 PolarHBondContact O-N 3.28Å; F532-S536 PolarHBondContact O-OG 3.42Å; R533-S536 WeakPolarHBondContact CA-OG 3.45Å; R533-S536 PolarHBondContact O-OG 3.29Å; I534-S536 VanDerWaalsContact C-N 3.31Å; I534-S536 PolarHBondContact O-N 3.38Å
537	G	89.6	Confident	92.1	Very high	21 Å²	21	19.1 Å²	19.1	22%	0.216	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	81	8.1	179.6	0	0	0	0	0	115.5	R533 I534 L535	R533-G537 PolarHBondContact O-N 3.1Å; I534-G537 PolarHBondContact O-N 2.82Å; L535-G537 VanDerWaalsContact C-N 3.29Å; L535-G537 PolarHBondContact O-N 3.02Å
538	L	90.4	Very high	92.4	Very high	31 Å²	31	20.7 Å²	20.7	16%	0.162	12%	0.12	C	C	.	.	S	Bend	trans	-67.6	-42.4	173.6	-68.3	174.9	0	0	0	111.4	Y196 R533	Y196-L538 HydrophobicContact CD1-CB 4.41Å; Y196-L538 HydrophobicContact CD1-CD2 4.03Å; Y196-L538 HydrophobicContact CD2-CD2 4.45Å; Y196-L538 HydrophobicContact CE1-CB 3.89Å; Y196-L538 HydrophobicContact CE1-CD2 4.23Å; Y196-L538 HydrophobicContact CG-CD2 4.17Å; R533-L538 HydrophobicContact CB-CB 4.22Å; R533-L538 HydrophobicContact CG-CD1 4.22Å; R533-L538 WeakPolarHBondContact O-CA 3.39Å; R533-L538 WeakPolarHBondContact O-CB 3.39Å; R533-L538 PolarHBondContact O-N 3.05Å
539	W	91.3	Very high	92.4	Very high	16 Å²	16	20.1 Å²	20.1	6%	0.061	12%	0.118	C	C	.	.	S	Bend	trans	-102.8	135.3	175	-71.3	10.6	0	0	0	110	Y196 T498 P499 S530 R533 I534	Y196-W539 PolarHBondContact OH-NE1 3.1Å; Y196-W539 VanDerWaalsContact OH-NE1 3.13Å; T498-W539 HydrophobicContact CG2-CH2 4.39Å; T498-W539 HydrophobicContact CG2-CZ3 4.44Å; P499-W539 HydrophobicContact CG-CD2 4.18Å; P499-W539 HydrophobicContact CG-CH2 4.16Å; P499-W539 HydrophobicContact CG-CZ2 3.6Å; S530-W539 VanDerWaalsContact CB-CZ3 3.41Å; S530-W539 VanDerWaalsContact OG-CH2 3.3Å; S530-W539 WeakPolarHBondContact OG-CH2 3.42Å; S530-W539 WeakPolarHBondContact OG-CZ3 3.06Å; R533-W539 HydrophobicContact CB-CB 4.29Å; R533-W539 HydrophobicContact CB-CD2 3.95Å; R533-W539 HydrophobicContact CB-CG 3.8Å; R533-W539 VanDerWaalsContact CD-CE2 3.42Å; R533-W539 PolarHBondContact O-N 3.07Å; I534-W539 HydrophobicContact CG1-CB 3.84Å; I534-W539 HydrophobicContact CG1-CE3 4.46Å
540	P	89.8	Confident	92.2	Very high	16 Å²	16	23.5 Å²	23.5	10%	0.104	13%	0.13	C	C	.	.			trans	-72.6	155.8	179.7	33.6	-38.3	0	0	0	111.1	M201 Y449 I478 Y542	M201-P540 HydrophobicContact CE-CG 3.75Å; Y449-P540 HydrophobicContact CE2-CG 4.01Å; I478-P540 HydrophobicContact CD1-CB 3.67Å; I478-P540 HydrophobicContact CD1-CG 4.21Å; I478-P540 HydrophobicContact CG1-CB 3.82Å; I478-P540 HydrophobicContact CG1-CG 4.16Å; I478-P540 HydrophobicContact CG2-CB 4.1Å; P540-Y542 HydrophobicContact CG-CD1 4.49Å; P540-Y542 HydrophobicContact CG-CE1 3.78Å; P540-Y542 HydrophobicContact CG-CE2 4Å; P540-Y542 PolarHBondContact O-N 3.42Å
541	V	91	Very high	91.9	Very high	6 Å²	6	26 Å²	26	4%	0.036	15%	0.146	C	C	.	.			trans	-84.6	107.1	175	-175.3	0	0	0	0	109.5	I478 G480 V482 L494 I534 G543 L546	I478-V541 WeakPolarHBondContact CG2-O 3.39Å; G480-V541 WeakPolarHBondContact CA-O 3.49Å; G480-V541 PolarHBondContact N-O 3.29Å; V482-V541 HydrophobicContact CG2-CB 4.18Å; V482-V541 HydrophobicContact CG2-CG2 3.58Å; L494-V541 HydrophobicContact CD1-CB 4.45Å; L494-V541 HydrophobicContact CD1-CG1 3.42Å; L494-V541 VanDerWaalsContact CD1-CG1 3.42Å; L494-V541 HydrophobicContact CD1-CG2 4.27Å; I534-V541 HydrophobicContact CG2-CG2 3.94Å; V541-G543 WeakPolarHBondContact CG1-O 3.32Å; V541-L546 HydrophobicContact CG2-CB 4.06Å; V541-L546 HydrophobicContact CG2-CD2 4.02Å
542	Y	87.8	Confident	91.6	Very high	20 Å²	20	34.2 Å²	34.2	8%	0.078	18%	0.184	C	C	.	.			trans	-78.3	-21.2	-176.3	-67.5	-68.3	0	0	0	114.1	L476 I478 R479 I497 P540	L476-Y542 HydrophobicContact CB-CD1 4.1Å; L476-Y542 HydrophobicContact CB-CE1 3.49Å; L476-Y542 VanDerWaalsContact CB-CE1 3.49Å; L476-Y542 HydrophobicContact CD1-CE1 4.23Å; L476-Y542 HydrophobicContact CD1-CE2 4.48Å; L476-Y542 HydrophobicContact CG-CE1 4.36Å; I478-Y542 HydrophobicContact CG1-CE1 4.38Å; R479-Y542 WeakPolarHBondContact CB-O 3.31Å; R479-Y542 PolarHBondContact N-O 2.95Å; I497-Y542 HydrophobicContact CB-CD2 3.77Å; I497-Y542 HydrophobicContact CB-CE2 4.18Å; I497-Y542 HydrophobicContact CD1-CD2 4.15Å; I497-Y542 HydrophobicContact CD1-CG 4.18Å; I497-Y542 HydrophobicContact CG1-CD2 4.25Å; I497-Y542 HydrophobicContact CG2-CD2 4.47Å; P540-Y542 HydrophobicContact CG-CD1 4.49Å; P540-Y542 HydrophobicContact CG-CE1 3.78Å; P540-Y542 HydrophobicContact CG-CE2 4Å; P540-Y542 PolarHBondContact O-N 3.42Å
543	G	88.9	Confident	91.4	Very high	17 Å²	17	36.8 Å²	36.8	18%	0.175	20%	0.198	C	C	.	.	S	Bend	trans	-162.9	170.2	176.9	0	0	0	0	0	111.4	P495 V541	P495-G543 WeakPolarHBondContact CD-O 3.47Å; V541-G543 WeakPolarHBondContact CG1-O 3.32Å
544	G	92.1	Very high	91.4	Very high	33 Å²	33	34 Å²	34	34%	0.34	19%	0.189	S	C	.	.	S	Bend	trans	69.6	-163.3	-176.1	0	0	0	0	0	113.5	G480 Q481 E492 N493	G480-G544 WeakPolarHBondContact CA-O 3.29Å; Q481-G544 PolarHBondContact N-O 3.32Å; E492-G544 CarbonylContact O-C 3.49Å; E492-G544 VanDerWaalsContact O-CA 3.23Å; E492-G544 WeakPolarHBondContact O-CA 3.44Å; N493-G544 WeakPolarHBondContact O-CA 3.28Å
545	A	94.5	Very high	91.4	Very high	11 Å²	11	35.4 Å²	35.4	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.2	176.7	0	0	0	0	0	111.2	Q481 E492 Y547	Q481-A545 CarbonylContact O-C 3.59Å; Q481-A545 WeakPolarHBondContact O-CA 3.24Å; E492-A545 HydrophobicContact CB-CB 4.32Å; E492-A545 PolarHBondContact N-O 3.45Å; E492-A545 PolarHBondContact O-N 3.49Å; A545-Y547 HydrophobicContact CB-CE2 3.82Å
546	L	96.1	Very high	91.5	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117	173.4	172.4	62.2	0	0	0	109	Q481 V482 I483 L494 I534 L535 V541	Q481-L546 PolarHBondContact O-N 3.35Å; V482-L546 CarbonylContact C-O 3.6Å; V482-L546 WeakPolarHBondContact CA-O 3.44Å; I483-L546 PolarHBondContact N-O 2.92Å; L494-L546 HydrophobicContact CD1-CB 4.49Å; I534-L546 HydrophobicContact CG2-CD2 4.11Å; L535-L546 HydrophobicContact CD2-CD1 3.55Å; L535-L546 HydrophobicContact CD2-CD2 4.38Å; V541-L546 HydrophobicContact CG2-CB 4.06Å; V541-L546 HydrophobicContact CG2-CD2 4.02Å
547	Y	95.3	Very high	91.7	Very high	52 Å²	52	36.9 Å²	36.9	20%	0.204	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122	170.8	-52.7	-103.3	0	0	0	107.7	I483 V485 I489 R490 E492 A545	I483-Y547 HydrophobicContact CB-CD1 3.75Å; I483-Y547 HydrophobicContact CB-CE1 4.07Å; I483-Y547 HydrophobicContact CB-CG 4.4Å; I483-Y547 HydrophobicContact CD1-CD1 3.96Å; I483-Y547 HydrophobicContact CD1-CE1 3.35Å; I483-Y547 HydrophobicContact CD1-CE2 4.46Å; I483-Y547 HydrophobicContact CG1-CD1 4.45Å; I483-Y547 HydrophobicContact CG1-CE1 4.29Å; I483-Y547 HydrophobicContact CG2-CD1 3.79Å; I483-Y547 HydrophobicContact CG2-CE1 4.06Å; I483-Y547 VanDerWaalsContact O-CA 3.31Å; I483-Y547 WeakPolarHBondContact O-CA 3.46Å; V485-Y547 HydrophobicContact CG1-CD1 3.91Å; V485-Y547 HydrophobicContact CG1-CG 4.43Å; I489-Y547 WeakPolarHBondContact CA-O 3.35Å; R490-Y547 HydrophobicContact CB-CD2 3.92Å; R490-Y547 HydrophobicContact CB-CG 4.25Å; R490-Y547 HydrophobicContact CG-CD2 4.19Å; R490-Y547 PolarHBondContact N-O 2.92Å; R490-Y547 PolarHBondContact O-N 3Å; E492-Y547 HydrophobicContact CB-CE2 4.41Å; E492-Y547 HydrophobicContact CG-CE2 3.89Å; E492-Y547 WeakPolarHBondContact OE1-CE2 3.26Å; E492-Y547 VanDerWaalsContact OE2-CE2 3.31Å; E492-Y547 WeakPolarHBondContact OE2-CE2 3.2Å; E492-Y547 PolarHBondContact OE2-OH 3.41Å; A545-Y547 HydrophobicContact CB-CE2 3.82Å
548	R	93.6	Very high	91.9	Very high	40 Å²	40	37.9 Å²	37.9	15%	0.151	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	157.4	178.3	67.2	177.4	-173.5	105.3	1.1	111.6	V482 I483 S484 V485 L535 M554	V482-R548 HydrophobicContact CG1-CG 4.44Å; I483-R548 PolarHBondContact O-N 3.04Å; I483-R548 VanDerWaalsContact O-N 3.07Å; S484-R548 WeakPolarHBondContact CA-O 3.44Å; V485-R548 PolarHBondContact N-O 3.21Å; L535-R548 VanDerWaalsContact O-CD 3.23Å; L535-R548 WeakPolarHBondContact O-CD 3.16Å; R548-M554 HydrophobicContact CB-SD 4.31Å
549	P	92.5	Very high	91.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	21%	0.21	C	C	.	.			trans	-63.6	161.9	171.6	-21.5	35.1	0	0	0	113.5	V485 G488 N553 M554 Y640	V485-P549 VanDerWaalsContact O-CA 3.29Å; V485-P549 WeakPolarHBondContact O-CA 3.07Å; G488-P549 WeakPolarHBondContact O-CD 3.5Å; P549-N553 HydrophobicContact CB-CB 4.03Å; P549-M554 HydrophobicContact CB-CG 4.3Å; P549-M554 HydrophobicContact CB-SD 4.48Å; P549-Y640 HydrophobicContact CG-CD2 3.85Å; P549-Y640 HydrophobicContact CG-CE2 3.75Å
550	E	90.3	Very high	91.8	Very high	100 Å²	100	50 Å²	50	47%	0.467	25%	0.246	S	C	.	.			trans	-53.1	143.6	169.2	-75.3	-62	154	0	0	111.1	S484 H552 N553	S484-E550 WeakPolarHBondContact CB-OE1 3.47Å; S484-E550 PolarHBondContact OG-OE1 3.23Å; E550-H552 PolarHBondContact O-N 3.45Å; E550-N553 WeakPolarHBondContact O-CB 3.36Å; E550-N553 PolarHBondContact O-N 3.49Å
551	P	87.1	Confident	91.9	Very high	66 Å²	66	50.3 Å²	50.3	43%	0.429	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-53.2	-32	-174.9	-28	34.9	0	0	0	115.1	N553 M554	P551-N553 PolarHBondContact O-N 2.83Å; P551-M554 PolarHBondContact O-N 3.5Å; P551-M554 VanDerWaalsContact O-N 3.14Å
552	H	86.7	Confident	92	Very high	172 Å²	172	56.1 Å²	56.1	80%	0.796	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-67.9	-20.9	179.6	-57.4	89.6	0	0	0	113.5	E550 M554	E550-H552 PolarHBondContact O-N 3.45Å; H552-M554 VanDerWaalsContact C-N 3.31Å
553	N	91.4	Very high	92.3	Very high	54 Å²	54	55.9 Å²	55.9	29%	0.289	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-87.1	-3.9	176.1	-70.2	-27.3	0	0	0	112.8	P549 E550 P551 R639 Y640	P549-N553 HydrophobicContact CB-CB 4.03Å; E550-N553 WeakPolarHBondContact O-CB 3.36Å; E550-N553 PolarHBondContact O-N 3.49Å; P551-N553 PolarHBondContact O-N 2.83Å; N553-R639 HydrophobicContact CB-CB 4.4Å; N553-R639 HydrophobicContact CB-CG 4.48Å; N553-R639 PolarHBondContact O-N 3.45Å; N553-Y640 PolarHBondContact O-N 3.33Å
554	M	92.9	Very high	92.5	Very high	22 Å²	22	55.6 Å²	55.6	11%	0.108	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.7	-177.4	-58.7	178.6	70.4	0	0	109.8	I489 R548 P549 P551 H552 Y640 L642	I489-M554 HydrophobicContact CD1-CE 4.01Å; R548-M554 HydrophobicContact CB-SD 4.31Å; P549-M554 HydrophobicContact CB-CG 4.3Å; P549-M554 HydrophobicContact CB-SD 4.48Å; P551-M554 PolarHBondContact O-N 3.5Å; P551-M554 VanDerWaalsContact O-N 3.14Å; H552-M554 VanDerWaalsContact C-N 3.31Å; M554-Y640 CarbonylContact C-O 3.55Å; M554-Y640 VanDerWaalsContact CA-O 3.31Å; M554-Y640 WeakPolarHBondContact CA-O 3.45Å; M554-L642 HydrophobicContact CB-CD1 4.35Å; M554-L642 HydrophobicContact CE-CD1 3.61Å; M554-L642 HydrophobicContact CE-CD2 4.32Å
555	F	94.8	Very high	92.4	Very high	33 Å²	33	62.4 Å²	62.4	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134	171.9	-159	-102.2	0	0	0	110.5	I557 R632 M633 H636 P638 Y640 A641 L642	F555-I557 HydrophobicContact CD1-CG1 4.01Å; F555-I557 HydrophobicContact CE1-CG1 4.15Å; F555-R632 HydrophobicContact CE1-CB 3.86Å; F555-R632 HydrophobicContact CZ-CB 3.67Å; F555-M633 HydrophobicContact CD1-CB 3.92Å; F555-M633 HydrophobicContact CD1-CG 4.39Å; F555-M633 HydrophobicContact CE1-CB 4.29Å; F555-H636 HydrophobicContact CD2-CB 4.06Å; F555-H636 AromaticContact CD2-CD2 3.91Å; F555-H636 HydrophobicContact CE2-CB 4.26Å; F555-H636 AromaticContact CE2-CD2 3.21Å; F555-H636 WeakPolarHBondContact CE2-CD2 3.42Å; F555-H636 AromaticContact CE2-CG 3.83Å; F555-H636 AromaticContact CE2-NE2 3.88Å; F555-H636 AromaticContact CZ-CD2 3.7Å; F555-P638 HydrophobicContact CB-CB 3.73Å; F555-P638 HydrophobicContact CB-CG 3.55Å; F555-Y640 PolarHBondContact N-O 2.88Å; F555-A641 WeakPolarHBondContact O-CA 3.06Å; F555-L642 PolarHBondContact O-N 3.42Å
556	Y	94.8	Very high	92.3	Very high	59 Å²	59	63 Å²	63	23%	0.231	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.3	-178.5	175	-109.3	0	0	0	110.6	F532 P558 L642 D644	F532-Y556 HydrophobicContact CB-CD2 4.38Å; F532-Y556 HydrophobicContact CB-CE2 3.76Å; F532-Y556 HydrophobicContact CD2-CD2 4.42Å; F532-Y556 AromaticContact CD2-CE2 3.78Å; F532-Y556 HydrophobicContact CD2-CE2 3.78Å; F532-Y556 HydrophobicContact CG-CE2 4.17Å; Y556-P558 HydrophobicContact CD1-CB 4.49Å; Y556-P558 HydrophobicContact CE1-CB 3.68Å; Y556-P558 HydrophobicContact CE1-CG 4.38Å; Y556-L642 HydrophobicContact CD2-CB 3.76Å; Y556-D644 HydrophobicContact CE2-CB 4.13Å; Y556-D644 PolarHBondContact OH-OD2 3.41Å
557	I	95.2	Very high	92.3	Very high	3 Å²	3	63.8 Å²	63.8	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	110.2	172.8	-50.4	-176.1	0	0	0	108.2	F555 G629 M630 M633 L642 L643 D644 C646	F555-I557 HydrophobicContact CD1-CG1 4.01Å; F555-I557 HydrophobicContact CE1-CG1 4.15Å; I557-G629 WeakPolarHBondContact CD1-O 3.39Å; I557-M630 HydrophobicContact CD1-SD 3.45Å; I557-M630 WeakPolarHBondContact CD1-SD 3.32Å; I557-M633 HydrophobicContact CD1-CB 3.9Å; I557-M633 HydrophobicContact CD1-CG 4.49Å; I557-M633 HydrophobicContact CD1-SD 4.28Å; I557-L642 PolarHBondContact N-O 2.93Å; I557-L643 HydrophobicContact CB-CD2 4.11Å; I557-L643 HydrophobicContact CD1-CD2 3.42Å; I557-L643 VanDerWaalsContact CD1-CD2 3.42Å; I557-L643 HydrophobicContact CG1-CD2 3.84Å; I557-D644 PolarHBondContact O-N 3.12Å; I557-C646 HydrophobicContact CB-CB 4.23Å; I557-C646 HydrophobicContact CG2-CB 3.62Å
558	P	93.5	Very high	92.3	Very high	42 Å²	42	61.3 Å²	61.3	27%	0.273	29%	0.291	S	S	.	.			trans	-72.4	158.9	178.1	29.4	-34	0	0	0	112	Y556 R560	Y556-P558 HydrophobicContact CD1-CB 4.49Å; Y556-P558 HydrophobicContact CE1-CB 3.68Å; Y556-P558 HydrophobicContact CE1-CG 4.38Å; P558-R560 WeakPolarHBondContact CG-O 3.43Å; P558-R560 PolarHBondContact O-N 2.91Å; P558-R560 VanDerWaalsContact O-N 3.16Å
559	Q	90.8	Very high	92.4	Very high	86 Å²	86	60.5 Å²	60.5	40%	0.402	29%	0.287	S	S	.	.	S	Bend	trans	-52.5	-35.7	172.2	-173.4	-174.8	35.3	0	0	113.4	P561 D644 E645	Q559-P561 WeakPolarHBondContact O-CD 3.28Å; Q559-D644 WeakPolarHBondContact CA-O 3.4Å; Q559-D644 PolarHBondContact N-O 3.33Å; Q559-D644 VanDerWaalsContact N-O 3.15Å; Q559-E645 HydrophobicContact CG-CB 4.13Å; Q559-E645 PolarHBondContact NE2-OE2 3.29Å
560	R	89.1	Confident	92.5	Very high	217 Å²	217	62.3 Å²	62.3	82%	0.819	30%	0.297	S	S	*	.	S	Bend	trans	-115.9	96.6	173.4	-63.8	-176.6	-175.6	-171.8	-1.1	109.2	P558 Y562	P558-R560 WeakPolarHBondContact CG-O 3.43Å; P558-R560 PolarHBondContact O-N 2.91Å; P558-R560 VanDerWaalsContact O-N 3.16Å; R560-Y562 PolarHBondContact O-N 2.9Å
561	P	91.2	Very high	92.7	Very high	22 Å²	22	57.5 Å²	57.5	14%	0.143	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-59.1	132.7	178.2	-25.4	34.8	0	0	0	112.1	Q559 M563 Q626	Q559-P561 WeakPolarHBondContact O-CD 3.28Å; P561-M563 HydrophobicContact CB-CE 3.57Å; P561-Q626 HydrophobicContact CG-CG 4.27Å
562	Y	93.3	Very high	93.1	Very high	127 Å²	127	54.4 Å²	54.4	50%	0.498	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-77.6	129.7	173.2	170.5	-110.2	0	0	0	110.3	R560 Y574 R632	R560-Y562 PolarHBondContact O-N 2.9Å; Y562-Y574 HydrophobicContact CD1-CE1 4.17Å; Y562-Y574 HydrophobicContact CD1-CE2 4.45Å; Y562-Y574 HydrophobicContact CE1-CE2 4.09Å; Y562-R632 VanDerWaalsContact O-CZ 3.24Å; Y562-R632 PolarHBondContact O-NH1 2.97Å; Y562-R632 PolarHBondContact O-NH2 3.42Å
563	M	94.1	Very high	93.6	Very high	16 Å²	16	46.2 Å²	46.2	8%	0.079	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-97.8	125.8	171.1	-60.7	-60.5	115.2	0	0	108.6	P561 W616 L620 K625 M628	P561-M563 HydrophobicContact CB-CE 3.57Å; M563-W616 HydrophobicContact CB-CB 3.89Å; M563-W616 HydrophobicContact CG-CB 4.3Å; M563-L620 HydrophobicContact SD-CD1 3.82Å; M563-K625 HydrophobicContact CE-CB 3.88Å; M563-K625 HydrophobicContact CE-CG 4.07Å; M563-K625 HydrophobicContact CG-CG 4.17Å; M563-K625 HydrophobicContact SD-CG 4.15Å; M563-M628 HydrophobicContact CE-CB 4.45Å; M563-M628 HydrophobicContact SD-CG 4.36Å
564	S	92.4	Very high	93.8	Very high	11 Å²	11	48 Å²	48	8%	0.077	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-73.8	154.6	179.8	39.7	0	0	0	0	110.6	D570 Q571	S564-D570 PolarHBondContact OG-O 3.17Å; S564-Q571 PolarHBondContact O-NE2 3.24Å; S564-Q571 PolarHBondContact OG-NE2 3.48Å; S564-Q571 PolarHBondContact OG-OE1 3.38Å
565	E	91.8	Very high	93.8	Very high	176 Å²	176	50.9 Å²	50.9	82%	0.822	24%	0.24	S	C	*	.	S	Bend	trans	-72.2	150.4	164.1	-64.1	-177.5	-178.1	0	0	109.4
566	G	92.6	Very high	93.8	Very high	24 Å²	24	51 Å²	51	25%	0.247	24%	0.242	C	C	.	.	S	Bend	trans	116.3	-146.8	178.5	0	0	0	0	0	113.4	W616	G566-W616 PolarHBondContact O-NE1 2.96Å
567	T	95.2	Very high	93.7	Very high	17 Å²	17	50.4 Å²	50.4	10%	0.104	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-82.9	169.3	-171.2	66.3	0	0	0	0	113.4	R569 D570 Q571 W610 S612 V613	T567-R569 PolarHBondContact O-N 3.27Å; T567-R569 PolarHBondContact OG1-N 3.41Å; T567-D570 WeakPolarHBondContact CB-OD2 3.35Å; T567-D570 PolarHBondContact N-OD2 3.04Å; T567-D570 WeakPolarHBondContact O-CB 3.41Å; T567-D570 PolarHBondContact O-N 3.4Å; T567-D570 PolarHBondContact OG1-N 2.85Å; T567-D570 PolarHBondContact OG1-OD2 3.09Å; T567-Q571 PolarHBondContact O-N 3.23Å; T567-Q571 PolarHBondContact O-NE2 2.93Å; T567-W610 WeakPolarHBondContact CB-O 3.36Å; T567-S612 CarbonylContact C-O 3.56Å; T567-S612 WeakPolarHBondContact CA-O 3.48Å; T567-V613 HydrophobicContact CG2-CG2 3.9Å
568	L	94.8	Very high	93.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-35	169.8	-177.3	60.3	0	0	0	111	D570 Q571 I603 L604 W610 S612 W616 M628	L568-D570 VanDerWaalsContact C-N 3.33Å; L568-D570 PolarHBondContact O-N 3.39Å; L568-Q571 HydrophobicContact CD1-CG 4.49Å; L568-Q571 WeakPolarHBondContact O-CB 3.35Å; L568-Q571 PolarHBondContact O-N 3.03Å; L568-Q571 VanDerWaalsContact O-N 3.15Å; L568-I603 HydrophobicContact CD1-CG2 4.12Å; L568-I603 HydrophobicContact CD2-CG2 4.24Å; L568-L604 HydrophobicContact CD2-CB 4.48Å; L568-L604 HydrophobicContact CD2-CD1 3.83Å; L568-W610 HydrophobicContact CG-CE3 4.26Å; L568-W610 HydrophobicContact CG-CZ3 4.36Å; L568-W610 PolarHBondContact N-O 3.5Å; L568-S612 PolarHBondContact N-O 2.93Å; L568-S612 VanDerWaalsContact N-O 3.11Å; L568-W616 HydrophobicContact CB-CH2 3.77Å; L568-W616 HydrophobicContact CB-CZ2 3.73Å; L568-W616 HydrophobicContact CD1-CE3 4.5Å; L568-W616 HydrophobicContact CD1-CH2 3.97Å; L568-W616 HydrophobicContact CD1-CZ2 4.39Å; L568-W616 HydrophobicContact CD1-CZ3 4.03Å; L568-W616 HydrophobicContact CG-CH2 4.34Å; L568-M628 HydrophobicContact CD1-CE 4Å
569	R	95.4	Very high	93.6	Very high	22 Å²	22	56.4 Å²	56.4	8%	0.083	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-46.2	175.1	-169.6	-176.1	-63.2	106.4	-4	111.1	T567 Q571 V572 I573 D588 L591 W610 E611	T567-R569 PolarHBondContact O-N 3.27Å; T567-R569 PolarHBondContact OG1-N 3.41Å; R569-Q571 PolarHBondContact O-N 3.4Å; R569-Q571 VanDerWaalsContact O-N 3.14Å; R569-V572 PolarHBondContact O-N 3.17Å; R569-I573 HydrophobicContact CG-CD1 4.41Å; R569-I573 HydrophobicContact CG-CG2 4.39Å; R569-I573 WeakPolarHBondContact O-CG1 3.36Å; R569-I573 PolarHBondContact O-N 3.47Å; R569-I573 VanDerWaalsContact O-N 3.17Å; R569-D588 IonicContact CZ-OD1 3.81Å; R569-D588 IonicContact CZ-OD2 3.6Å; R569-D588 IonicContact NE-OD1 3.07Å; R569-D588 PolarHBondContact NE-OD1 2.92Å; R569-D588 IonicContact NE-OD2 2.75Å; R569-D588 IonicContact NH2-OD1 3.98Å; R569-D588 IonicContact NH2-OD2 3.62Å; R569-D588 PolarHBondContact NH2-OD2 3.1Å; R569-L591 HydrophobicContact CG-CD1 3.86Å; R569-W610 HydrophobicContact CB-CB 4.45Å; R569-W610 HydrophobicContact CB-CE3 3.94Å; R569-W610 HydrophobicContact CG-CE3 4.4Å; R569-W610 PolarHBondContact N-O 2.82Å; R569-E611 IonicContact CZ-OE1 2.82Å; R569-E611 IonicContact NH1-OE1 3.15Å; R569-E611 PolarHBondContact NH1-OE1 3.39Å; R569-E611 IonicContact NH1-OE2 3.91Å; R569-E611 IonicContact NH2-OE1 3.12Å; R569-E611 PolarHBondContact NH2-OE1 2.93Å
570	D	95.3	Very high	93.8	Very high	39 Å²	39	54.2 Å²	54.2	21%	0.209	27%	0.27	C	S	.	.	H	α-helix	trans	-56.8	-31.7	178.4	-61.3	-41.1	0	0	0	111.6	S564 T567 L568 V572 Y574	S564-D570 PolarHBondContact OG-O 3.17Å; T567-D570 WeakPolarHBondContact CB-OD2 3.35Å; T567-D570 PolarHBondContact N-OD2 3.04Å; T567-D570 WeakPolarHBondContact O-CB 3.41Å; T567-D570 PolarHBondContact O-N 3.4Å; T567-D570 PolarHBondContact OG1-N 2.85Å; T567-D570 PolarHBondContact OG1-OD2 3.09Å; L568-D570 VanDerWaalsContact C-N 3.33Å; L568-D570 PolarHBondContact O-N 3.39Å; D570-V572 VanDerWaalsContact C-N 3.34Å; D570-V572 PolarHBondContact O-N 3.1Å; D570-Y574 WeakPolarHBondContact O-CB 3.49Å; D570-Y574 PolarHBondContact O-N 3.43Å; D570-Y574 VanDerWaalsContact O-N 3.12Å
571	Q	95.3	Very high	94	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-35.3	176.4	-55.2	-46.3	-56.9	0	0	113.4	S564 T567 L568 R569 W616 M628 R632	S564-Q571 PolarHBondContact O-NE2 3.24Å; S564-Q571 PolarHBondContact OG-NE2 3.48Å; S564-Q571 PolarHBondContact OG-OE1 3.38Å; T567-Q571 PolarHBondContact O-N 3.23Å; T567-Q571 PolarHBondContact O-NE2 2.93Å; L568-Q571 HydrophobicContact CD1-CG 4.49Å; L568-Q571 WeakPolarHBondContact O-CB 3.35Å; L568-Q571 PolarHBondContact O-N 3.03Å; L568-Q571 VanDerWaalsContact O-N 3.15Å; R569-Q571 PolarHBondContact O-N 3.4Å; R569-Q571 VanDerWaalsContact O-N 3.14Å; Q571-W616 VanDerWaalsContact CD-CD1 3.46Å; Q571-W616 HydrophobicContact CG-CB 4.49Å; Q571-W616 HydrophobicContact CG-CD2 4.11Å; Q571-W616 HydrophobicContact CG-CG 3.89Å; Q571-M628 HydrophobicContact CB-CE 4.22Å; Q571-M628 HydrophobicContact CB-CG 4.09Å; Q571-M628 HydrophobicContact CB-SD 3.94Å; Q571-R632 WeakPolarHBondContact O-CG 3.27Å; Q571-R632 PolarHBondContact O-NE 3.38Å; Q571-R632 PolarHBondContact O-NH2 2.93Å
572	V	95.8	Very high	94.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-83.7	-38.6	-177.1	-178	0	0	0	0	111.1	R569 D570 L591 L595 W610 M628 A631 R632	R569-V572 PolarHBondContact O-N 3.17Å; D570-V572 VanDerWaalsContact C-N 3.34Å; D570-V572 PolarHBondContact O-N 3.1Å; V572-L591 HydrophobicContact CG1-CD2 4.07Å; V572-L595 HydrophobicContact CG2-CD2 3.95Å; V572-L595 HydrophobicContact CG2-CG 4.5Å; V572-W610 HydrophobicContact CG2-CH2 4.22Å; V572-W610 HydrophobicContact CG2-CZ3 3.87Å; V572-M628 HydrophobicContact CG2-CE 4.39Å; V572-M628 HydrophobicContact CG2-SD 3.69Å; V572-A631 HydrophobicContact CG1-CB 4.39Å; V572-R632 WeakPolarHBondContact O-CG 3.37Å
573	I	95.7	Very high	94.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-84.9	-19.4	-173.1	67.6	176.9	0	0	0	113.3	R569 D576 V578 L581 L591 Y635 H636	R569-I573 HydrophobicContact CG-CD1 4.41Å; R569-I573 HydrophobicContact CG-CG2 4.39Å; R569-I573 WeakPolarHBondContact O-CG1 3.36Å; R569-I573 PolarHBondContact O-N 3.47Å; R569-I573 VanDerWaalsContact O-N 3.17Å; I573-D576 HydrophobicContact CB-CB 4.49Å; I573-D576 VanDerWaalsContact O-CB 3.31Å; I573-D576 WeakPolarHBondContact O-CB 3.32Å; I573-D576 PolarHBondContact O-N 3.01Å; I573-V578 HydrophobicContact CD1-CG2 4.19Å; I573-L581 HydrophobicContact CG2-CD1 4.02Å; I573-L581 HydrophobicContact CG2-CD2 4.39Å; I573-L591 HydrophobicContact CG2-CD1 4.1Å; I573-L591 HydrophobicContact CG2-CD2 4.18Å; I573-Y635 HydrophobicContact CB-CD1 4.49Å; I573-Y635 HydrophobicContact CB-CE1 3.96Å; I573-Y635 HydrophobicContact CB-CE2 4.34Å; I573-Y635 HydrophobicContact CG2-CD2 4.3Å; I573-Y635 HydrophobicContact CG2-CE1 4.37Å; I573-Y635 HydrophobicContact CG2-CE2 3.87Å; I573-Y635 VanDerWaalsContact O-CE1 3.28Å; I573-Y635 WeakPolarHBondContact O-CE1 3.42Å; I573-H636 PolarHBondContact O-NE2 3.45Å
574	Y	95.5	Very high	94.1	Very high	91 Å²	91	54.4 Å²	54.4	36%	0.357	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	133.5	-178.7	-177	-89.2	0	0	0	112.8	Y562 D570 H636	Y562-Y574 HydrophobicContact CD1-CE1 4.17Å; Y562-Y574 HydrophobicContact CD1-CE2 4.45Å; Y562-Y574 HydrophobicContact CE1-CE2 4.09Å; D570-Y574 WeakPolarHBondContact O-CB 3.49Å; D570-Y574 PolarHBondContact O-N 3.43Å; D570-Y574 VanDerWaalsContact O-N 3.12Å; Y574-H636 PolarHBondContact O-NE2 3.37Å
575	P	93.3	Very high	94.1	Very high	83 Å²	83	56.8 Å²	56.8	54%	0.539	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.4	9.1	9.8	36.5	-38.5	0	0	0	116.2	H636	P575-H636 WeakPolarHBondContact CD-NE2 3.34Å
576	D	94.9	Very high	94.2	Very high	35 Å²	35	49.9 Å²	49.9	19%	0.187	28%	0.275	C	S	.	.	S	Bend	trans	-72.2	154.6	178	-75.3	2.2	0	0	0	112.1	I573 D580 K584 Y635 H636	I573-D576 HydrophobicContact CB-CB 4.49Å; I573-D576 VanDerWaalsContact O-CB 3.31Å; I573-D576 WeakPolarHBondContact O-CB 3.32Å; I573-D576 PolarHBondContact O-N 3.01Å; D576-D580 HydrophobicContact CB-CB 3.82Å; D576-K584 IonicContact OD1-NZ 3.99Å; D576-K584 WeakPolarHBondContact OD2-CE 3.22Å; D576-K584 IonicContact OD2-NZ 2.63Å; D576-K584 PolarHBondContact OD2-NZ 3.29Å; D576-Y635 HydrophobicContact CB-CE1 4.13Å; D576-Y635 VanDerWaalsContact OD2-CE1 3.27Å; D576-Y635 WeakPolarHBondContact OD2-CE1 3.38Å; D576-Y635 PolarHBondContact OD2-OH 2.96Å; D576-H636 IonicContact OD1-CE1 3.58Å; D576-H636 IonicContact OD2-CE1 3.65Å
577	S	93.8	Very high	94.3	Very high	47 Å²	47	52.3 Å²	52.3	33%	0.329	29%	0.285	S	S	.	.			trans	-89.2	167.5	167.5	67.8	0	0	0	0	112	D579 D580 L581	S577-D579 PolarHBondContact O-N 2.7Å; S577-D580 WeakPolarHBondContact CB-OD2 3.36Å; S577-D580 PolarHBondContact N-OD2 2.9Å; S577-D580 WeakPolarHBondContact O-CA 3.36Å; S577-D580 WeakPolarHBondContact O-CB 3.47Å; S577-D580 PolarHBondContact O-N 3.46Å; S577-D580 VanDerWaalsContact OG-CG 3.28Å; S577-D580 PolarHBondContact OG-N 3.24Å; S577-D580 PolarHBondContact OG-OD2 3.26Å; S577-L581 PolarHBondContact O-N 2.85Å
578	V	92.3	Very high	94.3	Very high	61 Å²	61	54.1 Å²	54.1	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-57.9	-34.4	172.7	-178.7	0	0	0	0	111.5	I573 D580 L581 V582	I573-V578 HydrophobicContact CD1-CG2 4.19Å; V578-D580 VanDerWaalsContact C-N 3.28Å; V578-D580 PolarHBondContact O-N 2.88Å; V578-L581 WeakPolarHBondContact O-CB 3.5Å; V578-L581 PolarHBondContact O-N 2.92Å; V578-V582 WeakPolarHBondContact O-CG2 3.49Å; V578-V582 PolarHBondContact O-N 3.44Å; V578-V582 VanDerWaalsContact O-N 3.08Å
579	D	94.2	Very high	94.3	Very high	111 Å²	111	57.6 Å²	57.6	59%	0.594	32%	0.319	S	S	*	.	H	α-helix	trans	-65.7	-31.7	175.1	-67.8	-24.5	0	0	0	112.3	S577 R583	S577-D579 PolarHBondContact O-N 2.7Å; D579-R583 WeakPolarHBondContact O-CB 3.46Å; D579-R583 WeakPolarHBondContact O-CG 3.38Å; D579-R583 PolarHBondContact O-N 2.9Å; D579-R583 VanDerWaalsContact O-N 3.08Å; D579-R583 PolarHBondContact O-NE 3.25Å
580	D	94.3	Very high	94.3	Very high	40 Å²	40	58.8 Å²	58.8	21%	0.214	33%	0.327	C	S	.	.	H	α-helix	trans	-75.5	-36.9	176.3	-58.5	-53.7	0	0	0	111.3	D576 S577 V578 V582 R583 K584	D576-D580 HydrophobicContact CB-CB 3.82Å; S577-D580 WeakPolarHBondContact CB-OD2 3.36Å; S577-D580 PolarHBondContact N-OD2 2.9Å; S577-D580 WeakPolarHBondContact O-CA 3.36Å; S577-D580 WeakPolarHBondContact O-CB 3.47Å; S577-D580 PolarHBondContact O-N 3.46Å; S577-D580 VanDerWaalsContact OG-CG 3.28Å; S577-D580 PolarHBondContact OG-N 3.24Å; S577-D580 PolarHBondContact OG-OD2 3.26Å; V578-D580 VanDerWaalsContact C-N 3.28Å; V578-D580 PolarHBondContact O-N 2.88Å; D580-V582 VanDerWaalsContact C-N 3.34Å; D580-V582 PolarHBondContact O-N 3.31Å; D580-R583 PolarHBondContact O-N 2.95Å; D580-R583 IonicContact OD1-CZ 2.98Å; D580-R583 IonicContact OD1-NE 3.99Å; D580-R583 IonicContact OD1-NH1 2.7Å; D580-R583 PolarHBondContact OD1-NH1 3.4Å; D580-R583 IonicContact OD1-NH2 2.88Å; D580-R583 PolarHBondContact OD1-NH2 2.91Å; D580-K584 WeakPolarHBondContact O-CG 3.33Å; D580-K584 PolarHBondContact O-N 3.09Å
581	L	93.6	Very high	94.3	Very high	8 Å²	8	57 Å²	57	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-56.2	-49.4	171.7	175.8	72.2	0	0	0	110.8	I573 S577 V578 R583 K584 G585 L586 L591 Y635	I573-L581 HydrophobicContact CG2-CD1 4.02Å; I573-L581 HydrophobicContact CG2-CD2 4.39Å; S577-L581 PolarHBondContact O-N 2.85Å; V578-L581 WeakPolarHBondContact O-CB 3.5Å; V578-L581 PolarHBondContact O-N 2.92Å; L581-R583 VanDerWaalsContact C-N 3.33Å; L581-R583 PolarHBondContact O-N 3.04Å; L581-K584 PolarHBondContact O-N 2.67Å; L581-G585 PolarHBondContact O-N 3.48Å; L581-L586 HydrophobicContact CD1-CB 3.64Å; L581-L586 HydrophobicContact CD1-CD1 4.46Å; L581-L586 PolarHBondContact O-N 3.31Å; L581-L591 HydrophobicContact CD1-CD1 4.38Å; L581-L591 HydrophobicContact CD1-CD2 4.24Å; L581-L591 HydrophobicContact CD2-CD1 4.21Å; L581-Y635 HydrophobicContact CD1-CE2 3.59Å
582	V	93	Very high	94.4	Very high	105 Å²	105	59.7 Å²	59.7	64%	0.636	33%	0.33	S	S	*	.	H	α-helix	trans	-62.3	-41.3	176.9	174.7	0	0	0	0	110.8	V578 D580 K584 G585	V578-V582 WeakPolarHBondContact O-CG2 3.49Å; V578-V582 PolarHBondContact O-N 3.44Å; V578-V582 VanDerWaalsContact O-N 3.08Å; D580-V582 VanDerWaalsContact C-N 3.34Å; D580-V582 PolarHBondContact O-N 3.31Å; V582-K584 VanDerWaalsContact C-N 3.32Å; V582-K584 PolarHBondContact O-N 2.99Å; V582-G585 PolarHBondContact O-N 3.22Å
583	R	94.3	Very high	94.4	Very high	176 Å²	176	65.3 Å²	65.3	66%	0.664	36%	0.356	S	S	*	.	H	α-helix	trans	-64.4	-32.6	176	-81	-177.6	-101.6	140.4	-0.1	113.4	D579 D580 L581 G585	D579-R583 WeakPolarHBondContact O-CB 3.46Å; D579-R583 WeakPolarHBondContact O-CG 3.38Å; D579-R583 PolarHBondContact O-N 2.9Å; D579-R583 VanDerWaalsContact O-N 3.08Å; D579-R583 PolarHBondContact O-NE 3.25Å; D580-R583 PolarHBondContact O-N 2.95Å; D580-R583 IonicContact OD1-CZ 2.98Å; D580-R583 IonicContact OD1-NE 3.99Å; D580-R583 IonicContact OD1-NH1 2.7Å; D580-R583 PolarHBondContact OD1-NH1 3.4Å; D580-R583 IonicContact OD1-NH2 2.88Å; D580-R583 PolarHBondContact OD1-NH2 2.91Å; L581-R583 VanDerWaalsContact C-N 3.33Å; L581-R583 PolarHBondContact O-N 3.04Å; R583-G585 PolarHBondContact O-N 3.06Å
584	K	92.9	Very high	94.4	Very high	97 Å²	97	65.8 Å²	65.8	42%	0.422	36%	0.358	S	S	.	.	H	α-helix	trans	-74.2	-10.8	173	-75.5	178.2	172.1	-179.5	0	113	D576 D580 L581 V582 L586 H636	D576-K584 IonicContact OD1-NZ 3.99Å; D576-K584 WeakPolarHBondContact OD2-CE 3.22Å; D576-K584 IonicContact OD2-NZ 2.63Å; D576-K584 PolarHBondContact OD2-NZ 3.29Å; D580-K584 WeakPolarHBondContact O-CG 3.33Å; D580-K584 PolarHBondContact O-N 3.09Å; L581-K584 PolarHBondContact O-N 2.67Å; V582-K584 VanDerWaalsContact C-N 3.32Å; V582-K584 PolarHBondContact O-N 2.99Å; K584-L586 VanDerWaalsContact C-N 3.25Å; K584-L586 HydrophobicContact CB-CD1 4.17Å; K584-L586 HydrophobicContact CB-CG 4.24Å; K584-L586 HydrophobicContact CD-CD1 4.46Å; K584-L586 PolarHBondContact O-N 3.16Å; K584-H636 PolarHBondContact NZ-ND1 2.93Å
585	G	92.8	Very high	94.4	Very high	60 Å²	60	61.5 Å²	61.5	62%	0.619	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	20.5	-179.8	0	0	0	0	0	113.8	L581 V582 R583	L581-G585 PolarHBondContact O-N 3.48Å; V582-G585 PolarHBondContact O-N 3.22Å; R583-G585 PolarHBondContact O-N 3.06Å
586	L	93.7	Very high	94.6	Very high	31 Å²	31	63.2 Å²	63.2	16%	0.162	34%	0.337	C	S	.	.			trans	-90.3	147	177.9	-66.9	170.5	0	0	0	110.2	L581 K584 D590 Y635	L581-L586 HydrophobicContact CD1-CB 3.64Å; L581-L586 HydrophobicContact CD1-CD1 4.46Å; L581-L586 PolarHBondContact O-N 3.31Å; K584-L586 VanDerWaalsContact C-N 3.25Å; K584-L586 HydrophobicContact CB-CD1 4.17Å; K584-L586 HydrophobicContact CB-CG 4.24Å; K584-L586 HydrophobicContact CD-CD1 4.46Å; K584-L586 PolarHBondContact O-N 3.16Å; L586-D590 HydrophobicContact CD2-CB 4.1Å; L586-Y635 HydrophobicContact CD1-CD2 3.85Å; L586-Y635 HydrophobicContact CD1-CE2 3.49Å; L586-Y635 VanDerWaalsContact CD1-CE2 3.49Å
587	T	94.8	Very high	94.6	Very high	75 Å²	75	63.9 Å²	63.9	46%	0.46	34%	0.343	S	S	.	.			trans	-115.3	165.3	-177.4	66	0	0	0	0	111.4	S589 D590 L591	T587-S589 PolarHBondContact O-N 2.99Å; T587-S589 VanDerWaalsContact O-N 3.15Å; T587-D590 PolarHBondContact N-OD2 3.46Å; T587-D590 WeakPolarHBondContact O-CB 3.45Å; T587-D590 PolarHBondContact O-N 3.49Å; T587-D590 PolarHBondContact OG1-OD2 3.33Å; T587-L591 PolarHBondContact O-N 2.98Å
588	D	94.3	Very high	94.6	Very high	55 Å²	55	61.7 Å²	61.7	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-58.1	-27.5	174.8	-75.6	-8.3	0	0	0	111.9	R569 D590 L591 E592	R569-D588 IonicContact CZ-OD1 3.81Å; R569-D588 IonicContact CZ-OD2 3.6Å; R569-D588 IonicContact NE-OD1 3.07Å; R569-D588 PolarHBondContact NE-OD1 2.92Å; R569-D588 IonicContact NE-OD2 2.75Å; R569-D588 IonicContact NH2-OD1 3.98Å; R569-D588 IonicContact NH2-OD2 3.62Å; R569-D588 PolarHBondContact NH2-OD2 3.1Å; D588-D590 PolarHBondContact O-N 3.49Å; D588-L591 PolarHBondContact O-N 3.2Å; D588-E592 WeakPolarHBondContact O-CG 3.33Å; D588-E592 PolarHBondContact O-N 3.16Å
589	S	95.1	Very high	94.8	Very high	73 Å²	73	62.5 Å²	62.5	51%	0.51	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-36.5	173.7	-175.4	0	0	0	0	112.7	T587 L591 E592 E593	T587-S589 PolarHBondContact O-N 2.99Å; T587-S589 VanDerWaalsContact O-N 3.15Å; S589-L591 VanDerWaalsContact C-N 3.34Å; S589-E592 PolarHBondContact O-N 3.28Å; S589-E593 PolarHBondContact O-N 2.93Å; S589-E593 VanDerWaalsContact O-N 3.09Å
590	D	95.2	Very high	94.8	Very high	48 Å²	48	57.2 Å²	57.2	26%	0.257	30%	0.299	S	S	.	.	H	α-helix	trans	-69.3	-38.1	175.9	-57.5	-65.8	0	0	0	110.3	L586 T587 D588 E593 I594	L586-D590 HydrophobicContact CD2-CB 4.1Å; T587-D590 PolarHBondContact N-OD2 3.46Å; T587-D590 WeakPolarHBondContact O-CB 3.45Å; T587-D590 PolarHBondContact O-N 3.49Å; T587-D590 PolarHBondContact OG1-OD2 3.33Å; D588-D590 PolarHBondContact O-N 3.49Å; D590-E593 PolarHBondContact O-N 2.98Å; D590-I594 WeakPolarHBondContact O-CG1 3.45Å; D590-I594 PolarHBondContact O-N 3.35Å
591	L	95.9	Very high	94.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66	-38.1	175.3	-57.1	-176	0	0	0	111.6	R569 V572 I573 L581 T587 D588 S589 I594 L595 W610 Y635	R569-L591 HydrophobicContact CG-CD1 3.86Å; V572-L591 HydrophobicContact CG1-CD2 4.07Å; I573-L591 HydrophobicContact CG2-CD1 4.1Å; I573-L591 HydrophobicContact CG2-CD2 4.18Å; L581-L591 HydrophobicContact CD1-CD1 4.38Å; L581-L591 HydrophobicContact CD1-CD2 4.24Å; L581-L591 HydrophobicContact CD2-CD1 4.21Å; T587-L591 PolarHBondContact O-N 2.98Å; D588-L591 PolarHBondContact O-N 3.2Å; S589-L591 VanDerWaalsContact C-N 3.34Å; L591-I594 HydrophobicContact CD2-CD1 4.34Å; L591-I594 PolarHBondContact O-N 3.19Å; L591-L595 WeakPolarHBondContact O-CG 3.33Å; L591-L595 PolarHBondContact O-N 3.39Å; L591-W610 HydrophobicContact CB-CH2 3.5Å; L591-W610 HydrophobicContact CB-CZ2 3.6Å; L591-W610 HydrophobicContact CB-CZ3 4.35Å; L591-W610 HydrophobicContact CD1-CH2 4.37Å; L591-W610 HydrophobicContact CD1-CZ3 4.46Å; L591-Y635 HydrophobicContact CD2-CD2 3.75Å; L591-Y635 HydrophobicContact CD2-CE2 4.17Å
592	E	96.4	Very high	94.9	Very high	57 Å²	57	61.9 Å²	61.9	27%	0.266	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-41.2	172.3	-77.7	-177.9	-156	0	0	112.4	D588 S589 I594 L595 R596 L601 L604 W610	D588-E592 WeakPolarHBondContact O-CG 3.33Å; D588-E592 PolarHBondContact O-N 3.16Å; S589-E592 PolarHBondContact O-N 3.28Å; E592-I594 VanDerWaalsContact C-N 3.33Å; E592-L595 PolarHBondContact O-N 3.46Å; E592-R596 WeakPolarHBondContact O-CG 3.36Å; E592-R596 PolarHBondContact O-N 3.3Å; E592-R596 IonicContact OE2-CZ 3.96Å; E592-R596 IonicContact OE2-NH1 3.9Å; E592-R596 IonicContact OE2-NH2 3.75Å; E592-R596 PolarHBondContact OE2-NH2 2.96Å; E592-L601 HydrophobicContact CB-CD1 4.05Å; E592-L601 HydrophobicContact CG-CD1 4.04Å; E592-L604 HydrophobicContact CG-CD2 3.91Å; E592-W610 HydrophobicContact CG-CZ2 4.03Å
593	E	95.9	Very high	94.9	Very high	118 Å²	118	57 Å²	57	55%	0.551	29%	0.287	S	S	*	.	H	α-helix	trans	-61.1	-44.2	175.2	-170.6	178.3	177.9	0	0	111.1	S589 D590 L595 R596 T597	S589-E593 PolarHBondContact O-N 2.93Å; S589-E593 VanDerWaalsContact O-N 3.09Å; D590-E593 PolarHBondContact O-N 2.98Å; E593-L595 PolarHBondContact O-N 3.3Å; E593-R596 WeakPolarHBondContact O-CB 3.44Å; E593-R596 PolarHBondContact O-N 2.95Å; E593-R596 VanDerWaalsContact O-N 3.1Å; E593-T597 PolarHBondContact O-N 3.09Å; E593-T597 PolarHBondContact O-OG1 3.41Å; E593-T597 VanDerWaalsContact O-OG1 3.11Å
594	I	96.2	Very high	94.9	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.051	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-46.1	174.3	-68.8	164	0	0	0	111	D590 L591 E592 R596 T597 V598 A631 F634	D590-I594 WeakPolarHBondContact O-CG1 3.45Å; D590-I594 PolarHBondContact O-N 3.35Å; L591-I594 HydrophobicContact CD2-CD1 4.34Å; L591-I594 PolarHBondContact O-N 3.19Å; E592-I594 VanDerWaalsContact C-N 3.33Å; I594-R596 VanDerWaalsContact C-N 3.28Å; I594-R596 PolarHBondContact O-N 3.05Å; I594-T597 WeakPolarHBondContact O-CB 3.38Å; I594-T597 PolarHBondContact O-N 3.15Å; I594-V598 WeakPolarHBondContact O-CG2 3.33Å; I594-V598 PolarHBondContact O-N 3.17Å; I594-V598 VanDerWaalsContact O-N 3.14Å; I594-A631 HydrophobicContact CG2-CB 3.88Å; I594-A631 WeakPolarHBondContact CG2-O 3.3Å; I594-F634 HydrophobicContact CG1-CB 4.28Å; I594-F634 HydrophobicContact CG2-CB 3.87Å
595	L	96.3	Very high	94.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-32	176.4	-70.9	-173.4	0	0	0	112.4	V572 L591 E592 E593 V598 H599 L600 L601 W610 M628 A631	V572-L595 HydrophobicContact CG2-CD2 3.95Å; V572-L595 HydrophobicContact CG2-CG 4.5Å; L591-L595 WeakPolarHBondContact O-CG 3.33Å; L591-L595 PolarHBondContact O-N 3.39Å; E592-L595 PolarHBondContact O-N 3.46Å; E593-L595 PolarHBondContact O-N 3.3Å; L595-V598 HydrophobicContact CD2-CG2 4.42Å; L595-H599 PolarHBondContact O-N 3.44Å; L595-H599 VanDerWaalsContact O-N 3.11Å; L595-L600 HydrophobicContact CD2-CB 3.92Å; L595-L600 HydrophobicContact CD2-CD1 4.49Å; L595-L600 PolarHBondContact O-N 2.96Å; L595-L601 HydrophobicContact CB-CD1 4.47Å; L595-L601 PolarHBondContact O-N 3.28Å; L595-W610 HydrophobicContact CD1-CH2 3.33Å; L595-W610 HydrophobicContact CD1-CZ2 3.91Å; L595-W610 HydrophobicContact CD1-CZ3 4.02Å; L595-W610 HydrophobicContact CG-CH2 3.96Å; L595-M628 HydrophobicContact CD2-CE 4.41Å; L595-A631 HydrophobicContact CD2-CB 4.33Å
596	R	96.3	Very high	94.9	Very high	120 Å²	120	53.4 Å²	53.4	45%	0.453	26%	0.263	S	S	.	.	H	α-helix	trans	-64.8	-45.8	171.8	-73.9	174.4	-168.4	115.1	12.3	111	E592 E593 I594 V598 H599 L601	E592-R596 WeakPolarHBondContact O-CG 3.36Å; E592-R596 PolarHBondContact O-N 3.3Å; E592-R596 IonicContact OE2-CZ 3.96Å; E592-R596 IonicContact OE2-NH1 3.9Å; E592-R596 IonicContact OE2-NH2 3.75Å; E592-R596 PolarHBondContact OE2-NH2 2.96Å; E593-R596 WeakPolarHBondContact O-CB 3.44Å; E593-R596 PolarHBondContact O-N 2.95Å; E593-R596 VanDerWaalsContact O-N 3.1Å; I594-R596 VanDerWaalsContact C-N 3.28Å; I594-R596 PolarHBondContact O-N 3.05Å; R596-V598 VanDerWaalsContact C-N 3.27Å; R596-V598 PolarHBondContact O-N 3.41Å; R596-H599 PolarHBondContact O-N 3.49Å; R596-L601 HydrophobicContact CG-CB 4.14Å; R596-L601 HydrophobicContact CG-CD1 4.28Å; R596-L601 HydrophobicContact CG-CD2 3.73Å; R596-L601 HydrophobicContact CG-CG 4.27Å
597	T	94.8	Very high	94.8	Very high	49 Å²	49	54.1 Å²	54.1	30%	0.301	27%	0.265	S	S	.	.	H	α-helix	trans	-57.4	-40	178.2	-53.1	0	0	0	0	112.2	E593 I594 F634 A661	E593-T597 PolarHBondContact O-N 3.09Å; E593-T597 PolarHBondContact O-OG1 3.41Å; E593-T597 VanDerWaalsContact O-OG1 3.11Å; I594-T597 WeakPolarHBondContact O-CB 3.38Å; I594-T597 PolarHBondContact O-N 3.15Å; T597-F634 HydrophobicContact CG2-CD2 4.42Å; T597-F634 HydrophobicContact CG2-CE1 4.36Å; T597-F634 HydrophobicContact CG2-CE2 3.95Å; T597-F634 HydrophobicContact CG2-CZ 3.92Å; T597-A661 HydrophobicContact CG2-CB 3.71Å
598	V	95.3	Very high	94.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	11	178	-59.5	0	0	0	0	114	I594 L595 R596 L600 R627 M630 A631 F634 I658	I594-V598 WeakPolarHBondContact O-CG2 3.33Å; I594-V598 PolarHBondContact O-N 3.17Å; I594-V598 VanDerWaalsContact O-N 3.14Å; L595-V598 HydrophobicContact CD2-CG2 4.42Å; R596-V598 VanDerWaalsContact C-N 3.27Å; R596-V598 PolarHBondContact O-N 3.41Å; V598-L600 VanDerWaalsContact C-N 3.31Å; V598-L600 HydrophobicContact CG2-CB 3.98Å; V598-L600 HydrophobicContact CG2-CD1 3.96Å; V598-L600 HydrophobicContact CG2-CG 3.82Å; V598-L600 PolarHBondContact O-N 3Å; V598-R627 HydrophobicContact CB-CB 4.43Å; V598-R627 VanDerWaalsContact O-CD 3.27Å; V598-R627 WeakPolarHBondContact O-CD 3.41Å; V598-M630 HydrophobicContact CG1-CB 3.89Å; V598-A631 HydrophobicContact CG1-CB 4.45Å; V598-A631 HydrophobicContact CG2-CB 3.9Å; V598-F634 HydrophobicContact CG1-CD2 3.71Å; V598-F634 HydrophobicContact CG1-CE2 3.72Å; V598-I658 HydrophobicContact CB-CD1 4.36Å; V598-I658 HydrophobicContact CG1-CD1 4.48Å
599	H	94.8	Very high	94.4	Very high	79 Å²	79	52.2 Å²	52.2	37%	0.366	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	41	179.7	-65.3	-82.3	0	0	0	114.2	L595 R596 Y602 V654	L595-H599 PolarHBondContact O-N 3.44Å; L595-H599 VanDerWaalsContact O-N 3.11Å; R596-H599 PolarHBondContact O-N 3.49Å; H599-Y602 WeakPolarHBondContact O-CE1 3.37Å; H599-V654 HydrophobicContact CB-CG1 4.42Å
600	L	95.8	Very high	94.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.			trans	-116.5	2.7	178.4	-69.2	-170.6	0	0	0	114.4	L595 V598 Y602 I603 E624 R627 M628	L595-L600 HydrophobicContact CD2-CB 3.92Å; L595-L600 HydrophobicContact CD2-CD1 4.49Å; L595-L600 PolarHBondContact O-N 2.96Å; V598-L600 VanDerWaalsContact C-N 3.31Å; V598-L600 HydrophobicContact CG2-CB 3.98Å; V598-L600 HydrophobicContact CG2-CD1 3.96Å; V598-L600 HydrophobicContact CG2-CG 3.82Å; V598-L600 PolarHBondContact O-N 3Å; L600-Y602 HydrophobicContact CD2-CE1 4.42Å; L600-Y602 PolarHBondContact O-N 3.38Å; L600-Y602 VanDerWaalsContact O-N 3.11Å; L600-I603 HydrophobicContact CB-CD1 4.33Å; L600-I603 HydrophobicContact CD1-CD1 4.47Å; L600-I603 HydrophobicContact CD2-CD1 3.72Å; L600-I603 HydrophobicContact CG-CD1 4.4Å; L600-I603 WeakPolarHBondContact O-CB 3.43Å; L600-I603 PolarHBondContact O-N 3.31Å; L600-E624 HydrophobicContact CD2-CB 4.37Å; L600-E624 HydrophobicContact CD2-CG 4.16Å; L600-R627 HydrophobicContact CD1-CB 3.7Å; L600-R627 HydrophobicContact CD2-CB 3.93Å; L600-R627 VanDerWaalsContact CD2-NE 3.3Å; L600-R627 HydrophobicContact CG-CB 3.82Å; L600-M628 HydrophobicContact CD1-CB 4.19Å; L600-M628 HydrophobicContact CD1-CE 4.1Å
601	L	94.8	Very high	94.2	Very high	45 Å²	45	53.2 Å²	53.2	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-53.9	-36.2	-177.2	-172.2	71.5	0	0	0	113.1	E592 L595 R596 I603 L604	E592-L601 HydrophobicContact CB-CD1 4.05Å; E592-L601 HydrophobicContact CG-CD1 4.04Å; L595-L601 HydrophobicContact CB-CD1 4.47Å; L595-L601 PolarHBondContact O-N 3.28Å; R596-L601 HydrophobicContact CG-CB 4.14Å; R596-L601 HydrophobicContact CG-CD1 4.28Å; R596-L601 HydrophobicContact CG-CD2 3.73Å; R596-L601 HydrophobicContact CG-CG 4.27Å; L601-I603 PolarHBondContact O-N 2.9Å; L601-I603 VanDerWaalsContact O-N 3.1Å; L601-L604 HydrophobicContact CD1-CD2 4.39Å; L601-L604 VanDerWaalsContact O-CB 3.23Å; L601-L604 WeakPolarHBondContact O-CB 3.42Å; L601-L604 PolarHBondContact O-N 3.45Å
602	Y	94.4	Very high	94.1	Very high	101 Å²	101	54 Å²	54	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-60.5	-21.8	179.2	72.8	-91.1	0	0	0	114	H599 L600 L604 D605 R606 E624 R627	H599-Y602 WeakPolarHBondContact O-CE1 3.37Å; L600-Y602 HydrophobicContact CD2-CE1 4.42Å; L600-Y602 PolarHBondContact O-N 3.38Å; L600-Y602 VanDerWaalsContact O-N 3.11Å; Y602-L604 VanDerWaalsContact C-N 3.28Å; Y602-D605 PolarHBondContact O-N 2.94Å; Y602-R606 VanDerWaalsContact O-CB 3.3Å; Y602-R606 WeakPolarHBondContact O-CB 3.5Å; Y602-R606 PolarHBondContact O-N 3.4Å; Y602-E624 WeakPolarHBondContact CE2-OE1 3.37Å; Y602-E624 VanDerWaalsContact OH-CD 3.32Å; Y602-E624 VanDerWaalsContact OH-CG 3.29Å; Y602-E624 WeakPolarHBondContact OH-CG 3.45Å; Y602-E624 PolarHBondContact OH-OE1 3.5Å; Y602-R627 PolarHBondContact OH-NH2 3.37Å
603	I	94	Very high	94	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-35.3	176.7	-63.3	-175.3	0	0	0	110.1	L568 L600 L601 D605 R606 E607 L620 E624	L568-I603 HydrophobicContact CD1-CG2 4.12Å; L568-I603 HydrophobicContact CD2-CG2 4.24Å; L600-I603 HydrophobicContact CB-CD1 4.33Å; L600-I603 HydrophobicContact CD1-CD1 4.47Å; L600-I603 HydrophobicContact CD2-CD1 3.72Å; L600-I603 HydrophobicContact CG-CD1 4.4Å; L600-I603 WeakPolarHBondContact O-CB 3.43Å; L600-I603 PolarHBondContact O-N 3.31Å; L601-I603 PolarHBondContact O-N 2.9Å; L601-I603 VanDerWaalsContact O-N 3.1Å; I603-D605 VanDerWaalsContact C-N 3.29Å; I603-D605 PolarHBondContact O-N 2.96Å; I603-R606 PolarHBondContact O-N 2.86Å; I603-E607 HydrophobicContact CG2-CG 3.8Å; I603-E607 WeakPolarHBondContact O-CB 3.38Å; I603-E607 WeakPolarHBondContact O-CG 3.32Å; I603-E607 PolarHBondContact O-N 3.28Å; I603-L620 HydrophobicContact CD1-CD2 3.92Å; I603-L620 HydrophobicContact CG2-CD2 4.28Å; I603-E624 HydrophobicContact CD1-CB 4.11Å; I603-E624 HydrophobicContact CD1-CG 3.91Å
604	L	93.4	Very high	93.7	Very high	13 Å²	13	52.5 Å²	52.5	7%	0.068	28%	0.277	C	S	.	.	H	α-helix	trans	-58.7	-44.9	177.8	-172.3	64.5	0	0	0	110.7	L568 E592 L601 Y602 G608 G609 W610	L568-L604 HydrophobicContact CD2-CB 4.48Å; L568-L604 HydrophobicContact CD2-CD1 3.83Å; E592-L604 HydrophobicContact CG-CD2 3.91Å; L601-L604 HydrophobicContact CD1-CD2 4.39Å; L601-L604 VanDerWaalsContact O-CB 3.23Å; L601-L604 WeakPolarHBondContact O-CB 3.42Å; L601-L604 PolarHBondContact O-N 3.45Å; Y602-L604 VanDerWaalsContact C-N 3.28Å; L604-G608 PolarHBondContact O-N 3.4Å; L604-G609 WeakPolarHBondContact O-CA 3.27Å; L604-G609 PolarHBondContact O-N 3.23Å; L604-W610 HydrophobicContact CD1-CB 4.41Å; L604-W610 HydrophobicContact CD1-CD2 3.51Å; L604-W610 HydrophobicContact CD1-CE3 4.05Å; L604-W610 HydrophobicContact CD1-CG 3.66Å; L604-W610 HydrophobicContact CD1-CZ2 4.19Å; L604-W610 HydrophobicContact CD2-CZ2 4.16Å
605	D	91.2	Very high	93.5	Very high	133 Å²	133	56.8 Å²	56.8	71%	0.711	30%	0.3	S	S	*	.	H	α-helix	trans	-72	-40.1	177.2	-61.1	-35.6	0	0	0	112.1	Y602 I603 E607	Y602-D605 PolarHBondContact O-N 2.94Å; I603-D605 VanDerWaalsContact C-N 3.29Å; I603-D605 PolarHBondContact O-N 2.96Å; D605-E607 PolarHBondContact O-N 2.99Å
606	R	93.9	Very high	93.3	Very high	113 Å²	113	56.8 Å²	56.8	43%	0.426	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-40.1	-177.5	-171.1	-178.2	79.3	-167.2	2.6	112.7	Y602 I603 E624	Y602-R606 VanDerWaalsContact O-CB 3.3Å; Y602-R606 WeakPolarHBondContact O-CB 3.5Å; Y602-R606 PolarHBondContact O-N 3.4Å; I603-R606 PolarHBondContact O-N 2.86Å; R606-E624 IonicContact CZ-OE1 2.78Å; R606-E624 IonicContact NH1-OE1 3.77Å; R606-E624 PolarHBondContact NH1-OE1 3.14Å; R606-E624 IonicContact NH1-OE2 2.73Å; R606-E624 IonicContact NH2-OE1 3.25Å; R606-E624 IonicContact NH2-OE2 2.78Å
607	E	91.6	Very high	93.1	Very high	46 Å²	46	57.5 Å²	57.5	22%	0.215	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	0.8	-170.8	-56	-65.2	157.9	0	0	113.1	I603 D605 S612 W616 V619	I603-E607 HydrophobicContact CG2-CG 3.8Å; I603-E607 WeakPolarHBondContact O-CB 3.38Å; I603-E607 WeakPolarHBondContact O-CG 3.32Å; I603-E607 PolarHBondContact O-N 3.28Å; D605-E607 PolarHBondContact O-N 2.99Å; E607-S612 WeakPolarHBondContact O-CB 3.5Å; E607-W616 HydrophobicContact CB-CH2 4.1Å; E607-W616 HydrophobicContact CB-CZ3 4.25Å; E607-W616 HydrophobicContact CG-CH2 4.32Å; E607-W616 HydrophobicContact CG-CZ3 3.96Å; E607-V619 WeakPolarHBondContact OE1-CG1 3.38Å
608	G	87.3	Confident	92.7	Very high	68 Å²	68	61 Å²	61	70%	0.701	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	28.7	174.1	0	0	0	0	0	115	L604	L604-G608 PolarHBondContact O-N 3.4Å
609	G	93.3	Very high	92.5	Very high	21 Å²	21	63.7 Å²	63.7	22%	0.216	34%	0.34	C	S	.	.	S	Bend	trans	95.6	-175.6	171.6	0	0	0	0	0	115.3	L604 E611 S612	L604-G609 WeakPolarHBondContact O-CA 3.27Å; L604-G609 PolarHBondContact O-N 3.23Å; G609-E611 VanDerWaalsContact C-N 3.34Å; G609-E611 PolarHBondContact O-N 3.08Å; G609-S612 WeakPolarHBondContact O-CB 3.38Å; G609-S612 PolarHBondContact O-N 3.45Å; G609-S612 PolarHBondContact O-OG 2.92Å
610	W	94.1	Very high	92.4	Very high	20 Å²	20	60.1 Å²	60.1	8%	0.076	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-30.6	-171.3	-73	115.9	0	0	0	114.7	T567 L568 R569 V572 L591 E592 L595 L604 S612	T567-W610 WeakPolarHBondContact CB-O 3.36Å; L568-W610 HydrophobicContact CG-CE3 4.26Å; L568-W610 HydrophobicContact CG-CZ3 4.36Å; L568-W610 PolarHBondContact N-O 3.5Å; R569-W610 HydrophobicContact CB-CB 4.45Å; R569-W610 HydrophobicContact CB-CE3 3.94Å; R569-W610 HydrophobicContact CG-CE3 4.4Å; R569-W610 PolarHBondContact N-O 2.82Å; V572-W610 HydrophobicContact CG2-CH2 4.22Å; V572-W610 HydrophobicContact CG2-CZ3 3.87Å; L591-W610 HydrophobicContact CB-CH2 3.5Å; L591-W610 HydrophobicContact CB-CZ2 3.6Å; L591-W610 HydrophobicContact CB-CZ3 4.35Å; L591-W610 HydrophobicContact CD1-CH2 4.37Å; L591-W610 HydrophobicContact CD1-CZ3 4.46Å; E592-W610 HydrophobicContact CG-CZ2 4.03Å; L595-W610 HydrophobicContact CD1-CH2 3.33Å; L595-W610 HydrophobicContact CD1-CZ2 3.91Å; L595-W610 HydrophobicContact CD1-CZ3 4.02Å; L595-W610 HydrophobicContact CG-CH2 3.96Å; L604-W610 HydrophobicContact CD1-CB 4.41Å; L604-W610 HydrophobicContact CD1-CD2 3.51Å; L604-W610 HydrophobicContact CD1-CE3 4.05Å; L604-W610 HydrophobicContact CD1-CG 3.66Å; L604-W610 HydrophobicContact CD1-CZ2 4.19Å; L604-W610 HydrophobicContact CD2-CZ2 4.16Å; W610-S612 VanDerWaalsContact C-N 3.32Å
611	E	93	Very high	92.3	Very high	122 Å²	122	63 Å²	63	57%	0.57	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	0.7	-179.3	-57.4	-57.8	152.6	0	0	113.6	R569 G609 V613	R569-E611 IonicContact CZ-OE1 2.82Å; R569-E611 IonicContact NH1-OE1 3.15Å; R569-E611 PolarHBondContact NH1-OE1 3.39Å; R569-E611 IonicContact NH1-OE2 3.91Å; R569-E611 IonicContact NH2-OE1 3.12Å; R569-E611 PolarHBondContact NH2-OE1 2.93Å; G609-E611 VanDerWaalsContact C-N 3.34Å; G609-E611 PolarHBondContact O-N 3.08Å; E611-V613 PolarHBondContact O-N 3.27Å
612	S	93	Very high	92.1	Very high	16 Å²	16	62.9 Å²	62.9	11%	0.112	35%	0.353	C	S	.	.			trans	-59.3	136	176.7	56.8	0	0	0	0	110	T567 L568 E607 G609 W610 W616	T567-S612 CarbonylContact C-O 3.56Å; T567-S612 WeakPolarHBondContact CA-O 3.48Å; L568-S612 PolarHBondContact N-O 2.93Å; L568-S612 VanDerWaalsContact N-O 3.11Å; E607-S612 WeakPolarHBondContact O-CB 3.5Å; G609-S612 WeakPolarHBondContact O-CB 3.38Å; G609-S612 PolarHBondContact O-N 3.45Å; G609-S612 PolarHBondContact O-OG 2.92Å; W610-S612 VanDerWaalsContact C-N 3.32Å; S612-W616 WeakPolarHBondContact O-CZ2 3.5Å; S612-W616 WeakPolarHBondContact OG-CH2 3.23Å
613	V	93.8	Very high	92	Very high	104 Å²	104	58.5 Å²	58.5	63%	0.63	34%	0.339	S	S	*	.	B	Isolated β-bridge	trans	-120.6	119.4	177.7	178.8	0	0	0	0	108.1	T567 E611	T567-V613 HydrophobicContact CG2-CG2 3.9Å; E611-V613 PolarHBondContact O-N 3.27Å
614	S	91.3	Very high	92.1	Very high	41 Å²	41	59 Å²	59	29%	0.287	34%	0.341	S	S	.	.			trans	-143.9	163.4	-175.9	-71.1	0	0	0	0	110.4	W616	S614-W616 PolarHBondContact O-N 3.05Å; S614-W616 PolarHBondContact O-NE1 3.4Å
615	D	90.7	Very high	92.2	Very high	99 Å²	99	60.6 Å²	60.6	53%	0.529	35%	0.348	S	S	.	.			trans	-76.3	82.9	164.9	-167.2	-17.6	0	0	0	109.3	K617 D618 V619	D615-K617 PolarHBondContact O-N 3.18Å; D615-K617 WeakPolarHBondContact OD1-CB 3.36Å; D615-K617 PolarHBondContact OD1-N 2.99Å; D615-D618 PolarHBondContact O-N 3.11Å; D615-V619 WeakPolarHBondContact O-CG2 3.41Å; D615-V619 PolarHBondContact O-N 3.14Å
616	W	93.3	Very high	92.4	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-56.9	-23.6	-176.9	-59.5	111.4	0	0	0	113.5	M563 G566 L568 Q571 E607 S612 S614 D618 L620	M563-W616 HydrophobicContact CB-CB 3.89Å; M563-W616 HydrophobicContact CG-CB 4.3Å; G566-W616 PolarHBondContact O-NE1 2.96Å; L568-W616 HydrophobicContact CB-CH2 3.77Å; L568-W616 HydrophobicContact CB-CZ2 3.73Å; L568-W616 HydrophobicContact CD1-CE3 4.5Å; L568-W616 HydrophobicContact CD1-CH2 3.97Å; L568-W616 HydrophobicContact CD1-CZ2 4.39Å; L568-W616 HydrophobicContact CD1-CZ3 4.03Å; L568-W616 HydrophobicContact CG-CH2 4.34Å; Q571-W616 VanDerWaalsContact CD-CD1 3.46Å; Q571-W616 HydrophobicContact CG-CB 4.49Å; Q571-W616 HydrophobicContact CG-CD2 4.11Å; Q571-W616 HydrophobicContact CG-CG 3.89Å; E607-W616 HydrophobicContact CB-CH2 4.1Å; E607-W616 HydrophobicContact CB-CZ3 4.25Å; E607-W616 HydrophobicContact CG-CH2 4.32Å; E607-W616 HydrophobicContact CG-CZ3 3.96Å; S612-W616 WeakPolarHBondContact O-CZ2 3.5Å; S612-W616 WeakPolarHBondContact OG-CH2 3.23Å; S614-W616 PolarHBondContact O-N 3.05Å; S614-W616 PolarHBondContact O-NE1 3.4Å; W616-D618 VanDerWaalsContact C-N 3.3Å; W616-L620 HydrophobicContact CB-CD1 4.31Å; W616-L620 HydrophobicContact CE3-CD1 4.34Å; W616-L620 HydrophobicContact CE3-CD2 4.32Å; W616-L620 HydrophobicContact CE3-CG 4.16Å; W616-L620 WeakPolarHBondContact O-CB 3.4Å; W616-L620 WeakPolarHBondContact O-CG 3.46Å; W616-L620 PolarHBondContact O-N 3.26Å
617	K	90.4	Very high	92.4	Very high	134 Å²	134	51 Å²	51	58%	0.583	30%	0.302	S	S	*	.	H	α-helix	trans	-66.8	-33.4	175.8	-174	-168.5	166.1	-156	0	111.3	D615 K625	D615-K617 PolarHBondContact O-N 3.18Å; D615-K617 WeakPolarHBondContact OD1-CB 3.36Å; D615-K617 PolarHBondContact OD1-N 2.99Å; K617-K625 WeakPolarHBondContact O-CE 3.35Å; K617-K625 PolarHBondContact O-NZ 3.43Å
618	D	87.8	Confident	92.6	Very high	122 Å²	122	48.9 Å²	48.9	65%	0.652	29%	0.292	S	S	*	.	H	α-helix	trans	-101.1	-29.1	-177.9	-66.9	-11.4	0	0	0	111.9	D615 W616	D615-D618 PolarHBondContact O-N 3.11Å; W616-D618 VanDerWaalsContact C-N 3.3Å
619	V	91.3	Very high	93	Very high	58 Å²	58	45.9 Å²	45.9	35%	0.352	26%	0.261	S	S	.	.	H	α-helix	trans	-73.6	-40	179.8	173	0	0	0	0	113	E607 D615	E607-V619 WeakPolarHBondContact OE1-CG1 3.38Å; D615-V619 WeakPolarHBondContact O-CG2 3.41Å; D615-V619 PolarHBondContact O-N 3.14Å
620	L	93	Very high	93.1	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	25%	0.25	C	S	.	.	S	Bend	trans	-83.2	134.1	-177.9	-61.3	179.1	0	0	0	111.4	M563 I603 W616 E624 K625	M563-L620 HydrophobicContact SD-CD1 3.82Å; I603-L620 HydrophobicContact CD1-CD2 3.92Å; I603-L620 HydrophobicContact CG2-CD2 4.28Å; W616-L620 HydrophobicContact CB-CD1 4.31Å; W616-L620 HydrophobicContact CE3-CD1 4.34Å; W616-L620 HydrophobicContact CE3-CD2 4.32Å; W616-L620 HydrophobicContact CE3-CG 4.16Å; W616-L620 WeakPolarHBondContact O-CB 3.4Å; W616-L620 WeakPolarHBondContact O-CG 3.46Å; W616-L620 PolarHBondContact O-N 3.26Å; L620-E624 HydrophobicContact CB-CB 4.29Å; L620-E624 HydrophobicContact CD2-CB 4.41Å; L620-K625 HydrophobicContact CB-CG 3.73Å; L620-K625 WeakPolarHBondContact O-CE 3.41Å; L620-K625 PolarHBondContact O-NZ 3.17Å
621	S	92.7	Very high	93.3	Very high	60 Å²	60	44 Å²	44	42%	0.42	25%	0.247	S	C	.	.			trans	-66.6	161.5	170.7	66.7	0	0	0	0	111.8	G623 E624 K625	S621-G623 VanDerWaalsContact C-N 3.3Å; S621-G623 PolarHBondContact O-N 2.91Å; S621-E624 WeakPolarHBondContact CB-OE2 3.34Å; S621-E624 PolarHBondContact N-OE2 3.21Å; S621-E624 PolarHBondContact O-N 3.3Å; S621-E624 VanDerWaalsContact O-N 3.13Å; S621-E624 WeakPolarHBondContact OG-CB 3.4Å; S621-E624 WeakPolarHBondContact OG-CG 3.33Å; S621-E624 PolarHBondContact OG-N 2.88Å; S621-E624 PolarHBondContact OG-OE2 3.41Å; S621-K625 WeakPolarHBondContact O-CG 3.28Å; S621-K625 PolarHBondContact O-N 3.48Å
622	G	90.8	Very high	93.4	Very high	43 Å²	43	38.8 Å²	38.8	44%	0.443	22%	0.222	S	C	.	.	H	α-helix	trans	-56.6	-41	179.6	0	0	0	0	0	113.8	Q626	G622-Q626 PolarHBondContact O-N 3.43Å; G622-Q626 VanDerWaalsContact O-N 3.17Å
623	G	92.9	Very high	93.5	Very high	9 Å²	9	38 Å²	38	9%	0.093	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-37	176.1	0	0	0	0	0	113.1	S621 Q626 R627	S621-G623 VanDerWaalsContact C-N 3.3Å; S621-G623 PolarHBondContact O-N 2.91Å; G623-Q626 PolarHBondContact O-N 3.08Å; G623-R627 WeakPolarHBondContact O-CG 3.41Å; G623-R627 PolarHBondContact O-N 3.21Å
624	E	95	Very high	93.7	Very high	12 Å²	12	34 Å²	34	6%	0.056	19%	0.191	C	C	.	.	H	α-helix	trans	-66.5	-43.1	174.9	-71	165.3	150.3	0	0	111.6	L600 Y602 I603 R606 L620 S621 Q626 R627 M628	L600-E624 HydrophobicContact CD2-CB 4.37Å; L600-E624 HydrophobicContact CD2-CG 4.16Å; Y602-E624 WeakPolarHBondContact CE2-OE1 3.37Å; Y602-E624 VanDerWaalsContact OH-CD 3.32Å; Y602-E624 VanDerWaalsContact OH-CG 3.29Å; Y602-E624 WeakPolarHBondContact OH-CG 3.45Å; Y602-E624 PolarHBondContact OH-OE1 3.5Å; I603-E624 HydrophobicContact CD1-CB 4.11Å; I603-E624 HydrophobicContact CD1-CG 3.91Å; R606-E624 IonicContact CZ-OE1 2.78Å; R606-E624 IonicContact NH1-OE1 3.77Å; R606-E624 PolarHBondContact NH1-OE1 3.14Å; R606-E624 IonicContact NH1-OE2 2.73Å; R606-E624 IonicContact NH2-OE1 3.25Å; R606-E624 IonicContact NH2-OE2 2.78Å; L620-E624 HydrophobicContact CB-CB 4.29Å; L620-E624 HydrophobicContact CD2-CB 4.41Å; S621-E624 WeakPolarHBondContact CB-OE2 3.34Å; S621-E624 PolarHBondContact N-OE2 3.21Å; S621-E624 PolarHBondContact O-N 3.3Å; S621-E624 VanDerWaalsContact O-N 3.13Å; S621-E624 WeakPolarHBondContact OG-CB 3.4Å; S621-E624 WeakPolarHBondContact OG-CG 3.33Å; S621-E624 PolarHBondContact OG-N 2.88Å; S621-E624 PolarHBondContact OG-OE2 3.41Å; E624-Q626 VanDerWaalsContact C-N 3.31Å; E624-Q626 PolarHBondContact O-N 3.44Å; E624-R627 PolarHBondContact O-N 3.49Å; E624-M628 WeakPolarHBondContact O-CB 3.42Å; E624-M628 PolarHBondContact O-N 3.2Å
625	K	95.4	Very high	93.9	Very high	47 Å²	47	32.2 Å²	32.2	20%	0.204	18%	0.178	C	C	.	.	H	α-helix	trans	-58.1	-42.2	175.1	-71.4	169.3	178.1	139.9	0	112.4	M563 K617 L620 S621 M628 G629	M563-K625 HydrophobicContact CE-CB 3.88Å; M563-K625 HydrophobicContact CE-CG 4.07Å; M563-K625 HydrophobicContact CG-CG 4.17Å; M563-K625 HydrophobicContact SD-CG 4.15Å; K617-K625 WeakPolarHBondContact O-CE 3.35Å; K617-K625 PolarHBondContact O-NZ 3.43Å; L620-K625 HydrophobicContact CB-CG 3.73Å; L620-K625 WeakPolarHBondContact O-CE 3.41Å; L620-K625 PolarHBondContact O-NZ 3.17Å; S621-K625 WeakPolarHBondContact O-CG 3.28Å; S621-K625 PolarHBondContact O-N 3.48Å; K625-M628 WeakPolarHBondContact O-CB 3.38Å; K625-M628 PolarHBondContact O-N 3.4Å; K625-G629 PolarHBondContact O-N 3.47Å
626	Q	95	Very high	94.1	Very high	10 Å²	10	29.3 Å²	29.3	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-47.6	175.6	-84.7	-174.7	-6.7	0	0	112.4	P561 G622 G623 E624 M628 G629 M630 C646 T647 S648 V650	P561-Q626 HydrophobicContact CG-CG 4.27Å; G622-Q626 PolarHBondContact O-N 3.43Å; G622-Q626 VanDerWaalsContact O-N 3.17Å; G623-Q626 PolarHBondContact O-N 3.08Å; E624-Q626 VanDerWaalsContact C-N 3.31Å; E624-Q626 PolarHBondContact O-N 3.44Å; Q626-M628 VanDerWaalsContact C-N 3.28Å; Q626-M628 PolarHBondContact O-N 2.8Å; Q626-G629 WeakPolarHBondContact O-CA 3.38Å; Q626-G629 PolarHBondContact O-N 3.4Å; Q626-G629 VanDerWaalsContact O-N 3.13Å; Q626-M630 PolarHBondContact O-N 3.28Å; Q626-M630 VanDerWaalsContact O-N 3.16Å; Q626-C646 WeakPolarHBondContact CB-O 3.48Å; Q626-C646 WeakPolarHBondContact CG-O 3.31Å; Q626-C646 PolarHBondContact OE1-O 3.39Å; Q626-T647 VanDerWaalsContact OE1-C 3.3Å; Q626-S648 PolarHBondContact NE2-OG 3.08Å; Q626-V650 HydrophobicContact CB-CG2 4.14Å
627	R	95.6	Very high	94.1	Very high	35 Å²	35	36.8 Å²	36.8	13%	0.132	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-31.3	175.9	-67.6	-170.2	-54.6	-103.8	2.2	112.5	V598 L600 Y602 G623 E624 G629 M630 A631 V650 I658	V598-R627 HydrophobicContact CB-CB 4.43Å; V598-R627 VanDerWaalsContact O-CD 3.27Å; V598-R627 WeakPolarHBondContact O-CD 3.41Å; L600-R627 HydrophobicContact CD1-CB 3.7Å; L600-R627 HydrophobicContact CD2-CB 3.93Å; L600-R627 VanDerWaalsContact CD2-NE 3.3Å; L600-R627 HydrophobicContact CG-CB 3.82Å; Y602-R627 PolarHBondContact OH-NH2 3.37Å; G623-R627 WeakPolarHBondContact O-CG 3.41Å; G623-R627 PolarHBondContact O-N 3.21Å; E624-R627 PolarHBondContact O-N 3.49Å; R627-G629 VanDerWaalsContact C-N 3.34Å; R627-M630 WeakPolarHBondContact O-CB 3.34Å; R627-M630 PolarHBondContact O-N 2.89Å; R627-M630 VanDerWaalsContact O-N 3.16Å; R627-A631 PolarHBondContact O-N 3.03Å; R627-V650 HydrophobicContact CG-CG1 4.36Å; R627-V650 HydrophobicContact CG-CG2 3.88Å; R627-I658 HydrophobicContact CG-CD1 4.21Å
628	M	96.1	Very high	94.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-38.7	172.7	-171.5	59.8	73.9	0	0	111.3	M563 L568 Q571 V572 L595 L600 E624 K625 Q626 M630 A631 R632	M563-M628 HydrophobicContact CE-CB 4.45Å; M563-M628 HydrophobicContact SD-CG 4.36Å; L568-M628 HydrophobicContact CD1-CE 4Å; Q571-M628 HydrophobicContact CB-CE 4.22Å; Q571-M628 HydrophobicContact CB-CG 4.09Å; Q571-M628 HydrophobicContact CB-SD 3.94Å; V572-M628 HydrophobicContact CG2-CE 4.39Å; V572-M628 HydrophobicContact CG2-SD 3.69Å; L595-M628 HydrophobicContact CD2-CE 4.41Å; L600-M628 HydrophobicContact CD1-CB 4.19Å; L600-M628 HydrophobicContact CD1-CE 4.1Å; E624-M628 WeakPolarHBondContact O-CB 3.42Å; E624-M628 PolarHBondContact O-N 3.2Å; K625-M628 WeakPolarHBondContact O-CB 3.38Å; K625-M628 PolarHBondContact O-N 3.4Å; Q626-M628 VanDerWaalsContact C-N 3.28Å; Q626-M628 PolarHBondContact O-N 2.8Å; M628-M630 VanDerWaalsContact C-N 3.29Å; M628-M630 PolarHBondContact O-N 3.05Å; M628-A631 WeakPolarHBondContact O-CB 3.39Å; M628-A631 PolarHBondContact O-N 3.3Å; M628-A631 VanDerWaalsContact O-N 3.16Å; M628-A631 HydrophobicContact SD-CB 4.25Å; M628-R632 PolarHBondContact O-N 2.92Å; M628-R632 VanDerWaalsContact O-N 3.09Å
629	G	95.4	Very high	94.5	Very high	4 Å²	4	30.7 Å²	30.7	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-56.9	-42.1	169.4	0	0	0	0	0	112.6	I557 K625 Q626 R627 R632 M633	I557-G629 WeakPolarHBondContact CD1-O 3.39Å; K625-G629 PolarHBondContact O-N 3.47Å; Q626-G629 WeakPolarHBondContact O-CA 3.38Å; Q626-G629 PolarHBondContact O-N 3.4Å; Q626-G629 VanDerWaalsContact O-N 3.13Å; R627-G629 VanDerWaalsContact C-N 3.34Å; G629-R632 WeakPolarHBondContact O-CB 3.4Å; G629-R632 PolarHBondContact O-N 2.89Å; G629-M633 PolarHBondContact O-N 3.32Å
630	M	95.5	Very high	94.7	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-66.9	-37.1	175	-58.4	-59.5	-73.6	0	0	112.2	I557 V598 Q626 R627 M628 R632 M633 F634 L643 I658	I557-M630 HydrophobicContact CD1-SD 3.45Å; I557-M630 WeakPolarHBondContact CD1-SD 3.32Å; V598-M630 HydrophobicContact CG1-CB 3.89Å; Q626-M630 PolarHBondContact O-N 3.28Å; Q626-M630 VanDerWaalsContact O-N 3.16Å; R627-M630 WeakPolarHBondContact O-CB 3.34Å; R627-M630 PolarHBondContact O-N 2.89Å; R627-M630 VanDerWaalsContact O-N 3.16Å; M628-M630 VanDerWaalsContact C-N 3.29Å; M628-M630 PolarHBondContact O-N 3.05Å; M630-R632 VanDerWaalsContact C-N 3.29Å; M630-R632 PolarHBondContact O-N 2.88Å; M630-M633 HydrophobicContact CE-CE 3.86Å; M630-M633 HydrophobicContact CE-SD 4.31Å; M630-M633 WeakPolarHBondContact O-CB 3.32Å; M630-M633 PolarHBondContact O-N 2.75Å; M630-M633 VanDerWaalsContact O-N 3.15Å; M630-F634 WeakPolarHBondContact O-CD2 3.44Å; M630-F634 PolarHBondContact O-N 3.31Å; M630-F634 VanDerWaalsContact O-N 3.08Å; M630-L643 HydrophobicContact CE-CD1 4.45Å; M630-L643 HydrophobicContact SD-CD2 4.24Å; M630-I658 HydrophobicContact CB-CG2 4.17Å; M630-I658 HydrophobicContact CE-CG2 3.33Å; M630-I658 HydrophobicContact CG-CG2 4.09Å
631	A	96.4	Very high	94.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.3	-43.4	175	0	0	0	0	0	111.1	V572 I594 L595 V598 R627 M628 M633 F634 Y635	V572-A631 HydrophobicContact CG1-CB 4.39Å; I594-A631 HydrophobicContact CG2-CB 3.88Å; I594-A631 WeakPolarHBondContact CG2-O 3.3Å; L595-A631 HydrophobicContact CD2-CB 4.33Å; V598-A631 HydrophobicContact CG1-CB 4.45Å; V598-A631 HydrophobicContact CG2-CB 3.9Å; R627-A631 PolarHBondContact O-N 3.03Å; M628-A631 WeakPolarHBondContact O-CB 3.39Å; M628-A631 PolarHBondContact O-N 3.3Å; M628-A631 VanDerWaalsContact O-N 3.16Å; M628-A631 HydrophobicContact SD-CB 4.25Å; A631-M633 VanDerWaalsContact C-N 3.32Å; A631-M633 PolarHBondContact O-N 3.21Å; A631-F634 PolarHBondContact O-N 2.93Å; A631-Y635 PolarHBondContact O-N 3.01Å
632	R	96.1	Very high	95	Very high	14 Å²	14	25 Å²	25	5%	0.053	12%	0.118	C	C	.	.	H	α-helix	trans	-59.6	-42.1	175.1	-64.7	174.6	-176.9	168.3	2.7	112.3	F555 Y562 Q571 V572 M628 G629 M630 F634 Y635 H636	F555-R632 HydrophobicContact CE1-CB 3.86Å; F555-R632 HydrophobicContact CZ-CB 3.67Å; Y562-R632 VanDerWaalsContact O-CZ 3.24Å; Y562-R632 PolarHBondContact O-NH1 2.97Å; Y562-R632 PolarHBondContact O-NH2 3.42Å; Q571-R632 WeakPolarHBondContact O-CG 3.27Å; Q571-R632 PolarHBondContact O-NE 3.38Å; Q571-R632 PolarHBondContact O-NH2 2.93Å; V572-R632 WeakPolarHBondContact O-CG 3.37Å; M628-R632 PolarHBondContact O-N 2.92Å; M628-R632 VanDerWaalsContact O-N 3.09Å; G629-R632 WeakPolarHBondContact O-CB 3.4Å; G629-R632 PolarHBondContact O-N 2.89Å; M630-R632 VanDerWaalsContact C-N 3.29Å; M630-R632 PolarHBondContact O-N 2.88Å; R632-F634 VanDerWaalsContact C-N 3.33Å; R632-F634 PolarHBondContact O-N 2.91Å; R632-Y635 WeakPolarHBondContact O-CB 3.46Å; R632-Y635 PolarHBondContact O-N 3.31Å; R632-H636 PolarHBondContact O-CD2 3.13Å; R632-H636 PolarHBondContact O-N 3.4Å
633	M	95.9	Very high	95.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.5	-43.1	176.5	-179.6	-161.4	72.2	0	0	111.5	F555 I557 G629 M630 A631 H636 R637 P638 A641 L643 A662 I667	F555-M633 HydrophobicContact CD1-CB 3.92Å; F555-M633 HydrophobicContact CD1-CG 4.39Å; F555-M633 HydrophobicContact CE1-CB 4.29Å; I557-M633 HydrophobicContact CD1-CB 3.9Å; I557-M633 HydrophobicContact CD1-CG 4.49Å; I557-M633 HydrophobicContact CD1-SD 4.28Å; G629-M633 PolarHBondContact O-N 3.32Å; M630-M633 HydrophobicContact CE-CE 3.86Å; M630-M633 HydrophobicContact CE-SD 4.31Å; M630-M633 WeakPolarHBondContact O-CB 3.32Å; M630-M633 PolarHBondContact O-N 2.75Å; M630-M633 VanDerWaalsContact O-N 3.15Å; A631-M633 VanDerWaalsContact C-N 3.32Å; A631-M633 PolarHBondContact O-N 3.21Å; M633-H636 PolarHBondContact O-N 3.18Å; M633-R637 PolarHBondContact O-N 2.86Å; M633-P638 HydrophobicContact CG-CG 4.06Å; M633-P638 WeakPolarHBondContact O-CD 3.4Å; M633-A641 HydrophobicContact CG-CB 4.07Å; M633-A641 HydrophobicContact SD-CB 3.51Å; M633-A641 VanDerWaalsContact SD-CB 3.51Å; M633-L643 HydrophobicContact SD-CD2 4.15Å; M633-A662 HydrophobicContact CE-CB 3.76Å; M633-I667 HydrophobicContact CE-CD1 4.16Å; M633-I667 HydrophobicContact CG-CD1 4.4Å
634	F	96.3	Very high	95.3	Very high	18 Å²	18	22.9 Å²	22.9	8%	0.079	9%	0.094	C	C	.	.	H	α-helix	trans	-67.6	-34.4	176	-73.8	-64.2	0	0	0	113.3	I594 T597 V598 M630 A631 R632 R637 I658 A661 A662	I594-F634 HydrophobicContact CG1-CB 4.28Å; I594-F634 HydrophobicContact CG2-CB 3.87Å; T597-F634 HydrophobicContact CG2-CD2 4.42Å; T597-F634 HydrophobicContact CG2-CE1 4.36Å; T597-F634 HydrophobicContact CG2-CE2 3.95Å; T597-F634 HydrophobicContact CG2-CZ 3.92Å; V598-F634 HydrophobicContact CG1-CD2 3.71Å; V598-F634 HydrophobicContact CG1-CE2 3.72Å; M630-F634 WeakPolarHBondContact O-CD2 3.44Å; M630-F634 PolarHBondContact O-N 3.31Å; M630-F634 VanDerWaalsContact O-N 3.08Å; A631-F634 PolarHBondContact O-N 2.93Å; R632-F634 VanDerWaalsContact C-N 3.33Å; R632-F634 PolarHBondContact O-N 2.91Å; F634-R637 WeakPolarHBondContact O-CG 3.14Å; F634-I658 HydrophobicContact CE2-CG2 4.08Å; F634-I658 HydrophobicContact CZ-CG2 4.37Å; F634-A661 HydrophobicContact CE1-CB 4.25Å; F634-A661 HydrophobicContact CZ-CB 3.97Å; F634-A662 HydrophobicContact CE1-CB 4.14Å; F634-A662 HydrophobicContact CZ-CB 4.09Å
635	Y	95.8	Very high	95.1	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-63.5	-45.6	173.3	168.8	-102.9	0	0	0	111.8	I573 D576 L581 L586 L591 A631 R632	I573-Y635 HydrophobicContact CB-CD1 4.49Å; I573-Y635 HydrophobicContact CB-CE1 3.96Å; I573-Y635 HydrophobicContact CB-CE2 4.34Å; I573-Y635 HydrophobicContact CG2-CD2 4.3Å; I573-Y635 HydrophobicContact CG2-CE1 4.37Å; I573-Y635 HydrophobicContact CG2-CE2 3.87Å; I573-Y635 VanDerWaalsContact O-CE1 3.28Å; I573-Y635 WeakPolarHBondContact O-CE1 3.42Å; D576-Y635 HydrophobicContact CB-CE1 4.13Å; D576-Y635 VanDerWaalsContact OD2-CE1 3.27Å; D576-Y635 WeakPolarHBondContact OD2-CE1 3.38Å; D576-Y635 PolarHBondContact OD2-OH 2.96Å; L581-Y635 HydrophobicContact CD1-CE2 3.59Å; L586-Y635 HydrophobicContact CD1-CD2 3.85Å; L586-Y635 HydrophobicContact CD1-CE2 3.49Å; L586-Y635 VanDerWaalsContact CD1-CE2 3.49Å; L591-Y635 HydrophobicContact CD2-CD2 3.75Å; L591-Y635 HydrophobicContact CD2-CE2 4.17Å; A631-Y635 PolarHBondContact O-N 3.01Å; R632-Y635 WeakPolarHBondContact O-CB 3.46Å; R632-Y635 PolarHBondContact O-N 3.31Å
636	H	94.6	Very high	94.9	Very high	38 Å²	38	22 Å²	22	18%	0.176	9%	0.091	C	C	.	.	H	α-helix	trans	-79.3	-20.8	-177.4	-73	-67.6	0	0	0	114.4	F555 I573 Y574 P575 D576 K584 R632 M633	F555-H636 HydrophobicContact CD2-CB 4.06Å; F555-H636 AromaticContact CD2-CD2 3.91Å; F555-H636 HydrophobicContact CE2-CB 4.26Å; F555-H636 AromaticContact CE2-CD2 3.21Å; F555-H636 WeakPolarHBondContact CE2-CD2 3.42Å; F555-H636 AromaticContact CE2-CG 3.83Å; F555-H636 AromaticContact CE2-NE2 3.88Å; F555-H636 AromaticContact CZ-CD2 3.7Å; I573-H636 PolarHBondContact O-NE2 3.45Å; Y574-H636 PolarHBondContact O-NE2 3.37Å; P575-H636 WeakPolarHBondContact CD-NE2 3.34Å; D576-H636 IonicContact OD1-CE1 3.58Å; D576-H636 IonicContact OD2-CE1 3.65Å; K584-H636 PolarHBondContact NZ-ND1 2.93Å; R632-H636 PolarHBondContact O-CD2 3.13Å; R632-H636 PolarHBondContact O-N 3.4Å; M633-H636 PolarHBondContact O-N 3.18Å
637	R	93.6	Very high	94.6	Very high	159 Å²	159	21.8 Å²	21.8	60%	0.6	9%	0.09	S	C	*	.			trans	45.4	55.8	-179.2	-59.9	-169.9	172.1	101.8	-4.4	113.3	M633 F634	M633-R637 PolarHBondContact O-N 2.86Å; F634-R637 WeakPolarHBondContact O-CG 3.14Å
638	P	94.5	Very high	94.3	Very high	8 Å²	8	23.1 Å²	23.1	5%	0.052	10%	0.104	C	C	.	.			trans	-67.4	159.2	179.6	34.5	-40.4	0	0	0	111.4	F555 M633 A641 I667	F555-P638 HydrophobicContact CB-CB 3.73Å; F555-P638 HydrophobicContact CB-CG 3.55Å; M633-P638 HydrophobicContact CG-CG 4.06Å; M633-P638 WeakPolarHBondContact O-CD 3.4Å; P638-A641 HydrophobicContact CG-CB 4.46Å; P638-I667 HydrophobicContact CG-CG2 4.2Å
639	R	93.1	Very high	93.8	Very high	120 Å²	120	25.8 Å²	25.8	45%	0.453	13%	0.127	S	C	.	.	S	Bend	trans	-72	-38.4	168	-69.9	-173.6	172.7	-170.1	-3.7	111.7	N487 N553 A668	N487-R639 PolarHBondContact OD1-NH1 2.64Å; N553-R639 HydrophobicContact CB-CB 4.4Å; N553-R639 HydrophobicContact CB-CG 4.48Å; N553-R639 PolarHBondContact O-N 3.45Å; R639-A668 WeakPolarHBondContact O-CB 3.46Å; R639-A668 PolarHBondContact O-N 2.94Å
640	Y	94.7	Very high	93.6	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.3	-179.2	-67.1	-89	0	0	0	110.9	G488 I489 V512 D514 P549 N553 M554 F555 A668 L670	G488-Y640 WeakPolarHBondContact CA-OH 3.24Å; G488-Y640 PolarHBondContact N-OH 3.4Å; I489-Y640 HydrophobicContact CD1-CD1 3.99Å; I489-Y640 HydrophobicContact CD1-CE1 4.38Å; I489-Y640 HydrophobicContact CD1-CG 4.29Å; I489-Y640 HydrophobicContact CG1-CE1 4.49Å; V512-Y640 HydrophobicContact CG1-CE1 4.37Å; D514-Y640 PolarHBondContact N-OH 3.15Å; D514-Y640 PolarHBondContact OD1-OH 3.01Å; P549-Y640 HydrophobicContact CG-CD2 3.85Å; P549-Y640 HydrophobicContact CG-CE2 3.75Å; N553-Y640 PolarHBondContact O-N 3.33Å; M554-Y640 CarbonylContact C-O 3.55Å; M554-Y640 VanDerWaalsContact CA-O 3.31Å; M554-Y640 WeakPolarHBondContact CA-O 3.45Å; F555-Y640 PolarHBondContact N-O 2.88Å; Y640-A668 WeakPolarHBondContact CA-O 3.46Å; Y640-A668 HydrophobicContact CD1-CB 3.75Å; Y640-A668 HydrophobicContact CE1-CB 3.92Å; Y640-A668 HydrophobicContact CG-CB 4.46Å; Y640-L670 HydrophobicContact CD1-CD1 3.91Å
641	A	95.6	Very high	93.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.3	172.6	0	0	0	0	0	110.7	F555 M633 P638 L643 I667 A668 L669 L670	F555-A641 WeakPolarHBondContact O-CA 3.06Å; M633-A641 HydrophobicContact CG-CB 4.07Å; M633-A641 HydrophobicContact SD-CB 3.51Å; M633-A641 VanDerWaalsContact SD-CB 3.51Å; P638-A641 HydrophobicContact CG-CB 4.46Å; A641-L643 HydrophobicContact CB-CD2 4.17Å; A641-L643 HydrophobicContact CB-CG 4.42Å; A641-I667 HydrophobicContact CB-CG2 3.63Å; A641-A668 PolarHBondContact N-O 3.48Å; A641-L669 HydrophobicContact CB-CD2 4.09Å; A641-L670 PolarHBondContact O-N 3.5Å
642	L	96.1	Very high	93	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	111.1	176.9	-66.9	86.7	0	0	0	108.3	F532 L535 M554 F555 Y556 I557 L670	F532-L642 HydrophobicContact CD1-CD2 3.8Å; F532-L642 HydrophobicContact CD2-CB 4.36Å; F532-L642 HydrophobicContact CE1-CB 4.44Å; F532-L642 HydrophobicContact CE1-CD2 4.13Å; F532-L642 HydrophobicContact CE1-CG 4.46Å; F532-L642 HydrophobicContact CE2-CB 4.27Å; F532-L642 HydrophobicContact CG-CB 4.47Å; F532-L642 HydrophobicContact CG-CD2 4.16Å; F532-L642 HydrophobicContact CZ-CB 4.3Å; L535-L642 HydrophobicContact CB-CD2 3.78Å; L535-L642 HydrophobicContact CD1-CD2 3.88Å; L535-L642 HydrophobicContact CG-CD2 4.49Å; M554-L642 HydrophobicContact CB-CD1 4.35Å; M554-L642 HydrophobicContact CE-CD1 3.61Å; M554-L642 HydrophobicContact CE-CD2 4.32Å; F555-L642 PolarHBondContact O-N 3.42Å; Y556-L642 HydrophobicContact CD2-CB 3.76Å; I557-L642 PolarHBondContact N-O 2.93Å; L642-L670 WeakPolarHBondContact CA-O 3.45Å
643	L	95.8	Very high	92.6	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	99.4	-167.9	-57	-177.4	0	0	0	110.3	I557 M630 M633 A641 E645 F659 L669 L670 S671 I672	I557-L643 HydrophobicContact CB-CD2 4.11Å; I557-L643 HydrophobicContact CD1-CD2 3.42Å; I557-L643 VanDerWaalsContact CD1-CD2 3.42Å; I557-L643 HydrophobicContact CG1-CD2 3.84Å; M630-L643 HydrophobicContact CE-CD1 4.45Å; M630-L643 HydrophobicContact SD-CD2 4.24Å; M633-L643 HydrophobicContact SD-CD2 4.15Å; A641-L643 HydrophobicContact CB-CD2 4.17Å; A641-L643 HydrophobicContact CB-CG 4.42Å; L643-E645 PolarHBondContact O-N 3.01Å; L643-F659 HydrophobicContact CD1-CE1 3.84Å; L643-F659 HydrophobicContact CD1-CZ 3.69Å; L643-L669 HydrophobicContact CD1-CD2 4.18Å; L643-L670 PolarHBondContact N-O 3.42Å; L643-S671 CarbonylContact O-C 3.53Å; L643-S671 WeakPolarHBondContact O-CA 3.29Å; L643-I672 PolarHBondContact O-N 3.21Å
644	D	94.9	Very high	92.4	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	93.3	-179	-163.6	9.5	0	0	0	110.6	S529 F532 Y556 I557 Q559 C646 I672	S529-D644 VanDerWaalsContact CB-OD2 3.25Å; S529-D644 WeakPolarHBondContact CB-OD2 3.35Å; S529-D644 PolarHBondContact OG-OD1 3.35Å; S529-D644 PolarHBondContact OG-OD2 3.39Å; F532-D644 HydrophobicContact CD2-CB 3.96Å; F532-D644 HydrophobicContact CE2-CB 4.26Å; Y556-D644 HydrophobicContact CE2-CB 4.13Å; Y556-D644 PolarHBondContact OH-OD2 3.41Å; I557-D644 PolarHBondContact O-N 3.12Å; Q559-D644 WeakPolarHBondContact CA-O 3.4Å; Q559-D644 PolarHBondContact N-O 3.33Å; Q559-D644 VanDerWaalsContact N-O 3.15Å; D644-C646 PolarHBondContact O-N 3.34Å; D644-I672 WeakPolarHBondContact OD1-CD1 3.12Å
645	E	91.9	Very high	92.2	Very high	40 Å²	40	39.5 Å²	39.5	19%	0.187	21%	0.206	C	C	.	.	S	Bend	trans	48.4	33	178.9	-64.5	-174.5	-177.7	0	0	114.8	Q559 L643 T647 S648 I672 H674	Q559-E645 HydrophobicContact CG-CB 4.13Å; Q559-E645 PolarHBondContact NE2-OE2 3.29Å; L643-E645 PolarHBondContact O-N 3.01Å; E645-T647 PolarHBondContact O-N 3.01Å; E645-T647 VanDerWaalsContact O-N 3.1Å; E645-S648 PolarHBondContact O-N 3.49Å; E645-S648 PolarHBondContact O-OG 3.08Å; E645-I672 WeakPolarHBondContact CA-O 3.11Å; E645-I672 HydrophobicContact CG-CG2 4.08Å; E645-I672 PolarHBondContact N-O 3.35Å; E645-H674 IonicContact OE1-CD2 2.67Å; E645-H674 IonicContact OE1-NE2 3.06Å
646	C	89.4	Confident	92	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	1.4	-166.7	67.6	0	0	0	0	115	I557 Q626 D644	I557-C646 HydrophobicContact CB-CB 4.23Å; I557-C646 HydrophobicContact CG2-CB 3.62Å; Q626-C646 WeakPolarHBondContact CB-O 3.48Å; Q626-C646 WeakPolarHBondContact CG-O 3.31Å; Q626-C646 PolarHBondContact OE1-O 3.39Å; D644-C646 PolarHBondContact O-N 3.34Å
647	T	90.5	Very high	92	Very high	4 Å²	4	44 Å²	44	3%	0.025	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	13.7	179.5	52.5	0	0	0	0	113.5	Q626 E645 A649 V650 E655 F659	Q626-T647 VanDerWaalsContact OE1-C 3.3Å; E645-T647 PolarHBondContact O-N 3.01Å; E645-T647 VanDerWaalsContact O-N 3.1Å; T647-A649 PolarHBondContact O-N 3.25Å; T647-A649 VanDerWaalsContact O-N 3.15Å; T647-V650 PolarHBondContact O-N 3.31Å; T647-E655 WeakPolarHBondContact CB-OE1 3.46Å; T647-E655 HydrophobicContact CG2-CG 4.29Å; T647-E655 PolarHBondContact OG1-OE1 2.87Å; T647-F659 HydrophobicContact CG2-CE2 3.84Å
648	S	87.5	Confident	92	Very high	63 Å²	63	36.5 Å²	36.5	44%	0.441	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.9	-177.4	54.9	0	0	0	0	114.7	Q626 E645 R675	Q626-S648 PolarHBondContact NE2-OG 3.08Å; E645-S648 PolarHBondContact O-N 3.49Å; E645-S648 PolarHBondContact O-OG 3.08Å; S648-R675 PolarHBondContact O-NH2 3.21Å
649	A	87.1	Confident	92.1	Very high	57 Å²	57	36.2 Å²	36.2	47%	0.471	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	13.3	176.4	0	0	0	0	0	113.2	T647	T647-A649 PolarHBondContact O-N 3.25Å; T647-A649 VanDerWaalsContact O-N 3.15Å
650	V	89.6	Confident	92.1	Very high	6 Å²	6	34 Å²	34	4%	0.036	19%	0.193	C	C	.	.	S	Bend	trans	-105.4	145.7	179.2	-174.7	0	0	0	0	110	Q626 R627 T647 V654 E655 R675	Q626-V650 HydrophobicContact CB-CG2 4.14Å; R627-V650 HydrophobicContact CG-CG1 4.36Å; R627-V650 HydrophobicContact CG-CG2 3.88Å; T647-V650 PolarHBondContact O-N 3.31Å; V650-V654 HydrophobicContact CG1-CB 3.93Å; V650-V654 HydrophobicContact CG1-CG1 3.78Å; V650-E655 HydrophobicContact CG1-CB 4.36Å; V650-R675 PolarHBondContact O-NH1 3.37Å; V650-R675 PolarHBondContact O-NH2 2.98Å
651	S	90.4	Very high	92.2	Very high	66 Å²	66	35.3 Å²	35.3	46%	0.462	20%	0.204	S	C	.	.			trans	-67.7	148.7	174.7	58.7	0	0	0	0	111.2	D653 V654 E655	S651-D653 VanDerWaalsContact C-N 3.28Å; S651-D653 PolarHBondContact O-N 2.88Å; S651-V654 PolarHBondContact O-N 3.36Å; S651-V654 WeakPolarHBondContact OG-CG2 3.34Å; S651-E655 VanDerWaalsContact O-CB 3.26Å; S651-E655 WeakPolarHBondContact O-CB 3.32Å; S651-E655 PolarHBondContact O-N 3.07Å
652	I	89.3	Confident	92.1	Very high	103 Å²	103	35.3 Å²	35.3	53%	0.528	20%	0.204	S	C	.	.	H	α-helix	trans	-59.3	-38.4	-173.9	-63.3	167.7	0	0	0	111.8	G656	I652-G656 PolarHBondContact O-N 2.9Å
653	D	88.4	Confident	92	Very high	127 Å²	127	38.3 Å²	38.3	68%	0.679	22%	0.217	S	C	*	.	H	α-helix	trans	-66.3	-43.8	-178.8	-57.5	-28.8	0	0	0	112.3	S651 K657	S651-D653 VanDerWaalsContact C-N 3.28Å; S651-D653 PolarHBondContact O-N 2.88Å; D653-K657 WeakPolarHBondContact O-CG 3.22Å; D653-K657 PolarHBondContact O-N 3.47Å
654	V	91.3	Very high	91.9	Very high	23 Å²	23	44 Å²	44	14%	0.139	25%	0.247	C	C	.	.	H	α-helix	trans	-71.1	-43.1	178.6	173.5	0	0	0	0	110.2	H599 V650 S651 G656 K657 I658	H599-V654 HydrophobicContact CB-CG1 4.42Å; V650-V654 HydrophobicContact CG1-CB 3.93Å; V650-V654 HydrophobicContact CG1-CG1 3.78Å; S651-V654 PolarHBondContact O-N 3.36Å; S651-V654 WeakPolarHBondContact OG-CG2 3.34Å; V654-G656 VanDerWaalsContact C-N 3.31Å; V654-G656 PolarHBondContact O-N 3.28Å; V654-K657 PolarHBondContact O-N 3.45Å; V654-I658 HydrophobicContact CG1-CD1 3.71Å; V654-I658 HydrophobicContact CG1-CG1 4.35Å; V654-I658 VanDerWaalsContact O-CG1 3.32Å; V654-I658 WeakPolarHBondContact O-CG1 3.27Å; V654-I658 PolarHBondContact O-N 3.34Å
655	E	93.1	Very high	91.8	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-53.4	-48.2	173.7	169.2	177	-118.2	0	0	111.1	T647 V650 S651 K657 I658 F659 R675 S677 L678	T647-E655 WeakPolarHBondContact CB-OE1 3.46Å; T647-E655 HydrophobicContact CG2-CG 4.29Å; T647-E655 PolarHBondContact OG1-OE1 2.87Å; V650-E655 HydrophobicContact CG1-CB 4.36Å; S651-E655 VanDerWaalsContact O-CB 3.26Å; S651-E655 WeakPolarHBondContact O-CB 3.32Å; S651-E655 PolarHBondContact O-N 3.07Å; E655-K657 PolarHBondContact O-N 2.94Å; E655-I658 PolarHBondContact O-N 2.79Å; E655-F659 HydrophobicContact CG-CD2 4.31Å; E655-F659 HydrophobicContact CG-CE2 4.42Å; E655-F659 WeakPolarHBondContact O-CD2 3.48Å; E655-F659 PolarHBondContact O-N 3.22Å; E655-R675 WeakPolarHBondContact OE1-CD 3.33Å; E655-R675 IonicContact OE1-NH1 3.72Å; E655-R675 IonicContact OE2-NH1 2.99Å; E655-R675 PolarHBondContact OE2-NH1 2.76Å; E655-R675 VanDerWaalsContact OE2-NH1 3.12Å; E655-S677 PolarHBondContact OE2-OG 3.44Å; E655-L678 HydrophobicContact CG-CD1 4.31Å; E655-L678 HydrophobicContact CG-CD2 3.57Å; E655-L678 HydrophobicContact CG-CG 4.12Å; E655-L678 WeakPolarHBondContact OE1-CD1 3.48Å
656	G	91.5	Very high	91.9	Very high	12 Å²	12	47.7 Å²	47.7	12%	0.124	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-45.3	178.1	0	0	0	0	0	113.6	I652 V654 I658 F659 Q660 Y681	I652-G656 PolarHBondContact O-N 2.9Å; V654-G656 VanDerWaalsContact C-N 3.31Å; V654-G656 PolarHBondContact O-N 3.28Å; G656-I658 PolarHBondContact O-N 3.31Å; G656-F659 PolarHBondContact O-N 3.22Å; G656-Q660 WeakPolarHBondContact O-CB 3.34Å; G656-Q660 PolarHBondContact O-N 3.4Å; G656-Y681 WeakPolarHBondContact CA-OH 3.34Å; G656-Y681 PolarHBondContact O-OH 3.34Å; G656-Y681 VanDerWaalsContact O-OH 3.09Å
657	K	93.4	Very high	92.1	Very high	124 Å²	124	47.9 Å²	47.9	54%	0.539	29%	0.292	S	S	.	.	H	α-helix	trans	-62	-42.7	178.5	-71.3	175.8	-175.7	179.9	0	112.2	D653 V654 E655 Q660 A661	D653-K657 WeakPolarHBondContact O-CG 3.22Å; D653-K657 PolarHBondContact O-N 3.47Å; V654-K657 PolarHBondContact O-N 3.45Å; E655-K657 PolarHBondContact O-N 2.94Å; K657-Q660 PolarHBondContact O-N 3.47Å; K657-A661 WeakPolarHBondContact O-CB 3.33Å; K657-A661 PolarHBondContact O-N 3.07Å
658	I	94.9	Very high	92.3	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-45.7	179.6	-69.2	171.6	0	0	0	110.8	V598 R627 M630 F634 V654 E655 G656 Q660 A661 A662	V598-I658 HydrophobicContact CB-CD1 4.36Å; V598-I658 HydrophobicContact CG1-CD1 4.48Å; R627-I658 HydrophobicContact CG-CD1 4.21Å; M630-I658 HydrophobicContact CB-CG2 4.17Å; M630-I658 HydrophobicContact CE-CG2 3.33Å; M630-I658 HydrophobicContact CG-CG2 4.09Å; F634-I658 HydrophobicContact CE2-CG2 4.08Å; F634-I658 HydrophobicContact CZ-CG2 4.37Å; V654-I658 HydrophobicContact CG1-CD1 3.71Å; V654-I658 HydrophobicContact CG1-CG1 4.35Å; V654-I658 VanDerWaalsContact O-CG1 3.32Å; V654-I658 WeakPolarHBondContact O-CG1 3.27Å; V654-I658 PolarHBondContact O-N 3.34Å; E655-I658 PolarHBondContact O-N 2.79Å; G656-I658 PolarHBondContact O-N 3.31Å; I658-Q660 VanDerWaalsContact C-N 3.35Å; I658-Q660 PolarHBondContact O-N 3.46Å; I658-A661 PolarHBondContact O-N 3.15Å; I658-A662 WeakPolarHBondContact O-CB 3.45Å; I658-A662 PolarHBondContact O-N 3.48Å
659	F	95.1	Very high	92.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-38.7	178.3	-91.2	-104.9	0	0	0	112.2	L643 T647 E655 G656 A662 K663 L669 L678 Y681 H682	L643-F659 HydrophobicContact CD1-CE1 3.84Å; L643-F659 HydrophobicContact CD1-CZ 3.69Å; T647-F659 HydrophobicContact CG2-CE2 3.84Å; E655-F659 HydrophobicContact CG-CD2 4.31Å; E655-F659 HydrophobicContact CG-CE2 4.42Å; E655-F659 WeakPolarHBondContact O-CD2 3.48Å; E655-F659 PolarHBondContact O-N 3.22Å; G656-F659 PolarHBondContact O-N 3.22Å; F659-A662 PolarHBondContact O-N 3.32Å; F659-K663 WeakPolarHBondContact O-CG 2.98Å; F659-K663 PolarHBondContact O-N 3.41Å; F659-K663 VanDerWaalsContact O-N 3.1Å; F659-L669 HydrophobicContact CD1-CD1 3.6Å; F659-L669 HydrophobicContact CE1-CD1 4.08Å; F659-L669 HydrophobicContact CG-CD1 4.45Å; F659-L678 HydrophobicContact CB-CD2 4.33Å; F659-L678 HydrophobicContact CD1-CD2 3.9Å; F659-L678 HydrophobicContact CD2-CD2 3.59Å; F659-L678 HydrophobicContact CE1-CD1 4.35Å; F659-L678 HydrophobicContact CE1-CD2 4.05Å; F659-L678 HydrophobicContact CE2-CD1 4.04Å; F659-L678 HydrophobicContact CE2-CD2 3.73Å; F659-L678 HydrophobicContact CG-CD2 3.66Å; F659-L678 HydrophobicContact CZ-CD1 3.84Å; F659-L678 HydrophobicContact CZ-CD2 3.96Å; F659-Y681 HydrophobicContact CB-CD1 4.23Å; F659-Y681 HydrophobicContact CB-CD2 3.76Å; F659-Y681 HydrophobicContact CB-CE1 4.48Å; F659-Y681 HydrophobicContact CB-CE2 4.04Å; F659-Y681 HydrophobicContact CB-CG 3.87Å; F659-Y681 HydrophobicContact CD1-CD2 4.42Å; F659-Y681 HydrophobicContact CG-CD2 4.29Å; F659-H682 AromaticContact CE1-CE1 3.89Å
660	Q	94.5	Very high	93.1	Very high	75 Å²	75	42.3 Å²	42.3	35%	0.35	25%	0.25	S	S	.	.	H	α-helix	trans	-63.5	-48.1	174.5	-171.5	58.8	50	0	0	111.1	G656 K657 I658 A662 K663 D664 Y681	G656-Q660 WeakPolarHBondContact O-CB 3.34Å; G656-Q660 PolarHBondContact O-N 3.4Å; K657-Q660 PolarHBondContact O-N 3.47Å; I658-Q660 VanDerWaalsContact C-N 3.35Å; I658-Q660 PolarHBondContact O-N 3.46Å; Q660-A662 VanDerWaalsContact C-N 3.27Å; Q660-A662 PolarHBondContact O-N 3.38Å; Q660-K663 WeakPolarHBondContact O-CB 3.36Å; Q660-K663 PolarHBondContact O-N 3.41Å; Q660-K663 VanDerWaalsContact O-N 3.08Å; Q660-D664 PolarHBondContact NE2-OD1 2.88Å; Q660-D664 PolarHBondContact O-N 3.38Å; Q660-Y681 HydrophobicContact CB-CE1 4.01Å
661	A	95.5	Very high	93.4	Very high	27 Å²	27	42.1 Å²	42.1	22%	0.223	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-36.9	176.8	0	0	0	0	0	112.8	T597 F634 K657 I658 D664 A665	T597-A661 HydrophobicContact CG2-CB 3.71Å; F634-A661 HydrophobicContact CE1-CB 4.25Å; F634-A661 HydrophobicContact CZ-CB 3.97Å; K657-A661 WeakPolarHBondContact O-CB 3.33Å; K657-A661 PolarHBondContact O-N 3.07Å; I658-A661 PolarHBondContact O-N 3.15Å; A661-D664 PolarHBondContact O-N 2.83Å; A661-A665 WeakPolarHBondContact O-CB 2.98Å; A661-A665 PolarHBondContact O-N 3.26Å
662	A	95.2	Very high	93.6	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.7	-39.6	175.8	0	0	0	0	0	112.4	M633 F634 I658 F659 Q660 A665 G666 I667 L669	M633-A662 HydrophobicContact CE-CB 3.76Å; F634-A662 HydrophobicContact CE1-CB 4.14Å; F634-A662 HydrophobicContact CZ-CB 4.09Å; I658-A662 WeakPolarHBondContact O-CB 3.45Å; I658-A662 PolarHBondContact O-N 3.48Å; F659-A662 PolarHBondContact O-N 3.32Å; Q660-A662 VanDerWaalsContact C-N 3.27Å; Q660-A662 PolarHBondContact O-N 3.38Å; A662-A665 PolarHBondContact O-N 2.86Å; A662-G666 PolarHBondContact O-N 3.08Å; A662-I667 WeakPolarHBondContact O-CB 3.4Å; A662-I667 PolarHBondContact O-N 2.97Å; A662-I667 VanDerWaalsContact O-N 3.11Å; A662-L669 HydrophobicContact CB-CD1 4.32Å; A662-L669 HydrophobicContact CB-CD2 4.01Å
663	K	93.4	Very high	93.7	Very high	66 Å²	66	34.5 Å²	34.5	29%	0.287	20%	0.204	S	C	.	.	H	α-helix	trans	-66.6	-42.6	173.6	-72.2	-178.9	67.1	168.5	0	112.1	F659 Q660 A665 G666 L669 Y681	F659-K663 WeakPolarHBondContact O-CG 2.98Å; F659-K663 PolarHBondContact O-N 3.41Å; F659-K663 VanDerWaalsContact O-N 3.1Å; Q660-K663 WeakPolarHBondContact O-CB 3.36Å; Q660-K663 PolarHBondContact O-N 3.41Å; Q660-K663 VanDerWaalsContact O-N 3.08Å; K663-A665 PolarHBondContact O-N 3.18Å; K663-G666 WeakPolarHBondContact O-CA 3.35Å; K663-G666 PolarHBondContact O-N 3.38Å; K663-L669 HydrophobicContact CG-CD1 3.99Å; K663-Y681 HydrophobicContact CD-CD1 4.11Å; K663-Y681 WeakPolarHBondContact CD-O 3.29Å; K663-Y681 PolarHBondContact NZ-O 3.21Å
664	D	93.9	Very high	93.6	Very high	120 Å²	120	32.9 Å²	32.9	64%	0.642	19%	0.192	S	C	*	.	H	α-helix	trans	-64.2	-31.2	178.5	-62.2	-19.9	0	0	0	111.1	Q660 A661 G666	Q660-D664 PolarHBondContact NE2-OD1 2.88Å; Q660-D664 PolarHBondContact O-N 3.38Å; A661-D664 PolarHBondContact O-N 2.83Å; D664-G666 PolarHBondContact O-N 3.36Å
665	A	92.9	Very high	93.3	Very high	60 Å²	60	35 Å²	35	50%	0.496	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	0.3	171.2	0	0	0	0	0	114.2	A661 A662 K663 I667	A661-A665 WeakPolarHBondContact O-CB 2.98Å; A661-A665 PolarHBondContact O-N 3.26Å; A662-A665 PolarHBondContact O-N 2.86Å; K663-A665 PolarHBondContact O-N 3.18Å; A665-I667 HydrophobicContact CB-CD1 4.24Å; A665-I667 HydrophobicContact CB-CG1 4.19Å
666	G	92.6	Very high	93	Very high	63 Å²	63	36.9 Å²	36.9	65%	0.649	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	18	178	0	0	0	0	0	114.9	A662 K663 D664	A662-G666 PolarHBondContact O-N 3.08Å; K663-G666 WeakPolarHBondContact O-CA 3.35Å; K663-G666 PolarHBondContact O-N 3.38Å; D664-G666 PolarHBondContact O-N 3.36Å
667	I	94.7	Very high	92.8	Very high	6 Å²	6	37.9 Å²	37.9	3%	0.031	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-84.5	124.1	-179.3	-53.5	175.3	0	0	0	109.3	M633 P638 A641 A662 A665 L669	M633-I667 HydrophobicContact CE-CD1 4.16Å; M633-I667 HydrophobicContact CG-CD1 4.4Å; P638-I667 HydrophobicContact CG-CG2 4.2Å; A641-I667 HydrophobicContact CB-CG2 3.63Å; A662-I667 WeakPolarHBondContact O-CB 3.4Å; A662-I667 PolarHBondContact O-N 2.97Å; A662-I667 VanDerWaalsContact O-N 3.11Å; A665-I667 HydrophobicContact CB-CD1 4.24Å; A665-I667 HydrophobicContact CB-CG1 4.19Å; I667-L669 HydrophobicContact CB-CD2 4.38Å; I667-L669 HydrophobicContact CG2-CD2 3.99Å; I667-L669 PolarHBondContact O-N 3.05Å
668	A	94.8	Very high	92.6	Very high	3 Å²	3	32 Å²	32	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.8	173.5	0	0	0	0	0	110.5	R639 Y640 A641	R639-A668 WeakPolarHBondContact O-CB 3.46Å; R639-A668 PolarHBondContact O-N 2.94Å; Y640-A668 WeakPolarHBondContact CA-O 3.46Å; Y640-A668 HydrophobicContact CD1-CB 3.75Å; Y640-A668 HydrophobicContact CE1-CB 3.92Å; Y640-A668 HydrophobicContact CG-CB 4.46Å; A641-A668 PolarHBondContact N-O 3.48Å
669	L	95.3	Very high	92.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.3	-172.6	-52.8	-179.8	0	0	0	111	N517 V518 A641 L643 F659 A662 K663 I667	N517-L669 CarbonylContact C-O 3.56Å; N517-L669 WeakPolarHBondContact CA-O 3.47Å; N517-L669 PolarHBondContact OD1-N 3.19Å; V518-L669 PolarHBondContact N-O 2.97Å; A641-L669 HydrophobicContact CB-CD2 4.09Å; L643-L669 HydrophobicContact CD1-CD2 4.18Å; F659-L669 HydrophobicContact CD1-CD1 3.6Å; F659-L669 HydrophobicContact CE1-CD1 4.08Å; F659-L669 HydrophobicContact CG-CD1 4.45Å; A662-L669 HydrophobicContact CB-CD1 4.32Å; A662-L669 HydrophobicContact CB-CD2 4.01Å; K663-L669 HydrophobicContact CG-CD1 3.99Å; I667-L669 HydrophobicContact CB-CD2 4.38Å; I667-L669 HydrophobicContact CG2-CD2 3.99Å; I667-L669 PolarHBondContact O-N 3.05Å
670	L	96.1	Very high	92.1	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	103.2	165.4	-74.2	74.1	0	0	0	107	I489 V512 V518 F532 L535 Y640 A641 L642 L643	I489-L670 HydrophobicContact CD1-CD2 3.94Å; V512-L670 HydrophobicContact CG1-CD1 4.35Å; V518-L670 HydrophobicContact CB-CG 4.31Å; V518-L670 WeakPolarHBondContact O-CA 3.47Å; F532-L670 HydrophobicContact CE1-CB 4.26Å; F532-L670 HydrophobicContact CZ-CB 4.21Å; F532-L670 VanDerWaalsContact CZ-O 3.29Å; F532-L670 WeakPolarHBondContact CZ-O 3.3Å; L535-L670 HydrophobicContact CD1-CD2 4.39Å; Y640-L670 HydrophobicContact CD1-CD1 3.91Å; A641-L670 PolarHBondContact O-N 3.5Å; L642-L670 WeakPolarHBondContact CA-O 3.45Å; L643-L670 PolarHBondContact N-O 3.42Å
671	S	95.6	Very high	91.9	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.2	-173.7	79.1	0	0	0	0	113.3	V518 I520 L643 H682	V518-S671 PolarHBondContact O-N 3.46Å; I520-S671 PolarHBondContact N-O 2.95Å; L643-S671 CarbonylContact O-C 3.53Å; L643-S671 WeakPolarHBondContact O-CA 3.29Å; S671-H682 PolarHBondContact OG-CE1 3.14Å; S671-H682 PolarHBondContact OG-NE2 3.41Å
672	I	95.4	Very high	91.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.4	166.1	-62.5	164.9	0	0	0	106.8	I520 K528 F532 L643 D644 E645	I520-I672 HydrophobicContact CB-CG1 3.87Å; I520-I672 HydrophobicContact CD1-CG1 4.24Å; I520-I672 HydrophobicContact CG2-CG1 4.08Å; K528-I672 HydrophobicContact CB-CD1 3.7Å; K528-I672 HydrophobicContact CB-CG1 4.09Å; K528-I672 HydrophobicContact CB-CG2 4.12Å; K528-I672 HydrophobicContact CD-CG2 3.93Å; F532-I672 HydrophobicContact CD1-CD1 4.38Å; F532-I672 HydrophobicContact CD2-CD1 3.36Å; F532-I672 HydrophobicContact CD2-CG1 4.15Å; F532-I672 HydrophobicContact CE1-CD1 4.32Å; F532-I672 HydrophobicContact CE1-CG1 4.44Å; F532-I672 HydrophobicContact CE2-CB 4.36Å; F532-I672 HydrophobicContact CE2-CD1 3.28Å; F532-I672 HydrophobicContact CE2-CG1 3.52Å; F532-I672 HydrophobicContact CG-CD1 3.97Å; F532-I672 HydrophobicContact CZ-CD1 3.81Å; F532-I672 HydrophobicContact CZ-CG1 3.71Å; L643-I672 PolarHBondContact O-N 3.21Å; D644-I672 WeakPolarHBondContact OD1-CD1 3.12Å; E645-I672 WeakPolarHBondContact CA-O 3.11Å; E645-I672 HydrophobicContact CG-CG2 4.08Å; E645-I672 PolarHBondContact N-O 3.35Å
673	T	90.4	Very high	91.8	Very high	8 Å²	8	37.9 Å²	37.9	5%	0.049	21%	0.213	C	C	.	.			trans	-155.2	152.2	176.9	-176.6	0	0	0	0	111.7	L519 I520 R675 L678	L519-T673 HydrophobicContact CD1-CG2 3.31Å; I520-T673 PolarHBondContact O-N 2.89Å; T673-R675 PolarHBondContact OG1-N 2.83Å; T673-R675 VanDerWaalsContact OG1-N 3.07Å; T673-L678 HydrophobicContact CG2-CB 4.09Å; T673-L678 HydrophobicContact CG2-CD1 3.71Å
674	H	85.9	Confident	91.8	Very high	92 Å²	92	36.4 Å²	36.4	43%	0.426	21%	0.208	S	C	.	.			trans	-103.3	-0.5	173	-69.7	-81.4	0	0	0	112.5	G522 E645 P676	G522-H674 PolarHBondContact O-CE1 3.32Å; E645-H674 IonicContact OE1-CD2 2.67Å; E645-H674 IonicContact OE1-NE2 3.06Å; H674-P676 WeakPolarHBondContact O-CD 3.44Å
675	R	86.4	Confident	91.8	Very high	67 Å²	67	30.8 Å²	30.8	25%	0.253	18%	0.177	S	C	.	.			trans	-86.8	120.9	-174.2	-67.8	-176.2	167.2	-154	2.5	111.7	S648 V650 E655 T673 S677 L678	S648-R675 PolarHBondContact O-NH2 3.21Å; V650-R675 PolarHBondContact O-NH1 3.37Å; V650-R675 PolarHBondContact O-NH2 2.98Å; E655-R675 WeakPolarHBondContact OE1-CD 3.33Å; E655-R675 IonicContact OE1-NH1 3.72Å; E655-R675 IonicContact OE2-NH1 2.99Å; E655-R675 PolarHBondContact OE2-NH1 2.76Å; E655-R675 VanDerWaalsContact OE2-NH1 3.12Å; T673-R675 PolarHBondContact OG1-N 2.83Å; T673-R675 VanDerWaalsContact OG1-N 3.07Å; R675-S677 PolarHBondContact O-N 2.89Å; R675-L678 PolarHBondContact O-N 3.44Å
676	P	85.8	Confident	91.9	Very high	42 Å²	42	28 Å²	28	27%	0.273	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-62.9	-28.4	177.7	-24	34.8	0	0	0	114.2	H674 L678 W679 L705	H674-P676 WeakPolarHBondContact O-CD 3.44Å; P676-L678 PolarHBondContact O-N 3.42Å; P676-W679 HydrophobicContact CB-CD2 4.24Å; P676-W679 HydrophobicContact CB-CE3 4.36Å; P676-W679 HydrophobicContact CB-CH2 4.35Å; P676-W679 HydrophobicContact CB-CZ2 4.2Å; P676-W679 HydrophobicContact CB-CZ3 4.39Å; P676-W679 HydrophobicContact CG-CZ2 4.33Å; P676-W679 WeakPolarHBondContact O-CB 3.38Å; P676-W679 VanDerWaalsContact O-CG 3.32Å; P676-W679 PolarHBondContact O-N 3.28Å; P676-L705 HydrophobicContact CB-CD2 4.41Å
677	S	86.4	Confident	92	Very high	33 Å²	33	28.4 Å²	28.4	23%	0.231	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-54.5	-25.7	178.1	51.8	0	0	0	0	113.7	E655 R675	E655-S677 PolarHBondContact OE2-OG 3.44Å; R675-S677 PolarHBondContact O-N 2.89Å
678	L	89.6	Confident	91.9	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-89.7	-10.8	-176.8	-71.5	179.6	0	0	0	114.2	E655 F659 T673 R675 P676 K680 Y681 H682	E655-L678 HydrophobicContact CG-CD1 4.31Å; E655-L678 HydrophobicContact CG-CD2 3.57Å; E655-L678 HydrophobicContact CG-CG 4.12Å; E655-L678 WeakPolarHBondContact OE1-CD1 3.48Å; F659-L678 HydrophobicContact CB-CD2 4.33Å; F659-L678 HydrophobicContact CD1-CD2 3.9Å; F659-L678 HydrophobicContact CD2-CD2 3.59Å; F659-L678 HydrophobicContact CE1-CD1 4.35Å; F659-L678 HydrophobicContact CE1-CD2 4.05Å; F659-L678 HydrophobicContact CE2-CD1 4.04Å; F659-L678 HydrophobicContact CE2-CD2 3.73Å; F659-L678 HydrophobicContact CG-CD2 3.66Å; F659-L678 HydrophobicContact CZ-CD1 3.84Å; F659-L678 HydrophobicContact CZ-CD2 3.96Å; T673-L678 HydrophobicContact CG2-CB 4.09Å; T673-L678 HydrophobicContact CG2-CD1 3.71Å; R675-L678 PolarHBondContact O-N 3.44Å; P676-L678 PolarHBondContact O-N 3.42Å; L678-K680 VanDerWaalsContact C-N 3.29Å; L678-K680 PolarHBondContact O-N 3.44Å; L678-Y681 HydrophobicContact CD2-CD2 3.79Å; L678-Y681 HydrophobicContact CD2-CE2 4.06Å; L678-Y681 PolarHBondContact O-N 3.01Å; L678-Y681 VanDerWaalsContact O-N 3.1Å; L678-H682 PolarHBondContact O-CE1 3.04Å; L678-H682 PolarHBondContact O-ND1 2.9Å
679	W	89.7	Confident	91.6	Very high	30 Å²	30	32.1 Å²	32.1	11%	0.114	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-59.6	-39.3	-175	-66.1	-3.4	0	0	0	112.7	L519 P676 Y681 H682 L699 A701 R704 L705	L519-W679 HydrophobicContact CD2-CG 4.06Å; P676-W679 HydrophobicContact CB-CD2 4.24Å; P676-W679 HydrophobicContact CB-CE3 4.36Å; P676-W679 HydrophobicContact CB-CH2 4.35Å; P676-W679 HydrophobicContact CB-CZ2 4.2Å; P676-W679 HydrophobicContact CB-CZ3 4.39Å; P676-W679 HydrophobicContact CG-CZ2 4.33Å; P676-W679 WeakPolarHBondContact O-CB 3.38Å; P676-W679 VanDerWaalsContact O-CG 3.32Å; P676-W679 PolarHBondContact O-N 3.28Å; W679-Y681 PolarHBondContact O-N 3.41Å; W679-Y681 VanDerWaalsContact O-N 3.11Å; W679-H682 PolarHBondContact O-N 2.92Å; W679-L699 HydrophobicContact CB-CD2 4.3Å; W679-A701 HydrophobicContact CB-CB 4.26Å; W679-R704 HydrophobicContact CE3-CB 3.98Å; W679-R704 HydrophobicContact CE3-CG 3.94Å; W679-R704 HydrophobicContact CH2-CG 3.94Å; W679-R704 HydrophobicContact CZ3-CB 3.87Å; W679-R704 HydrophobicContact CZ3-CG 3.46Å; W679-R704 VanDerWaalsContact CZ3-CG 3.46Å; W679-L705 HydrophobicContact CE3-CD2 4.31Å; W679-L705 HydrophobicContact CE3-CG 4.08Å
680	K	89.7	Confident	91	Very high	128 Å²	128	34 Å²	34	56%	0.557	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-61.5	-18.6	178.5	64.4	-179.4	179.4	171.7	0	114.9	L678	L678-K680 VanDerWaalsContact C-N 3.29Å; L678-K680 PolarHBondContact O-N 3.44Å
681	Y	91.3	Very high	90.4	Very high	17 Å²	17	41.2 Å²	41.2	7%	0.067	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-86.7	-14	177.7	-58.6	-65.6	0	0	0	112.5	G656 F659 Q660 K663 L678 W679	G656-Y681 WeakPolarHBondContact CA-OH 3.34Å; G656-Y681 PolarHBondContact O-OH 3.34Å; G656-Y681 VanDerWaalsContact O-OH 3.09Å; F659-Y681 HydrophobicContact CB-CD1 4.23Å; F659-Y681 HydrophobicContact CB-CD2 3.76Å; F659-Y681 HydrophobicContact CB-CE1 4.48Å; F659-Y681 HydrophobicContact CB-CE2 4.04Å; F659-Y681 HydrophobicContact CB-CG 3.87Å; F659-Y681 HydrophobicContact CD1-CD2 4.42Å; F659-Y681 HydrophobicContact CG-CD2 4.29Å; Q660-Y681 HydrophobicContact CB-CE1 4.01Å; K663-Y681 HydrophobicContact CD-CD1 4.11Å; K663-Y681 WeakPolarHBondContact CD-O 3.29Å; K663-Y681 PolarHBondContact NZ-O 3.21Å; L678-Y681 HydrophobicContact CD2-CD2 3.79Å; L678-Y681 HydrophobicContact CD2-CE2 4.06Å; L678-Y681 PolarHBondContact O-N 3.01Å; L678-Y681 VanDerWaalsContact O-N 3.1Å; W679-Y681 PolarHBondContact O-N 3.41Å; W679-Y681 VanDerWaalsContact O-N 3.11Å
682	H	93.9	Very high	89.7	Confident	10 Å²	10	41.5 Å²	41.5	5%	0.046	22%	0.215	C	C	.	.			trans	-105.9	149.5	-175.5	-59.7	85.1	0	0	0	111.9	V518 L519 F659 S671 L678 W679 L699	V518-H682 VanDerWaalsContact C-CD2 3.42Å; V518-H682 PolarHBondContact O-CD2 3.01Å; L519-H682 HydrophobicContact CB-CB 3.77Å; F659-H682 AromaticContact CE1-CE1 3.89Å; S671-H682 PolarHBondContact OG-CE1 3.14Å; S671-H682 PolarHBondContact OG-NE2 3.41Å; L678-H682 PolarHBondContact O-CE1 3.04Å; L678-H682 PolarHBondContact O-ND1 2.9Å; W679-H682 PolarHBondContact O-N 2.92Å; H682-L699 HydrophobicContact CB-CD2 4.03Å
683	S	93.3	Very high	89.3	Confident	42 Å²	42	42.6 Å²	42.6	29%	0.294	23%	0.227	S	C	.	.	S	Bend	trans	-103.8	-27.5	-178.7	59.3	0	0	0	0	113.1	N517 L699	N517-S683 PolarHBondContact N-OG 3.25Å; N517-S683 VanDerWaalsContact N-OG 3.08Å; N517-S683 PolarHBondContact O-N 3.39Å; N517-S683 PolarHBondContact O-OG 3.26Å; S683-L699 PolarHBondContact O-N 3.31Å
684	H	94.7	Very high	89.4	Confident	36 Å²	36	45.5 Å²	45.5	17%	0.167	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.2	-175.5	-68.1	79	0	0	0	110	N517 V518 L519 F696 E697	N517-H684 PolarHBondContact O-N 2.59Å; N517-H684 VanDerWaalsContact O-N 3.08Å; V518-H684 HydrophobicContact CG2-CB 4.35Å; L519-H684 PolarHBondContact N-O 3.26Å; H684-F696 HydrophobicContact CB-CE2 4.03Å; H684-F696 HydrophobicContact CB-CZ 4.08Å; H684-E697 CarbonylContact C-O 3.57Å; H684-E697 WeakPolarHBondContact CA-O 3.43Å
685	L	94.1	Very high	89.8	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.7	179.4	179.7	66.8	0	0	0	110.1	L519 T521 Q687 F696 E697 L699	L519-L685 HydrophobicContact CB-CD1 4.13Å; L519-L685 HydrophobicContact CD2-CD1 3.89Å; L519-L685 HydrophobicContact CG-CD1 3.97Å; L519-L685 CarbonylContact O-C 3.53Å; L519-L685 WeakPolarHBondContact O-CA 3.38Å; T521-L685 HydrophobicContact CG2-CD1 3.71Å; L685-Q687 HydrophobicContact CD2-CB 4.4Å; L685-Q687 HydrophobicContact CG-CB 4.32Å; L685-F696 WeakPolarHBondContact O-CA 3.03Å; L685-E697 HydrophobicContact CB-CG 4.4Å; L685-E697 PolarHBondContact N-O 3.24Å; L685-E697 PolarHBondContact O-N 2.9Å; L685-L699 HydrophobicContact CB-CB 4.32Å; L685-L699 HydrophobicContact CB-CD1 4.27Å; L685-L699 HydrophobicContact CD2-CD1 4.43Å
686	L	95.1	Very high	90.1	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	108.2	163.5	179.3	60.6	0	0	0	108.6	L508 I510 V518 L519 I520 T521 L531 F688 W694 K695 F696	L508-L686 HydrophobicContact CD1-CD1 4.45Å; I510-L686 HydrophobicContact CD1-CD2 4.3Å; I510-L686 HydrophobicContact CG2-CD1 4.06Å; V518-L686 HydrophobicContact CG1-CB 4.17Å; L519-L686 PolarHBondContact O-N 2.66Å; I520-L686 WeakPolarHBondContact CA-O 3.15Å; I520-L686 HydrophobicContact CD1-CD2 4.43Å; I520-L686 HydrophobicContact CG1-CB 4.27Å; I520-L686 HydrophobicContact CG1-CD2 4.32Å; I520-L686 HydrophobicContact CG2-CD2 4.44Å; T521-L686 PolarHBondContact N-O 3.42Å; L531-L686 HydrophobicContact CD2-CD2 3.94Å; L686-F688 HydrophobicContact CD2-CE2 3.89Å; L686-F688 HydrophobicContact CD2-CZ 4.04Å; L686-F688 HydrophobicContact CG-CE2 3.98Å; L686-F688 HydrophobicContact CG-CZ 4.37Å; L686-W694 HydrophobicContact CD1-CB 4.44Å; L686-W694 HydrophobicContact CD1-CE3 4.11Å; L686-K695 CarbonylContact C-O 3.59Å; L686-K695 WeakPolarHBondContact CA-O 3.33Å; L686-F696 HydrophobicContact CB-CD2 4.07Å; L686-F696 HydrophobicContact CD1-CB 4.28Å; L686-F696 HydrophobicContact CD1-CD2 4.28Å
687	Q	93.4	Very high	90.5	Very high	71 Å²	71	50 Å²	50	33%	0.332	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.6	-179.6	-179.6	166.2	-6.2	0	0	110.7	T521 L685 W694 K695	T521-Q687 HydrophobicContact CG2-CB 3.88Å; T521-Q687 HydrophobicContact CG2-CG 3.81Å; T521-Q687 WeakPolarHBondContact O-CA 3.47Å; L685-Q687 HydrophobicContact CD2-CB 4.4Å; L685-Q687 HydrophobicContact CG-CB 4.32Å; Q687-W694 CarbonylContact O-C 3.57Å; Q687-W694 VanDerWaalsContact O-CA 3.23Å; Q687-W694 WeakPolarHBondContact O-CA 3.23Å; Q687-K695 PolarHBondContact N-O 3.02Å; Q687-K695 PolarHBondContact O-N 3.25Å
688	F	92.8	Very high	90.7	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138.4	168.2	-67.1	-87.5	0	0	0	110	I496 V505 I520 T521 G522 P523 C526 K528 L531 L686 W694	I496-F688 HydrophobicContact CD1-CE1 4.38Å; V505-F688 HydrophobicContact CG2-CD1 4.19Å; V505-F688 HydrophobicContact CG2-CE1 3.94Å; I520-F688 HydrophobicContact CG2-CD2 4.05Å; I520-F688 HydrophobicContact CG2-CE2 3.67Å; T521-F688 PolarHBondContact O-N 2.8Å; G522-F688 VanDerWaalsContact CA-O 3.27Å; G522-F688 WeakPolarHBondContact CA-O 3.35Å; P523-F688 VanDerWaalsContact CD-O 3.31Å; P523-F688 WeakPolarHBondContact CD-O 3.06Å; C526-F688 HydrophobicContact CB-CB 4.05Å; C526-F688 WeakPolarHBondContact SG-CB 3.47Å; K528-F688 HydrophobicContact CG-CD2 4.01Å; K528-F688 HydrophobicContact CG-CE2 4.36Å; L531-F688 HydrophobicContact CD2-CZ 4.24Å; L686-F688 HydrophobicContact CD2-CE2 3.89Å; L686-F688 HydrophobicContact CD2-CZ 4.04Å; L686-F688 HydrophobicContact CG-CE2 3.98Å; L686-F688 HydrophobicContact CG-CZ 4.37Å; F688-W694 HydrophobicContact CD1-CB 4.17Å; F688-W694 HydrophobicContact CE1-CB 4.33Å
689	D	88.1	Confident	90.7	Very high	85 Å²	85	54.2 Å²	54.2	46%	0.455	28%	0.279	S	S	.	.			trans	-85.8	-17.7	177.7	60.6	15.7	0	0	0	113.7	E691 G692 G693	D689-E691 VanDerWaalsContact C-N 3.29Å; D689-E691 WeakPolarHBondContact OD1-CA 3.41Å; D689-E691 PolarHBondContact OD1-N 3.08Å; D689-G692 PolarHBondContact OD1-N 3.42Å; D689-G693 VanDerWaalsContact CG-CA 3.5Å; D689-G693 VanDerWaalsContact CG-O 3.26Å; D689-G693 PolarHBondContact N-O 3.19Å; D689-G693 VanDerWaalsContact N-O 3.11Å; D689-G693 WeakPolarHBondContact OD1-CA 2.91Å; D689-G693 PolarHBondContact OD1-N 3.48Å; D689-G693 WeakPolarHBondContact OD2-CA 3.22Å; D689-G693 PolarHBondContact OD2-N 3.05Å
690	G	83.7	Confident	90.4	Very high	41 Å²	41	57.1 Å²	57.1	42%	0.423	30%	0.297	S	S	.	.	S	Bend	trans	90.9	-13.7	-176.2	0	0	0	0	0	114.2
691	E	82.9	Confident	89.9	Confident	155 Å²	155	51.8 Å²	51.8	72%	0.724	28%	0.277	S	S	*	.	S	Bend	trans	-109.9	39.4	175.2	-60.8	-175.8	176.5	0	0	109.6	Q468 D689 G693	Q468-E691 VanDerWaalsContact CD-O 3.28Å; Q468-E691 PolarHBondContact NE2-O 2.87Å; Q468-E691 PolarHBondContact OE1-O 3.19Å; D689-E691 VanDerWaalsContact C-N 3.29Å; D689-E691 WeakPolarHBondContact OD1-CA 3.41Å; D689-E691 PolarHBondContact OD1-N 3.08Å; E691-G693 PolarHBondContact O-N 2.93Å; E691-G693 VanDerWaalsContact O-N 3.09Å
692	G	80.3	Confident	89.1	Confident	8 Å²	8	55.2 Å²	55.2	8%	0.082	30%	0.303	C	S	.	.	S	Bend	trans	71.8	-4.8	173	0	0	0	0	0	116.7	V504 D689	V504-G692 WeakPolarHBondContact O-CA 3.11Å; D689-G692 PolarHBondContact OD1-N 3.42Å
693	G	86.9	Confident	88.3	Confident	23 Å²	23	56.2 Å²	56.2	24%	0.237	31%	0.313	C	S	.	.			trans	-87	159.4	170.1	0	0	0	0	0	112.4	D689 E691	D689-G693 VanDerWaalsContact CG-CA 3.5Å; D689-G693 VanDerWaalsContact CG-O 3.26Å; D689-G693 PolarHBondContact N-O 3.19Å; D689-G693 VanDerWaalsContact N-O 3.11Å; D689-G693 WeakPolarHBondContact OD1-CA 2.91Å; D689-G693 PolarHBondContact OD1-N 3.48Å; D689-G693 WeakPolarHBondContact OD2-CA 3.22Å; D689-G693 PolarHBondContact OD2-N 3.05Å; E691-G693 PolarHBondContact O-N 2.93Å; E691-G693 VanDerWaalsContact O-N 3.09Å
694	W	93.6	Very high	87.5	Confident	70 Å²	70	57.3 Å²	57.3	27%	0.265	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	154.6	-178.8	58.8	-89.4	0	0	0	110.2	S507 L508 N509 I510 L686 Q687 F688 F696	S507-W694 PolarHBondContact O-NE1 2.89Å; L508-W694 HydrophobicContact CD1-CB 4.37Å; L508-W694 HydrophobicContact CD1-CD2 3.54Å; L508-W694 HydrophobicContact CD1-CE3 4.03Å; L508-W694 HydrophobicContact CD1-CG 3.65Å; L508-W694 HydrophobicContact CD1-CZ2 4.44Å; N509-W694 HydrophobicContact CB-CH2 3.9Å; N509-W694 HydrophobicContact CB-CZ2 3.9Å; N509-W694 WeakPolarHBondContact O-CH2 3.33Å; N509-W694 VanDerWaalsContact O-CZ3 3.31Å; N509-W694 WeakPolarHBondContact O-CZ3 3.42Å; I510-W694 HydrophobicContact CG2-CE3 4.34Å; I510-W694 HydrophobicContact CG2-CZ3 4.1Å; L686-W694 HydrophobicContact CD1-CB 4.44Å; L686-W694 HydrophobicContact CD1-CE3 4.11Å; Q687-W694 CarbonylContact O-C 3.57Å; Q687-W694 VanDerWaalsContact O-CA 3.23Å; Q687-W694 WeakPolarHBondContact O-CA 3.23Å; F688-W694 HydrophobicContact CD1-CB 4.17Å; F688-W694 HydrophobicContact CE1-CB 4.33Å; W694-F696 HydrophobicContact CE3-CB 4.29Å; W694-F696 HydrophobicContact CZ3-CB 3.97Å
695	K	93.1	Very high	86.7	Confident	148 Å²	148	58.4 Å²	58.4	64%	0.643	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	137	175.3	-66	-177.2	179.3	-179.4	0	109.4	L686 Q687	L686-K695 CarbonylContact C-O 3.59Å; L686-K695 WeakPolarHBondContact CA-O 3.33Å; Q687-K695 PolarHBondContact N-O 3.02Å; Q687-K695 PolarHBondContact O-N 3.25Å
696	F	94.4	Very high	86	Confident	61 Å²	61	61.2 Å²	61.2	27%	0.268	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.9	176.4	-174	-113.2	0	0	0	109.4	I510 V518 H684 L685 L686 W694	I510-F696 HydrophobicContact CG2-CB 4.4Å; I510-F696 HydrophobicContact CG2-CG 4.36Å; V518-F696 HydrophobicContact CG1-CE2 3.99Å; V518-F696 HydrophobicContact CG2-CE2 4.36Å; H684-F696 HydrophobicContact CB-CE2 4.03Å; H684-F696 HydrophobicContact CB-CZ 4.08Å; L685-F696 WeakPolarHBondContact O-CA 3.03Å; L686-F696 HydrophobicContact CB-CD2 4.07Å; L686-F696 HydrophobicContact CD1-CB 4.28Å; L686-F696 HydrophobicContact CD1-CD2 4.28Å; W694-F696 HydrophobicContact CE3-CB 4.29Å; W694-F696 HydrophobicContact CZ3-CB 3.97Å
697	E	93.1	Very high	85.3	Confident	86 Å²	86	66.4 Å²	66.4	40%	0.402	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.1	-174.3	63.8	-173.5	179.4	0	0	112.2	H684 L685	H684-E697 CarbonylContact C-O 3.57Å; H684-E697 WeakPolarHBondContact CA-O 3.43Å; L685-E697 HydrophobicContact CB-CG 4.4Å; L685-E697 PolarHBondContact N-O 3.24Å; L685-E697 PolarHBondContact O-N 2.9Å
698	P	91.7	Very high	84.7	Confident	101 Å²	101	66.3 Å²	66.3	66%	0.656	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	137.2	168.3	-21.4	33.6	0	0	0	111.2
699	L	88.1	Confident	84.1	Confident	21 Å²	21	72.6 Å²	72.6	11%	0.11	39%	0.392	C	S	.	.			trans	-95.4	111.6	-178.3	179.8	66.3	0	0	0	110.6	L519 W679 H682 S683 L685 A701	L519-L699 HydrophobicContact CD2-CD2 4.06Å; W679-L699 HydrophobicContact CB-CD2 4.3Å; H682-L699 HydrophobicContact CB-CD2 4.03Å; S683-L699 PolarHBondContact O-N 3.31Å; L685-L699 HydrophobicContact CB-CB 4.32Å; L685-L699 HydrophobicContact CB-CD1 4.27Å; L685-L699 HydrophobicContact CD2-CD1 4.43Å; L699-A701 PolarHBondContact O-N 2.77Å
700	D	85	Confident	83.9	Confident	92 Å²	92	74.2 Å²	74.2	49%	0.492	40%	0.397	S	S	.	.			trans	-84.5	92.2	161.2	-173.6	-16.8	0	0	0	109.4	S702 A703 R704	D700-S702 VanDerWaalsContact C-N 3.3Å; D700-S702 PolarHBondContact O-N 2.99Å; D700-S702 PolarHBondContact OD1-N 3.21Å; D700-S702 VanDerWaalsContact OD1-N 3.17Å; D700-S702 PolarHBondContact OD1-OG 2.91Å; D700-A703 HydrophobicContact CB-CB 4.08Å; D700-A703 VanDerWaalsContact CG-CB 3.45Å; D700-A703 PolarHBondContact OD1-N 3.22Å; D700-A703 WeakPolarHBondContact OD2-CB 3.4Å; D700-R704 WeakPolarHBondContact O-CB 3.49Å; D700-R704 PolarHBondContact O-N 3.46Å; D700-R704 VanDerWaalsContact O-N 3.08Å
701	A	77.9	Confident	84	Confident	15 Å²	15	78.1 Å²	78.1	12%	0.124	40%	0.402	C	S	.	.	H	α-helix	trans	-62.3	-36.8	-178	0	0	0	0	0	112.5	W679 L699 R704 L705	W679-A701 HydrophobicContact CB-CB 4.26Å; L699-A701 PolarHBondContact O-N 2.77Å; A701-R704 PolarHBondContact O-N 3.25Å; A701-L705 WeakPolarHBondContact O-CB 3.36Å; A701-L705 WeakPolarHBondContact O-CD1 3.35Å; A701-L705 WeakPolarHBondContact O-CG 3.37Å; A701-L705 PolarHBondContact O-N 3.17Å
702	S	74.9	Confident	84	Confident	89 Å²	89	75.8 Å²	75.8	62%	0.622	39%	0.391	S	S	*	.	H	α-helix	trans	-65.6	-49.8	179.6	26.1	0	0	0	0	112.2	D700 R704 L705 S706	D700-S702 VanDerWaalsContact C-N 3.3Å; D700-S702 PolarHBondContact O-N 2.99Å; D700-S702 PolarHBondContact OD1-N 3.21Å; D700-S702 VanDerWaalsContact OD1-N 3.17Å; D700-S702 PolarHBondContact OD1-OG 2.91Å; S702-R704 VanDerWaalsContact C-N 3.29Å; S702-R704 PolarHBondContact O-N 3.43Å; S702-L705 PolarHBondContact O-N 3.01Å; S702-S706 PolarHBondContact O-N 3.43Å; S702-S706 VanDerWaalsContact O-N 3.09Å; S702-S706 PolarHBondContact O-OG 2.95Å
703	A	76.8	Confident	84.3	Confident	31 Å²	31	83.8 Å²	83.8	26%	0.256	42%	0.419	S	S	.	.	H	α-helix	trans	-64.3	-36.4	178	0	0	0	0	0	111.6	D700 S706 M707	D700-A703 HydrophobicContact CB-CB 4.08Å; D700-A703 VanDerWaalsContact CG-CB 3.45Å; D700-A703 PolarHBondContact OD1-N 3.22Å; D700-A703 WeakPolarHBondContact OD2-CB 3.4Å; A703-S706 PolarHBondContact O-OG 3.43Å; A703-M707 HydrophobicContact CB-CE 4.27Å; A703-M707 WeakPolarHBondContact O-CB 3.43Å; A703-M707 VanDerWaalsContact O-CE 3.29Å; A703-M707 WeakPolarHBondContact O-CE 3.18Å; A703-M707 VanDerWaalsContact O-CG 3.24Å; A703-M707 WeakPolarHBondContact O-CG 3.39Å; A703-M707 PolarHBondContact O-N 3.03Å
704	R	77.9	Confident	84.2	Confident	65 Å²	65	86.8 Å²	86.8	25%	0.245	43%	0.429	C	S	.	.	H	α-helix	trans	-71	-39.4	179.9	-154.7	-178.4	-178	102.7	-6.3	112.7	W679 D700 A701 S702 Q708	W679-R704 HydrophobicContact CE3-CB 3.98Å; W679-R704 HydrophobicContact CE3-CG 3.94Å; W679-R704 HydrophobicContact CH2-CG 3.94Å; W679-R704 HydrophobicContact CZ3-CB 3.87Å; W679-R704 HydrophobicContact CZ3-CG 3.46Å; W679-R704 VanDerWaalsContact CZ3-CG 3.46Å; D700-R704 WeakPolarHBondContact O-CB 3.49Å; D700-R704 PolarHBondContact O-N 3.46Å; D700-R704 VanDerWaalsContact O-N 3.08Å; A701-R704 PolarHBondContact O-N 3.25Å; S702-R704 VanDerWaalsContact C-N 3.29Å; S702-R704 PolarHBondContact O-N 3.43Å; R704-Q708 WeakPolarHBondContact O-CB 3.41Å; R704-Q708 PolarHBondContact O-N 3.05Å
705	L	77.8	Confident	83.8	Confident	59 Å²	59	88.1 Å²	88.1	31%	0.309	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-46.9	174.3	-80.8	158.9	0	0	0	111	P676 W679 A701 S702 M707 Q708 E709	P676-L705 HydrophobicContact CB-CD2 4.41Å; W679-L705 HydrophobicContact CE3-CD2 4.31Å; W679-L705 HydrophobicContact CE3-CG 4.08Å; A701-L705 WeakPolarHBondContact O-CB 3.36Å; A701-L705 WeakPolarHBondContact O-CD1 3.35Å; A701-L705 WeakPolarHBondContact O-CG 3.37Å; A701-L705 PolarHBondContact O-N 3.17Å; S702-L705 PolarHBondContact O-N 3.01Å; L705-M707 PolarHBondContact O-N 3.07Å; L705-Q708 PolarHBondContact O-N 3.14Å; L705-Q708 VanDerWaalsContact O-N 3.16Å; L705-E709 WeakPolarHBondContact O-CG 3.38Å; L705-E709 PolarHBondContact O-N 3.07Å
706	S	78.6	Confident	83.4	Confident	61 Å²	61	86 Å²	86	43%	0.427	43%	0.434	S	S	.	.	H	α-helix	trans	-63.5	-42.9	178.5	65.2	0	0	0	0	112.3	S702 A703 Q708 E709 E710	S702-S706 PolarHBondContact O-N 3.43Å; S702-S706 VanDerWaalsContact O-N 3.09Å; S702-S706 PolarHBondContact O-OG 2.95Å; A703-S706 PolarHBondContact O-OG 3.43Å; S706-Q708 VanDerWaalsContact C-N 3.29Å; S706-Q708 PolarHBondContact O-N 3.03Å; S706-E709 PolarHBondContact O-N 3.34Å; S706-E710 WeakPolarHBondContact O-CB 3.5Å; S706-E710 PolarHBondContact O-N 3.31Å
707	M	81.1	Confident	82.9	Confident	111 Å²	111	88.3 Å²	88.3	55%	0.547	45%	0.446	S	S	.	.	H	α-helix	trans	-62.1	-35.7	174.3	-75.8	-172.8	-75	0	0	112.3	A703 L705 K711	A703-M707 HydrophobicContact CB-CE 4.27Å; A703-M707 WeakPolarHBondContact O-CB 3.43Å; A703-M707 VanDerWaalsContact O-CE 3.29Å; A703-M707 WeakPolarHBondContact O-CE 3.18Å; A703-M707 VanDerWaalsContact O-CG 3.24Å; A703-M707 WeakPolarHBondContact O-CG 3.39Å; A703-M707 PolarHBondContact O-N 3.03Å; L705-M707 PolarHBondContact O-N 3.07Å; M707-K711 VanDerWaalsContact O-CB 3.24Å; M707-K711 WeakPolarHBondContact O-CB 3.31Å; M707-K711 PolarHBondContact O-N 3.42Å
708	Q	79.2	Confident	82.3	Confident	68 Å²	68	89.4 Å²	89.4	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-71.5	-41.8	177.1	-171.4	177	-4.1	0	0	111.8	R704 L705 S706 E710 K711 Q712	R704-Q708 WeakPolarHBondContact O-CB 3.41Å; R704-Q708 PolarHBondContact O-N 3.05Å; L705-Q708 PolarHBondContact O-N 3.14Å; L705-Q708 VanDerWaalsContact O-N 3.16Å; S706-Q708 VanDerWaalsContact C-N 3.29Å; S706-Q708 PolarHBondContact O-N 3.03Å; Q708-E710 VanDerWaalsContact C-N 3.35Å; Q708-K711 PolarHBondContact O-N 3.35Å; Q708-Q712 WeakPolarHBondContact O-CB 3.36Å; Q708-Q712 PolarHBondContact O-N 3.27Å
709	E	82.1	Confident	81.8	Confident	135 Å²	135	88.8 Å²	88.8	63%	0.631	45%	0.452	S	S	*	.	H	α-helix	trans	-62	-43.1	173.7	-72.7	175.9	177.4	0	0	111.3	L705 S706 Q712 R713	L705-E709 WeakPolarHBondContact O-CG 3.38Å; L705-E709 PolarHBondContact O-N 3.07Å; S706-E709 PolarHBondContact O-N 3.34Å; E709-Q712 PolarHBondContact O-N 2.92Å; E709-R713 VanDerWaalsContact O-CB 3.29Å; E709-R713 WeakPolarHBondContact O-CB 3.22Å; E709-R713 PolarHBondContact O-N 3.16Å
710	E	83.8	Confident	81.4	Confident	119 Å²	119	89 Å²	89	56%	0.556	46%	0.459	S	S	*	.	H	α-helix	trans	-63	-47.6	175	-175	175.9	-169.3	0	0	111.5	S706 Q708 Q712 R713 L714	S706-E710 WeakPolarHBondContact O-CB 3.5Å; S706-E710 PolarHBondContact O-N 3.31Å; Q708-E710 VanDerWaalsContact C-N 3.35Å; E710-Q712 VanDerWaalsContact C-N 3.34Å; E710-Q712 PolarHBondContact O-N 3.48Å; E710-R713 WeakPolarHBondContact O-CB 3.41Å; E710-R713 PolarHBondContact O-N 2.99Å; E710-L714 HydrophobicContact CG-CD1 4.19Å; E710-L714 WeakPolarHBondContact O-CG 3.33Å; E710-L714 PolarHBondContact O-N 3.09Å
711	K	84.4	Confident	81.4	Confident	122 Å²	122	87.9 Å²	87.9	53%	0.53	45%	0.452	S	S	.	.	H	α-helix	trans	-54.8	-50.4	174.2	176.4	-174.9	167.8	-178.4	0	111	M707 Q708 R713 L714 E715	M707-K711 VanDerWaalsContact O-CB 3.24Å; M707-K711 WeakPolarHBondContact O-CB 3.31Å; M707-K711 PolarHBondContact O-N 3.42Å; Q708-K711 PolarHBondContact O-N 3.35Å; K711-R713 VanDerWaalsContact C-N 3.3Å; K711-R713 PolarHBondContact O-N 3.14Å; K711-L714 PolarHBondContact O-N 3.21Å; K711-E715 WeakPolarHBondContact CE-OE1 3.24Å; K711-E715 HydrophobicContact CG-CG 4.43Å; K711-E715 IonicContact NZ-OE1 3.63Å; K711-E715 WeakPolarHBondContact O-CB 3.24Å; K711-E715 WeakPolarHBondContact O-CG 3.43Å; K711-E715 PolarHBondContact O-N 3.45Å
712	Q	83.8	Confident	81.6	Confident	107 Å²	107	90.9 Å²	90.9	50%	0.5	47%	0.471	S	S	.	.	H	α-helix	trans	-65.8	-35.8	-177.8	-166.6	168.3	6.6	0	0	111.5	Q708 E709 E710 N716	Q708-Q712 WeakPolarHBondContact O-CB 3.36Å; Q708-Q712 PolarHBondContact O-N 3.27Å; E709-Q712 PolarHBondContact O-N 2.92Å; E710-Q712 VanDerWaalsContact C-N 3.34Å; E710-Q712 PolarHBondContact O-N 3.48Å; Q712-N716 WeakPolarHBondContact O-CB 3.38Å; Q712-N716 PolarHBondContact O-N 3.07Å; Q712-N716 PolarHBondContact O-ND2 3.45Å
713	R	85.5	Confident	81.9	Confident	176 Å²	176	96.4 Å²	96.4	66%	0.664	48%	0.478	S	S	*	.	H	α-helix	trans	-62.3	-46.3	172.2	-175.7	-178.4	-177.6	-179.6	1.5	111.7	E709 E710 K711 N716 Q717	E709-R713 VanDerWaalsContact O-CB 3.29Å; E709-R713 WeakPolarHBondContact O-CB 3.22Å; E709-R713 PolarHBondContact O-N 3.16Å; E710-R713 WeakPolarHBondContact O-CB 3.41Å; E710-R713 PolarHBondContact O-N 2.99Å; K711-R713 VanDerWaalsContact C-N 3.3Å; K711-R713 PolarHBondContact O-N 3.14Å; R713-N716 PolarHBondContact O-N 3.16Å; R713-Q717 WeakPolarHBondContact O-CG 3.27Å; R713-Q717 PolarHBondContact O-N 3Å
714	L	84.9	Confident	82.2	Confident	85 Å²	85	101.6 Å²	101.6	45%	0.445	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-43.5	177.6	-71.4	171.2	0	0	0	111.7	E710 K711 N716 Q717 L718	E710-L714 HydrophobicContact CG-CD1 4.19Å; E710-L714 WeakPolarHBondContact O-CG 3.33Å; E710-L714 PolarHBondContact O-N 3.09Å; K711-L714 PolarHBondContact O-N 3.21Å; L714-N716 VanDerWaalsContact C-N 3.35Å; L714-N716 PolarHBondContact O-N 2.69Å; L714-Q717 PolarHBondContact O-N 3.42Å; L714-L718 WeakPolarHBondContact O-CB 3.33Å; L714-L718 WeakPolarHBondContact O-CD1 3.36Å; L714-L718 WeakPolarHBondContact O-CG 3.36Å; L714-L718 PolarHBondContact O-N 3.35Å
715	E	86.1	Confident	82.5	Confident	98 Å²	98	104.4 Å²	104.4	46%	0.458	51%	0.514	S	S	.	.	H	α-helix	trans	-60.1	-43.8	175.3	-75.7	176.6	161.9	0	0	111.7	K711 Q717 L718 S719	K711-E715 WeakPolarHBondContact CE-OE1 3.24Å; K711-E715 HydrophobicContact CG-CG 4.43Å; K711-E715 IonicContact NZ-OE1 3.63Å; K711-E715 WeakPolarHBondContact O-CB 3.24Å; K711-E715 WeakPolarHBondContact O-CG 3.43Å; K711-E715 PolarHBondContact O-N 3.45Å; E715-Q717 VanDerWaalsContact C-N 3.35Å; E715-Q717 PolarHBondContact O-N 3.27Å; E715-L718 PolarHBondContact O-N 3.19Å; E715-S719 WeakPolarHBondContact O-CB 3.34Å; E715-S719 PolarHBondContact O-N 3.21Å
716	N	84.4	Confident	82.8	Confident	105 Å²	105	107.4 Å²	107.4	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-61.7	-42.2	174.9	-75.2	-22.3	0	0	0	111.7	Q712 R713 L714 S719	Q712-N716 WeakPolarHBondContact O-CB 3.38Å; Q712-N716 PolarHBondContact O-N 3.07Å; Q712-N716 PolarHBondContact O-ND2 3.45Å; R713-N716 PolarHBondContact O-N 3.16Å; L714-N716 VanDerWaalsContact C-N 3.35Å; L714-N716 PolarHBondContact O-N 2.69Å; N716-S719 PolarHBondContact O-N 2.95Å; N716-S719 PolarHBondContact O-OG 3.04Å
717	Q	83	Confident	83.1	Confident	108 Å²	108	111.1 Å²	111.1	51%	0.505	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-46.5	175.7	-74.2	176.9	-24.4	0	0	111.9	R713 L714 E715 S719 G720	R713-Q717 WeakPolarHBondContact O-CG 3.27Å; R713-Q717 PolarHBondContact O-N 3Å; L714-Q717 PolarHBondContact O-N 3.42Å; E715-Q717 VanDerWaalsContact C-N 3.35Å; E715-Q717 PolarHBondContact O-N 3.27Å; Q717-S719 VanDerWaalsContact C-N 3.32Å; Q717-S719 PolarHBondContact O-N 3.14Å; Q717-G720 PolarHBondContact O-N 3.43Å; Q717-G720 VanDerWaalsContact O-N 3.14Å
718	L	81.9	Confident	83.2	Confident	110 Å²	110	109.9 Å²	109.9	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-58.9	-40	176.9	-80.7	155.6	0	0	0	112.2	L714 E715 G720 I721	L714-L718 WeakPolarHBondContact O-CB 3.33Å; L714-L718 WeakPolarHBondContact O-CD1 3.36Å; L714-L718 WeakPolarHBondContact O-CG 3.36Å; L714-L718 PolarHBondContact O-N 3.35Å; E715-L718 PolarHBondContact O-N 3.19Å; L718-G720 PolarHBondContact O-N 3.18Å; L718-I721 HydrophobicContact CD2-CD1 3.93Å; L718-I721 WeakPolarHBondContact O-CB 3.44Å; L718-I721 PolarHBondContact O-N 3.4Å; L718-I721 VanDerWaalsContact O-N 3.14Å
719	S	80.3	Confident	83.3	Confident	87 Å²	87	109.7 Å²	109.7	61%	0.608	53%	0.533	S	S	*	.	H	α-helix	trans	-61.7	-26	178	78.8	0	0	0	0	113.7	E715 N716 Q717	E715-S719 WeakPolarHBondContact O-CB 3.34Å; E715-S719 PolarHBondContact O-N 3.21Å; N716-S719 PolarHBondContact O-N 2.95Å; N716-S719 PolarHBondContact O-OG 3.04Å; Q717-S719 VanDerWaalsContact C-N 3.32Å; Q717-S719 PolarHBondContact O-N 3.14Å
720	G	80.6	Confident	83.4	Confident	25 Å²	25	107.2 Å²	107.2	26%	0.258	52%	0.521	S	S	.	.	H	α-helix	trans	-83.7	-19	178	0	0	0	0	0	114.4	Q717 L718 R723 M724	Q717-G720 PolarHBondContact O-N 3.43Å; Q717-G720 VanDerWaalsContact O-N 3.14Å; L718-G720 PolarHBondContact O-N 3.18Å; G720-R723 PolarHBondContact O-N 3.11Å; G720-M724 WeakPolarHBondContact O-CG 3.39Å; G720-M724 PolarHBondContact O-N 3.36Å; G720-M724 VanDerWaalsContact O-N 3.1Å
721	I	84.6	Confident	83.4	Confident	70 Å²	70	105 Å²	105	36%	0.359	51%	0.513	S	S	.	.	H	α-helix	trans	-57.7	-44.2	-175.2	-65	-177.1	0	0	0	113.1	L718 R723 M724 Q725	L718-I721 HydrophobicContact CD2-CD1 3.93Å; L718-I721 WeakPolarHBondContact O-CB 3.44Å; L718-I721 PolarHBondContact O-N 3.4Å; L718-I721 VanDerWaalsContact O-N 3.14Å; I721-R723 VanDerWaalsContact C-N 3.3Å; I721-R723 PolarHBondContact O-N 3.36Å; I721-M724 PolarHBondContact O-N 3.35Å; I721-M724 VanDerWaalsContact O-N 3.1Å; I721-Q725 HydrophobicContact CG2-CG 4.06Å; I721-Q725 WeakPolarHBondContact O-CG 3.4Å; I721-Q725 PolarHBondContact O-N 3.48Å
722	P	81.5	Confident	83.2	Confident	78 Å²	78	105.5 Å²	105.5	51%	0.506	51%	0.512	S	S	.	.	H	α-helix	trans	-60	-39.1	-179.8	-24.3	34.1	0	0	0	112.9	Q725 Q726	P722-Q725 PolarHBondContact O-N 3.5Å; P722-Q726 WeakPolarHBondContact O-CB 3.28Å; P722-Q726 PolarHBondContact O-N 3.44Å
723	R	81.8	Confident	83.1	Confident	204 Å²	204	106.6 Å²	106.6	77%	0.77	52%	0.52	S	S	*	.	H	α-helix	trans	-68.5	-38.9	175.6	-77.8	-176.3	175.4	172	-0.2	111.9	G720 I721 Q726 R727	G720-R723 PolarHBondContact O-N 3.11Å; I721-R723 VanDerWaalsContact C-N 3.3Å; I721-R723 PolarHBondContact O-N 3.36Å; R723-Q726 PolarHBondContact O-N 2.91Å; R723-R727 WeakPolarHBondContact O-CB 3.19Å; R723-R727 PolarHBondContact O-N 2.9Å
724	M	82.1	Confident	83	Confident	140 Å²	140	104.5 Å²	104.5	69%	0.69	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-39.7	176.3	-66.8	-177.7	112.2	0	0	111.4	G720 I721 R727 L728	G720-M724 WeakPolarHBondContact O-CG 3.39Å; G720-M724 PolarHBondContact O-N 3.36Å; G720-M724 VanDerWaalsContact O-N 3.1Å; I721-M724 PolarHBondContact O-N 3.35Å; I721-M724 VanDerWaalsContact O-N 3.1Å; M724-R727 PolarHBondContact O-N 2.89Å; M724-L728 VanDerWaalsContact O-CB 3.24Å; M724-L728 WeakPolarHBondContact O-CB 3.24Å; M724-L728 PolarHBondContact O-N 3.41Å
725	Q	84.6	Confident	82.8	Confident	125 Å²	125	106.2 Å²	106.2	58%	0.584	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-44	173.3	-75.2	176.5	-25.5	0	0	111.8	I721 P722 L728 S729	I721-Q725 HydrophobicContact CG2-CG 4.06Å; I721-Q725 WeakPolarHBondContact O-CG 3.4Å; I721-Q725 PolarHBondContact O-N 3.48Å; P722-Q725 PolarHBondContact O-N 3.5Å; Q725-L728 WeakPolarHBondContact O-CB 3.5Å; Q725-L728 PolarHBondContact O-N 2.86Å; Q725-S729 PolarHBondContact O-N 2.98Å
726	Q	84.4	Confident	82.1	Confident	121 Å²	121	104.5 Å²	104.5	57%	0.565	54%	0.539	S	S	*	.	H	α-helix	trans	-63.3	-44.8	176.5	-165.2	173.2	10.3	0	0	111.2	P722 R723 L728 S729 E730	P722-Q726 WeakPolarHBondContact O-CB 3.28Å; P722-Q726 PolarHBondContact O-N 3.44Å; R723-Q726 PolarHBondContact O-N 2.91Å; Q726-L728 VanDerWaalsContact C-N 3.34Å; Q726-L728 PolarHBondContact O-N 3.42Å; Q726-S729 PolarHBondContact O-N 2.92Å; Q726-S729 PolarHBondContact O-OG 3.32Å; Q726-E730 PolarHBondContact O-N 3.44Å
727	R	85	Confident	81.4	Confident	139 Å²	139	105.3 Å²	105.3	53%	0.525	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-36.7	176.3	-172	56.4	172.5	-179.5	1.4	112.7	R723 M724 S729 E730 L731	R723-R727 WeakPolarHBondContact O-CB 3.19Å; R723-R727 PolarHBondContact O-N 2.9Å; M724-R727 PolarHBondContact O-N 2.89Å; R727-S729 VanDerWaalsContact C-N 3.34Å; R727-E730 WeakPolarHBondContact CD-OE2 3.36Å; R727-E730 IonicContact CZ-OE2 2.76Å; R727-E730 IonicContact NH1-OE2 3.27Å; R727-E730 PolarHBondContact NH1-OE2 2.91Å; R727-E730 PolarHBondContact O-N 3.32Å; R727-L731 HydrophobicContact CG-CD1 4.23Å; R727-L731 WeakPolarHBondContact O-CB 3.41Å; R727-L731 VanDerWaalsContact O-CG 3.28Å; R727-L731 WeakPolarHBondContact O-CG 3.36Å; R727-L731 PolarHBondContact O-N 2.95Å
728	L	82.6	Confident	80.1	Confident	85 Å²	85	106.8 Å²	106.8	45%	0.445	55%	0.55	S	S	.	*	H	α-helix	trans	-63	-42.1	173.4	-171.5	78.5	0	0	0	110.7	M724 Q725 Q726 L731 R732	M724-L728 VanDerWaalsContact O-CB 3.24Å; M724-L728 WeakPolarHBondContact O-CB 3.24Å; M724-L728 PolarHBondContact O-N 3.41Å; Q725-L728 WeakPolarHBondContact O-CB 3.5Å; Q725-L728 PolarHBondContact O-N 2.86Å; Q726-L728 VanDerWaalsContact C-N 3.34Å; Q726-L728 PolarHBondContact O-N 3.42Å; L728-L731 PolarHBondContact O-N 2.93Å; L728-R732 WeakPolarHBondContact O-CB 3.43Å; L728-R732 WeakPolarHBondContact O-CG 3.19Å; L728-R732 PolarHBondContact O-N 3.5Å
729	S	81.8	Confident	78.7	Confident	65 Å²	65	110 Å²	110	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-64.4	-40.2	176.1	72.8	0	0	0	0	112.5	Q725 Q726 R727 L733	Q725-S729 PolarHBondContact O-N 2.98Å; Q726-S729 PolarHBondContact O-N 2.92Å; Q726-S729 PolarHBondContact O-OG 3.32Å; R727-S729 VanDerWaalsContact C-N 3.34Å; S729-L733 WeakPolarHBondContact O-CB 3.33Å; S729-L733 PolarHBondContact O-N 3.45Å
730	E	84.2	Confident	77.1	Confident	83 Å²	83	114 Å²	114	39%	0.388	58%	0.577	S	S	.	*	H	α-helix	trans	-63	-43.3	173.2	-72.9	176.6	178.8	0	0	111.9	Q726 R727 L733 L734	Q726-E730 PolarHBondContact O-N 3.44Å; R727-E730 WeakPolarHBondContact CD-OE2 3.36Å; R727-E730 IonicContact CZ-OE2 2.76Å; R727-E730 IonicContact NH1-OE2 3.27Å; R727-E730 PolarHBondContact NH1-OE2 2.91Å; R727-E730 PolarHBondContact O-N 3.32Å; E730-L733 PolarHBondContact O-N 3.02Å; E730-L734 WeakPolarHBondContact O-CG 3.43Å; E730-L734 PolarHBondContact O-N 3.04Å
731	L	83.2	Confident	75.6	Confident	73 Å²	73	120.9 Å²	120.9	38%	0.382	60%	0.602	S	S	.	*	H	α-helix	trans	-67.6	-41.7	179.7	-74.5	170.2	0	0	0	112	R727 L728 L733 L734 L735	R727-L731 HydrophobicContact CG-CD1 4.23Å; R727-L731 WeakPolarHBondContact O-CB 3.41Å; R727-L731 VanDerWaalsContact O-CG 3.28Å; R727-L731 WeakPolarHBondContact O-CG 3.36Å; R727-L731 PolarHBondContact O-N 2.95Å; L728-L731 PolarHBondContact O-N 2.93Å; L731-L733 VanDerWaalsContact C-N 3.28Å; L731-L733 PolarHBondContact O-N 3.34Å; L731-L734 PolarHBondContact O-N 3.46Å; L731-L735 WeakPolarHBondContact O-CB 3.46Å; L731-L735 WeakPolarHBondContact O-CG 3.38Å; L731-L735 PolarHBondContact O-N 2.97Å
732	R	81.3	Confident	73.4	Confident	132 Å²	132	124.8 Å²	124.8	50%	0.498	62%	0.624	S	S	.	*	H	α-helix	trans	-59.4	-41.1	173.3	-76.8	177.8	176.3	175.8	-3.9	111.5	L728 L735 G736 E737	L728-R732 WeakPolarHBondContact O-CB 3.43Å; L728-R732 WeakPolarHBondContact O-CG 3.19Å; L728-R732 PolarHBondContact O-N 3.5Å; R732-L735 PolarHBondContact O-N 2.94Å; R732-G736 PolarHBondContact O-N 3.41Å; R732-E737 PolarHBondContact O-N 2.9Å; R732-E737 VanDerWaalsContact O-N 3.16Å
733	L	81.1	Confident	71.5	Confident	130 Å²	130	128.4 Å²	128.4	68%	0.681	65%	0.645	S	S	*	*	H	α-helix	trans	-66.1	-36.6	176.1	-163.7	139.5	0	0	0	112.4	S729 E730 L731	S729-L733 WeakPolarHBondContact O-CB 3.33Å; S729-L733 PolarHBondContact O-N 3.45Å; E730-L733 PolarHBondContact O-N 3.02Å; L731-L733 VanDerWaalsContact C-N 3.28Å; L731-L733 PolarHBondContact O-N 3.34Å
734	L	82.9	Confident	69.5	Low	132 Å²	132	122.5 Å²	122.5	69%	0.691	64%	0.64	S	S	*	*	H	α-helix	trans	-74.9	-31.1	176.6	-74.5	168	0	0	0	113.8	E730 L731	E730-L734 WeakPolarHBondContact O-CG 3.43Å; E730-L734 PolarHBondContact O-N 3.04Å; L731-L734 PolarHBondContact O-N 3.46Å
735	L	81.6	Confident	67.4	Low	120 Å²	120	125.4 Å²	125.4	63%	0.628	65%	0.652	S	S	*	*	H	α-helix	trans	-86.4	-6.8	-179.3	-71.1	166.6	0	0	0	113.2	L731 R732 E737	L731-L735 WeakPolarHBondContact O-CB 3.46Å; L731-L735 WeakPolarHBondContact O-CG 3.38Å; L731-L735 PolarHBondContact O-N 2.97Å; R732-L735 PolarHBondContact O-N 2.94Å; L735-E737 VanDerWaalsContact C-N 3.26Å; L735-E737 HydrophobicContact CB-CG 4.32Å; L735-E737 PolarHBondContact O-N 3.45Å
736	G	72.3	Confident	64.9	Low	63 Å²	63	123.3 Å²	123.3	65%	0.649	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.9	14.8	-179.5	0	0	0	0	0	113.9	R732 L738	R732-G736 PolarHBondContact O-N 3.41Å; G736-L738 VanDerWaalsContact C-N 3.28Å; G736-L738 PolarHBondContact O-N 3.41Å; G736-L738 VanDerWaalsContact O-N 3.09Å
737	E	68.9	Low	62.6	Low	121 Å²	121	129.5 Å²	129.5	57%	0.565	68%	0.681	S	S	*	*			trans	-83.7	72.6	174.7	-65.6	176.9	178.6	0	0	109	R732 L735	R732-E737 PolarHBondContact O-N 2.9Å; R732-E737 VanDerWaalsContact O-N 3.16Å; L735-E737 VanDerWaalsContact C-N 3.26Å; L735-E737 HydrophobicContact CB-CG 4.32Å; L735-E737 PolarHBondContact O-N 3.45Å
738	L	56	Low	60.2	Low	139 Å²	139	129.6 Å²	129.6	73%	0.728	70%	0.697	S	S	*	*			trans	-95.9	92.9	161.6	-70.9	171.9	0	0	0	107.1	G736	G736-L738 VanDerWaalsContact C-N 3.28Å; G736-L738 PolarHBondContact O-N 3.41Å; G736-L738 VanDerWaalsContact O-N 3.09Å
739	E	51.9	Low	57.8	Low	179 Å²	179	130 Å²	130	84%	0.836	71%	0.713	S	S	*	*			trans	-77.5	122.6	156.5	-76	-175.2	156.1	0	0	107.7	E741	E739-E741 VanDerWaalsContact C-N 3.27Å; E739-E741 PolarHBondContact O-N 3.45Å
740	D	46.5	Very low	55.7	Low	169 Å²	169	132.1 Å²	132.1	90%	0.904	74%	0.735	S	S	*	*			trans	-61.9	84.2	169.1	-75.4	-45.4	0	0	0	109.8
741	E	48.5	Very low	53.1	Low	170 Å²	170	132.6 Å²	132.6	79%	0.794	75%	0.753	S	S	*	*			trans	-113.3	85	157.3	-76.9	-165.2	157.3	0	0	108.4	E739	E739-E741 VanDerWaalsContact C-N 3.27Å; E739-E741 PolarHBondContact O-N 3.45Å
742	D	40.1	Very low	51.5	Low	153 Å²	153	135.2 Å²	135.2	82%	0.818	77%	0.774	S	S	*	*				161.1	85.7	125.8	-82.7	-23.1	0	0	0	111.7
743	T	40.9	Very low	49.3	Very low	154 Å²	154	137.2 Å²	137.2	95%	0.945	79%	0.794	S	S	*	*			trans	-91.9	85.4	142.5	33.3	0	0	0	0	109
744	A	39.7	Very low	47	Very low	80 Å²	80	140.6 Å²	140.6	66%	0.661	83%	0.826	S	S	*	*	S	Bend	trans	-176	103.6	142.3	0	0	0	0	0	112.5
745	E	38.1	Very low	45.2	Very low	201 Å²	201	141.1 Å²	141.1	94%	0.939	83%	0.833	S	S	*	*			trans	64.8	116.1	140.4	-59.2	-172.4	161.1	0	0	121.1
746	G	31.4	Very low	43.3	Very low	81 Å²	81	142.2 Å²	142.2	84%	0.835	84%	0.843	S	S	*	*			trans	140.9	56.4	141.9	0	0	0	0	0	118.6	V748	G746-V748 PolarHBondContact O-N 2.87Å
747	R	36.3	Very low	41.7	Very low	250 Å²	250	146.6 Å²	146.6	94%	0.943	85%	0.854	S	S	*	*			trans	-62.6	127.7	161.7	-80.5	179.5	173.4	171.3	-1.1	110.7
748	V	34.8	Very low	40.1	Very low	142 Å²	142	148.1 Å²	148.1	86%	0.861	87%	0.871	S	S	*	*			trans	-147.9	114.4	132	-177.4	0	0	0	0	111.8	G746	G746-V748 PolarHBondContact O-N 2.87Å
749	A	33.2	Very low	39.1	Very low	94 Å²	94	148.6 Å²	148.6	78%	0.777	88%	0.88	S	S	*	*			trans	58.2	109	146.1	0	0	0	0	0	121.8
750	A	35.8	Very low	38.3	Very low	109 Å²	109	146.6 Å²	146.6	90%	0.901	88%	0.883	S	S	*	*			trans	-79.5	140.7	144.8	0	0	0	0	0	110.5
751	A	30.8	Very low	37.7	Very low	93 Å²	93	145 Å²	145	77%	0.769	88%	0.882	S	S	*	*			trans	-121	143.3	159.3	0	0	0	0	0	108.5
752	P	49.8	Very low	36.8	Very low	128 Å²	128	143.1 Å²	143.1	83%	0.831	89%	0.888	S	S	*	*			trans	-88.5	144.7	-172.6	35.2	-31.2	0	0	0	111
753	L	34.4	Very low	36.6	Very low	174 Å²	174	142.3 Å²	142.3	91%	0.911	89%	0.894	S	S	*	*			trans	-118	119.1	163.8	-83.9	161.4	0	0	0	108.8
754	C	33.5	Very low	36.2	Very low	201 Å²	201	141.2 Å²	141.2	100%	1.358	89%	0.89	S	S	*	*			trans	-66.1	0	149.4	-76.4	0	0	0	0	110.4

Retrieved 754 of 754 residues in 1587.4 ms (Link to these results)

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