A0A087XXC0_POEFO Loading...

Cullin 3

AlphaFold DB , UniProt , Accession A0A087XXC0, Species POEFO (Poecilia formosa, Amazon molly), Gene CUL3, Length 801 aa.

						>A0A087XXC0_POEFO|A0A087XXC0|CUL3
MSNLSKGGTKKDTKMRIRAFPMTMDEKYVNNIWDLLKNAIQEIQRKNNSGLSFEELYRNAYTMVLHKHGEKLYTGLREVVTEHLINKVREDVLNSLNNNFLQTLNQAWNDHQTAMVMIRDILMYMDRVYVQQNNVENVYNLGLIIFRDQVVRYGCIRDHLRQTLLDMIARERKGEVVDRGAIRNACQMLMILGLEGRSVYEEDFEAPFLEMSAEFFQLESQKFLSENSASVYIKKVEARINEEIERVMHCLDKSTEEPIVKVVERELISKHMKTIVEMENSGLVHMLKNGKTDDLACMYKLFSRVPNGLKTMCECMSSYLREQGKALVSEEGEGKNPVDYIQGLLDLKSRFDRFLQESFNNDRLFKQTIAGDFEYFLNLNSRSPEYLSLFIDDKLKKGVKGLTEQEVESILDKAMVLFRFMQEKDVFERYYKQHLARRLLTNKSVSDDSEKNMISKLKTECGCQFTSKLEGMFRDMSISNTTMDEFRQHLQTTGVSLGGVDLTVRVLTTGYWPTQSATPKCNIPPSPRHAFEVFRRFYLGKHSGRQLTLQHHMGSADLNATFYGPIKKEDGSEVGVGGAQVTGSNTRKHILQVSTFQMTILMLFNNREKSTFEEIQQETDIPERELVRALQSLACGKPTQRVLTKEPKSKEIENGHVFTVNDQFTSKLHRVKIQTDLIGKMNPSSRRLINWFITDFCDRLLMNELAFFVMAAKQGESDPERKETRQKVDDDRKHEIEAAIVRIMKSRKKMQHNVLVAEVTQQLRARFLPSPVVIKKRIEGLIEREYLARTPEDRKVYTYVA
					

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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	37.1	Very low	34.7	Very low	235 Å²	235	154.5 Å²	154.5	100%	1.158	88%	0.881	S	S	*	*				0	115.1	0	-70.8	-179	-170.4	0	0	107
2	S	36.8	Very low	34.5	Very low	128 Å²	128	154.8 Å²	154.8	90%	0.895	88%	0.878	S	S	*	*			trans	15.5	93.6	178.8	25.9	0	0	0	0	119.2
3	N	29.3	Very low	34.6	Very low	140 Å²	140	151.8 Å²	151.8	75%	0.749	87%	0.865	S	S	*	*			trans	-45.6	133.3	159.9	-80.7	-13.3	0	0	0	114.3
4	L	30.4	Very low	34.8	Very low	157 Å²	157	155.6 Å²	155.6	82%	0.822	87%	0.867	S	S	*	*				63.8	136.3	103.7	-75.8	146.1	0	0	0	114.2
5	S	29.7	Very low	34.6	Very low	108 Å²	108	157.1 Å²	157.1	76%	0.755	87%	0.868	S	S	*	*			cis	-164.3	161	18.6	60.7	0	0	0	0	110.6
6	K	36.3	Very low	35.2	Very low	210 Å²	210	162.4 Å²	162.4	91%	0.913	87%	0.871	S	S	*	*			trans	-71.3	147.9	167.8	-73.8	174.4	171.8	176.3	0	111.4
7	G	30.1	Very low	35.8	Very low	83 Å²	83	161.3 Å²	161.3	86%	0.856	86%	0.863	S	S	*	*			trans	-178.5	126.1	155.3	0	0	0	0	0	113.2
8	G	28.4	Very low	36.2	Very low	84 Å²	84	165.3 Å²	165.3	87%	0.866	86%	0.864	S	S	*	*			trans	122.3	89.9	151.4	0	0	0	0	0	117.6
9	T	43.1	Very low	36.3	Very low	148 Å²	148	161.7 Å²	161.7	91%	0.908	86%	0.86	S	S	*	*			trans	-86.2	119.4	156.6	42.7	0	0	0	0	110.2
10	K	31.6	Very low	36.7	Very low	210 Å²	210	162.6 Å²	162.6	91%	0.913	86%	0.856	S	S	*	*			trans	-147.5	133.3	156.4	-105.7	-177.5	-179.8	179.5	0	110.4
11	K	48.9	Very low	37.1	Very low	197 Å²	197	159.8 Å²	159.8	86%	0.857	85%	0.848	S	S	*	*			trans	-46.7	140.5	170.2	-81.2	169.3	165	173.6	0	111.3
12	D	32.3	Very low	37.8	Very low	157 Å²	157	157.5 Å²	157.5	84%	0.84	84%	0.837	S	S	*	*			trans	-164.6	132.1	135	-101.9	-22.7	0	0	0	115.5
13	T	35.5	Very low	38.8	Very low	117 Å²	117	157.1 Å²	157.1	72%	0.718	83%	0.829	S	S	*	*			trans	61.2	92.9	142.8	-30.1	0	0	0	0	120.8	M15	T13-M15 PolarHBondContact O-N 3.25Å; T13-M15 VanDerWaalsContact O-N 3.14Å
14	K	38.3	Very low	40.5	Very low	205 Å²	205	151.9 Å²	151.9	89%	0.891	80%	0.8	S	S	*	*			trans	-46	111.9	151.2	-108.4	176.9	174.7	174	0	110.6	R16	K14-R16 PolarHBondContact O-N 2.91Å
15	M	31.8	Very low	42.6	Very low	178 Å²	178	149.5 Å²	149.5	88%	0.877	79%	0.788	S	S	*	*			trans	-79.6	108.3	159.2	-152.2	160.1	124.2	0	0	107.5	T13 I17	T13-M15 PolarHBondContact O-N 3.25Å; T13-M15 VanDerWaalsContact O-N 3.14Å; M15-I17 PolarHBondContact O-N 3.45Å
16	R	44.5	Very low	44.9	Very low	242 Å²	242	151.4 Å²	151.4	91%	0.913	79%	0.785	S	S	*	*			trans	-65.6	97.1	174.2	-100	179.6	167.2	169.2	-3.7	108.8	K14 R18	K14-R16 PolarHBondContact O-N 2.91Å; R16-R18 PolarHBondContact O-N 3.38Å
17	I	44.9	Very low	47	Very low	143 Å²	143	148.7 Å²	148.7	73%	0.733	77%	0.774	S	S	*	*			trans	-69.8	115.9	157.7	-58.8	177.7	0	0	0	105.6	M15 A19	M15-I17 PolarHBondContact O-N 3.45Å; I17-A19 PolarHBondContact O-N 3.07Å
18	R	42.9	Very low	49.6	Very low	234 Å²	234	150.9 Å²	150.9	88%	0.883	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-55.6	126.7	170.6	-84	-179.3	173.7	172.3	-2.1	107.7	R16 F20	R16-R18 PolarHBondContact O-N 3.38Å; R18-F20 PolarHBondContact O-N 3.49Å
19	A	38.6	Very low	52.2	Low	96 Å²	96	147 Å²	147	79%	0.793	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-56.2	126.9	170.9	0	0	0	0	0	109	I17	I17-A19 PolarHBondContact O-N 3.07Å
20	F	44.3	Very low	54.4	Low	180 Å²	180	142.9 Å²	142.9	79%	0.789	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-60.5	134.8	165.5	-72.3	-88.2	0	0	0	108.2	R18 M22	R18-F20 PolarHBondContact O-N 3.49Å; F20-M22 PolarHBondContact O-N 3.49Å
21	P	44.6	Very low	57.1	Low	104 Å²	104	137.9 Å²	137.9	68%	0.675	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.4	128	-179.8	19.2	-27.1	0	0	0	110.4	T23	P21-T23 PolarHBondContact O-N 3.43Å
22	M	52.2	Low	59	Low	187 Å²	187	128.9 Å²	128.9	92%	0.921	63%	0.633	S	S	*	*	S	Bend	trans	-74.4	-0	-173.6	-99.6	-168.9	174.5	0	0	114.5	F20	F20-M22 PolarHBondContact O-N 3.49Å
23	T	57.4	Low	61.8	Low	119 Å²	119	122.6 Å²	122.6	73%	0.73	60%	0.598	S	S	*	*	S	Bend	trans	-146.9	125.7	-178.9	52	0	0	0	0	110.2	P21	P21-T23 PolarHBondContact O-N 3.43Å
24	M	64.5	Low	64.5	Low	31 Å²	31	120.8 Å²	120.8	15%	0.153	58%	0.583	C	S	.	*			trans	-72.9	139	168.4	-71.9	175.6	70.1	0	0	109.6	Y28 V29 I32 T62 H66	M24-Y28 HydrophobicContact CE-CD1 3.41Å; M24-Y28 VanDerWaalsContact CE-CD1 3.41Å; M24-Y28 HydrophobicContact CE-CE1 3.67Å; M24-V29 HydrophobicContact CB-CG2 3.77Å; M24-V29 HydrophobicContact CE-CG2 3.73Å; M24-V29 HydrophobicContact SD-CG2 4.27Å; M24-I32 HydrophobicContact CE-CD1 3.66Å; M24-T62 HydrophobicContact CE-CG2 4.13Å; M24-T62 HydrophobicContact SD-CG2 4.04Å; M24-H66 HydrophobicContact CG-CB 4.09Å; M24-H66 HydrophobicContact SD-CB 3.43Å; M24-H66 WeakPolarHBondContact SD-CB 3.28Å; M24-H66 PolarHBondContact SD-CD2 3.4Å
25	D	75.4	Confident	67	Low	106 Å²	106	114.5 Å²	114.5	57%	0.567	56%	0.559	S	S	*	*			trans	-68.1	136.7	170.1	-179.2	1.4	0	0	0	109.8	K27 Y28 V29	D25-K27 PolarHBondContact O-N 3.28Å; D25-K27 PolarHBondContact OD1-N 2.96Å; D25-Y28 WeakPolarHBondContact O-CB 3.36Å; D25-Y28 PolarHBondContact O-N 3.35Å; D25-V29 PolarHBondContact O-N 3.27Å; D25-V29 VanDerWaalsContact O-N 3.13Å
26	E	78.1	Confident	69.8	Low	149 Å²	149	106.2 Å²	106.2	70%	0.696	52%	0.518	S	S	*	.	H	α-helix	trans	-55	-35.4	179.6	-79.3	-168.4	147.5	0	0	112.6	Y28 V29 N30	E26-Y28 VanDerWaalsContact C-N 3.3Å; E26-Y28 PolarHBondContact O-N 3.15Å; E26-V29 PolarHBondContact O-N 3.29Å; E26-N30 WeakPolarHBondContact O-CB 3.4Å; E26-N30 VanDerWaalsContact O-CG 3.25Å; E26-N30 PolarHBondContact O-N 3.43Å; E26-N30 PolarHBondContact O-ND2 2.95Å
27	K	80.7	Confident	72.1	Confident	153 Å²	153	97.7 Å²	97.7	67%	0.665	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-38.4	175.6	-77.3	-177.2	178.2	177.8	0	112.3	D25 N31	D25-K27 PolarHBondContact O-N 3.28Å; D25-K27 PolarHBondContact OD1-N 2.96Å; K27-N31 PolarHBondContact O-N 2.82Å; K27-N31 PolarHBondContact O-ND2 3.45Å; K27-N31 PolarHBondContact O-OD1 2.86Å
28	Y	83.1	Confident	74.4	Confident	129 Å²	129	95.2 Å²	95.2	51%	0.506	48%	0.476	S	S	.	.	H	α-helix	trans	-71.7	-39.8	178.7	-174.2	-117.6	0	0	0	111.4	M24 D25 E26 N30 N31 I32	M24-Y28 HydrophobicContact CE-CD1 3.41Å; M24-Y28 VanDerWaalsContact CE-CD1 3.41Å; M24-Y28 HydrophobicContact CE-CE1 3.67Å; D25-Y28 WeakPolarHBondContact O-CB 3.36Å; D25-Y28 PolarHBondContact O-N 3.35Å; E26-Y28 VanDerWaalsContact C-N 3.3Å; E26-Y28 PolarHBondContact O-N 3.15Å; Y28-N30 VanDerWaalsContact C-N 3.35Å; Y28-N30 PolarHBondContact O-N 2.74Å; Y28-N31 PolarHBondContact O-N 3.22Å; Y28-I32 HydrophobicContact CD1-CD1 3.98Å; Y28-I32 HydrophobicContact CE1-CD1 3.58Å; Y28-I32 HydrophobicContact CE2-CD1 4.35Å; Y28-I32 WeakPolarHBondContact O-CG1 3.27Å; Y28-I32 PolarHBondContact O-N 3.41Å
29	V	84.6	Confident	76.7	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.006	44%	0.436	C	S	.	.	H	α-helix	trans	-62.1	-41.6	173.8	179.4	0	0	0	0	111.4	M24 D25 E26 I32 W33 M63 H68 K71	M24-V29 HydrophobicContact CB-CG2 3.77Å; M24-V29 HydrophobicContact CE-CG2 3.73Å; M24-V29 HydrophobicContact SD-CG2 4.27Å; D25-V29 PolarHBondContact O-N 3.27Å; D25-V29 VanDerWaalsContact O-N 3.13Å; E26-V29 PolarHBondContact O-N 3.29Å; V29-I32 PolarHBondContact O-N 3.1Å; V29-W33 WeakPolarHBondContact O-CB 3.42Å; V29-W33 PolarHBondContact O-N 3.44Å; V29-M63 HydrophobicContact CG1-CE 4Å; V29-H68 HydrophobicContact CG1-CB 4.27Å; V29-K71 HydrophobicContact CG1-CD 4.46Å
30	N	87.4	Confident	79.3	Confident	62 Å²	62	79.9 Å²	79.9	33%	0.332	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-45.5	175.9	-71.9	-23.6	0	0	0	111.9	E26 Y28 I32 W33 D34 K71	E26-N30 WeakPolarHBondContact O-CB 3.4Å; E26-N30 VanDerWaalsContact O-CG 3.25Å; E26-N30 PolarHBondContact O-N 3.43Å; E26-N30 PolarHBondContact O-ND2 2.95Å; Y28-N30 VanDerWaalsContact C-N 3.35Å; Y28-N30 PolarHBondContact O-N 2.74Å; N30-I32 VanDerWaalsContact C-N 3.31Å; N30-I32 PolarHBondContact O-N 2.91Å; N30-W33 PolarHBondContact O-N 3.28Å; N30-W33 VanDerWaalsContact O-N 3.15Å; N30-D34 PolarHBondContact O-N 3.45Å; N30-K71 PolarHBondContact OD1-NZ 2.94Å
31	N	88.4	Confident	81.6	Confident	105 Å²	105	73.1 Å²	73.1	56%	0.561	37%	0.37	S	S	*	.	H	α-helix	trans	-60.7	-40	177.7	-70.4	-13.2	0	0	0	112.4	K27 Y28 L35	K27-N31 PolarHBondContact O-N 2.82Å; K27-N31 PolarHBondContact O-ND2 3.45Å; K27-N31 PolarHBondContact O-OD1 2.86Å; Y28-N31 PolarHBondContact O-N 3.22Å; N31-L35 WeakPolarHBondContact O-CB 3.44Å; N31-L35 PolarHBondContact O-N 3.47Å; N31-L35 VanDerWaalsContact O-N 3.14Å
32	I	88.6	Confident	83.8	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-43.1	175.7	-66	172.2	0	0	0	110.6	M24 Y28 V29 N30 L35 L36 N59 M63	M24-I32 HydrophobicContact CE-CD1 3.66Å; Y28-I32 HydrophobicContact CD1-CD1 3.98Å; Y28-I32 HydrophobicContact CE1-CD1 3.58Å; Y28-I32 HydrophobicContact CE2-CD1 4.35Å; Y28-I32 WeakPolarHBondContact O-CG1 3.27Å; Y28-I32 PolarHBondContact O-N 3.41Å; V29-I32 PolarHBondContact O-N 3.1Å; N30-I32 VanDerWaalsContact C-N 3.31Å; N30-I32 PolarHBondContact O-N 2.91Å; I32-L35 PolarHBondContact O-N 3.48Å; I32-L36 HydrophobicContact CG2-CD1 4.06Å; I32-L36 HydrophobicContact CG2-CG 4.46Å; I32-L36 WeakPolarHBondContact O-CG 3.49Å; I32-L36 PolarHBondContact O-N 2.98Å; I32-N59 HydrophobicContact CG2-CB 3.76Å; I32-M63 HydrophobicContact CB-CG 4.41Å; I32-M63 HydrophobicContact CB-SD 4.3Å; I32-M63 HydrophobicContact CG2-CG 3.76Å; I32-M63 HydrophobicContact CG2-SD 3.67Å
33	W	92.5	Very high	85.7	Confident	26 Å²	26	61.7 Å²	61.7	10%	0.098	31%	0.305	C	S	.	.	H	α-helix	trans	-62.1	-44.2	176.5	172.3	-116.1	0	0	0	112.2	V29 N30 L35 L36 K37 M63 L72 G75 L76 V79	V29-W33 WeakPolarHBondContact O-CB 3.42Å; V29-W33 PolarHBondContact O-N 3.44Å; N30-W33 PolarHBondContact O-N 3.28Å; N30-W33 VanDerWaalsContact O-N 3.15Å; W33-L35 VanDerWaalsContact C-N 3.28Å; W33-L35 PolarHBondContact O-N 3.32Å; W33-L36 HydrophobicContact CE3-CB 4.34Å; W33-L36 PolarHBondContact O-N 3.49Å; W33-K37 HydrophobicContact CH2-CB 4.39Å; W33-K37 HydrophobicContact CZ2-CB 4.11Å; W33-K37 HydrophobicContact CZ2-CD 4.38Å; W33-K37 VanDerWaalsContact O-CB 3.28Å; W33-K37 WeakPolarHBondContact O-CB 3.32Å; W33-K37 PolarHBondContact O-N 2.77Å; W33-M63 HydrophobicContact CB-CE 4.1Å; W33-M63 HydrophobicContact CB-SD 4.47Å; W33-L72 HydrophobicContact CE3-CD1 3.73Å; W33-L72 HydrophobicContact CZ3-CD1 3.65Å; W33-G75 VanDerWaalsContact CH2-CA 3.47Å; W33-G75 WeakPolarHBondContact CH2-O 3.48Å; W33-G75 WeakPolarHBondContact CZ2-O 3.36Å; W33-L76 VanDerWaalsContact CH2-N 3.33Å; W33-V79 HydrophobicContact CH2-CG2 4.15Å; W33-V79 HydrophobicContact CZ2-CG2 3.94Å
34	D	90.8	Very high	87.3	Confident	78 Å²	78	57 Å²	57	42%	0.417	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-38.6	178.1	-70.9	-29	0	0	0	111.5	N30 K37 N38	N30-D34 PolarHBondContact O-N 3.45Å; D34-K37 PolarHBondContact O-N 2.85Å; D34-N38 WeakPolarHBondContact O-CB 3.29Å; D34-N38 PolarHBondContact O-N 2.81Å; D34-N38 PolarHBondContact O-ND2 2.93Å; D34-N38 VanDerWaalsContact O-ND2 3.15Å
35	L	91.3	Very high	88.5	Confident	74 Å²	74	62.9 Å²	62.9	39%	0.387	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-44.9	174.9	-167.9	152.6	0	0	0	111.6	N31 I32 W33 A39 L56	N31-L35 WeakPolarHBondContact O-CB 3.44Å; N31-L35 PolarHBondContact O-N 3.47Å; N31-L35 VanDerWaalsContact O-N 3.14Å; I32-L35 PolarHBondContact O-N 3.48Å; W33-L35 VanDerWaalsContact C-N 3.28Å; W33-L35 PolarHBondContact O-N 3.32Å; L35-A39 WeakPolarHBondContact O-CB 3.17Å; L35-A39 PolarHBondContact O-N 3.43Å; L35-L56 HydrophobicContact CD2-CD2 3.4Å
36	L	91.6	Very high	89.2	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-41.8	175.8	-70.2	172.2	0	0	0	112.1	I32 W33 A39 I40 L56 N59 A60 M63 L72 I121	I32-L36 HydrophobicContact CG2-CD1 4.06Å; I32-L36 HydrophobicContact CG2-CG 4.46Å; I32-L36 WeakPolarHBondContact O-CG 3.49Å; I32-L36 PolarHBondContact O-N 2.98Å; W33-L36 HydrophobicContact CE3-CB 4.34Å; W33-L36 PolarHBondContact O-N 3.49Å; L36-A39 PolarHBondContact O-N 2.93Å; L36-I40 WeakPolarHBondContact O-CD1 3.37Å; L36-I40 VanDerWaalsContact O-CG1 3.26Å; L36-I40 WeakPolarHBondContact O-CG1 3.37Å; L36-I40 PolarHBondContact O-N 3.47Å; L36-L56 HydrophobicContact CD2-CB 4.26Å; L36-L56 HydrophobicContact CD2-CD2 4.02Å; L36-L56 WeakPolarHBondContact CD2-O 3.25Å; L36-N59 HydrophobicContact CD2-CB 4.34Å; L36-A60 HydrophobicContact CD1-CB 4.2Å; L36-A60 HydrophobicContact CD2-CB 4.36Å; L36-M63 HydrophobicContact CD1-SD 3.67Å; L36-L72 HydrophobicContact CD1-CD1 3.79Å; L36-I121 HydrophobicContact CD2-CG2 4.29Å
37	K	92.9	Very high	89.7	Confident	64 Å²	64	60.7 Å²	60.7	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-48.7	176	172.3	169.6	179.5	176.4	0	111.1	W33 D34 A39 I40 Q41 V79	W33-K37 HydrophobicContact CH2-CB 4.39Å; W33-K37 HydrophobicContact CZ2-CB 4.11Å; W33-K37 HydrophobicContact CZ2-CD 4.38Å; W33-K37 VanDerWaalsContact O-CB 3.28Å; W33-K37 WeakPolarHBondContact O-CB 3.32Å; W33-K37 PolarHBondContact O-N 2.77Å; D34-K37 PolarHBondContact O-N 2.85Å; K37-A39 VanDerWaalsContact C-N 3.34Å; K37-A39 PolarHBondContact O-N 3.47Å; K37-I40 PolarHBondContact O-N 3.07Å; K37-Q41 WeakPolarHBondContact O-CG 3.44Å; K37-Q41 PolarHBondContact O-N 3.37Å; K37-V79 HydrophobicContact CB-CG2 4.44Å; K37-V79 HydrophobicContact CD-CG2 3.89Å; K37-V79 HydrophobicContact CG-CG2 3.71Å
38	N	91.6	Very high	89.9	Confident	90 Å²	90	56.2 Å²	56.2	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-43	176.9	-71.4	-26.1	0	0	0	111.4	D34 I40 Q41 E42	D34-N38 WeakPolarHBondContact O-CB 3.29Å; D34-N38 PolarHBondContact O-N 2.81Å; D34-N38 PolarHBondContact O-ND2 2.93Å; D34-N38 VanDerWaalsContact O-ND2 3.15Å; N38-I40 PolarHBondContact O-N 3.46Å; N38-Q41 PolarHBondContact O-N 2.86Å; N38-E42 WeakPolarHBondContact O-CG 3.44Å; N38-E42 PolarHBondContact O-N 2.81Å
39	A	91.6	Very high	89.8	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.033	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-42.3	176.8	0	0	0	0	0	112.7	L35 L36 K37 Q41 E42 I43 L51 L56	L35-A39 WeakPolarHBondContact O-CB 3.17Å; L35-A39 PolarHBondContact O-N 3.43Å; L36-A39 PolarHBondContact O-N 2.93Å; K37-A39 VanDerWaalsContact C-N 3.34Å; K37-A39 PolarHBondContact O-N 3.47Å; A39-Q41 VanDerWaalsContact C-N 3.34Å; A39-Q41 PolarHBondContact O-N 3.04Å; A39-E42 PolarHBondContact O-N 2.98Å; A39-I43 VanDerWaalsContact O-CG1 3.28Å; A39-I43 WeakPolarHBondContact O-CG1 3.38Å; A39-I43 PolarHBondContact O-N 2.89Å; A39-L51 HydrophobicContact CB-CD1 4.31Å; A39-L51 HydrophobicContact CB-CD2 4.01Å; A39-L56 HydrophobicContact CB-CD1 3.67Å; A39-L56 HydrophobicContact CB-CD2 3.53Å; A39-L56 HydrophobicContact CB-CG 4.28Å
40	I	92.9	Very high	89.6	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-43.3	175.2	-68.9	161.7	0	0	0	110.6	L36 K37 N38 I43 Q44 L76 V79 I118	L36-I40 WeakPolarHBondContact O-CD1 3.37Å; L36-I40 VanDerWaalsContact O-CG1 3.26Å; L36-I40 WeakPolarHBondContact O-CG1 3.37Å; L36-I40 PolarHBondContact O-N 3.47Å; K37-I40 PolarHBondContact O-N 3.07Å; N38-I40 PolarHBondContact O-N 3.46Å; I40-I43 PolarHBondContact O-N 2.83Å; I40-Q44 WeakPolarHBondContact O-CG 3.43Å; I40-Q44 PolarHBondContact O-N 3.22Å; I40-L76 HydrophobicContact CD1-CD1 3.87Å; I40-L76 HydrophobicContact CG2-CD1 4.48Å; I40-V79 HydrophobicContact CB-CG1 4.34Å; I40-V79 HydrophobicContact CG2-CG1 3.72Å; I40-I118 HydrophobicContact CG1-CG1 4.42Å; I40-I118 HydrophobicContact CG2-CD1 3.88Å; I40-I118 HydrophobicContact CG2-CG1 4.36Å
41	Q	92.6	Very high	89.6	Confident	39 Å²	39	58 Å²	58	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-40.7	176.9	-71.7	179.7	-15.1	0	0	112.4	K37 N38 A39 Q44 R45 V79	K37-Q41 WeakPolarHBondContact O-CG 3.44Å; K37-Q41 PolarHBondContact O-N 3.37Å; N38-Q41 PolarHBondContact O-N 2.86Å; A39-Q41 VanDerWaalsContact C-N 3.34Å; A39-Q41 PolarHBondContact O-N 3.04Å; Q41-Q44 PolarHBondContact O-N 3.22Å; Q41-R45 WeakPolarHBondContact O-CB 3.35Å; Q41-R45 VanDerWaalsContact O-CG 3.29Å; Q41-R45 WeakPolarHBondContact O-CG 3.47Å; Q41-R45 PolarHBondContact O-N 2.85Å; Q41-V79 HydrophobicContact CG-CG1 3.89Å
42	E	92.1	Very high	89.8	Confident	49 Å²	49	55.7 Å²	55.7	23%	0.229	30%	0.302	C	S	.	.	H	α-helix	trans	-66.8	-37.2	176.2	-71	-56.1	115.9	0	0	111.8	N38 A39 R45 K46 N47 L51	N38-E42 WeakPolarHBondContact O-CG 3.44Å; N38-E42 PolarHBondContact O-N 2.81Å; A39-E42 PolarHBondContact O-N 2.98Å; E42-R45 CarbonylContact O-C 3.59Å; E42-R45 PolarHBondContact O-N 3.24Å; E42-R45 IonicContact OE1-CZ 3.62Å; E42-R45 IonicContact OE1-NH1 3.84Å; E42-R45 PolarHBondContact OE1-NH1 2.8Å; E42-K46 PolarHBondContact O-N 3.21Å; E42-N47 PolarHBondContact O-N 2.88Å; E42-N47 WeakPolarHBondContact OE2-CB 3.24Å; E42-N47 PolarHBondContact OE2-ND2 3.37Å; E42-L51 HydrophobicContact CB-CD1 4.32Å
43	I	92.1	Very high	89.8	Confident	2 Å²	2	59 Å²	59	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-46.2	171.8	-70.8	166.1	0	0	0	111.1	A39 I40 R45 K46 N48 L51 A114 M117 I118 I121	A39-I43 VanDerWaalsContact O-CG1 3.28Å; A39-I43 WeakPolarHBondContact O-CG1 3.38Å; A39-I43 PolarHBondContact O-N 2.89Å; I40-I43 PolarHBondContact O-N 2.83Å; I43-R45 VanDerWaalsContact C-N 3.26Å; I43-R45 PolarHBondContact O-N 2.79Å; I43-K46 PolarHBondContact O-N 3.3Å; I43-N48 HydrophobicContact CG1-CB 4.43Å; I43-L51 HydrophobicContact CD1-CD1 4.18Å; I43-L51 HydrophobicContact CG1-CD1 3.69Å; I43-A114 HydrophobicContact CG2-CB 4.03Å; I43-M117 HydrophobicContact CD1-CB 4.41Å; I43-M117 HydrophobicContact CG2-CB 4.06Å; I43-M117 HydrophobicContact CG2-CE 3.71Å; I43-M117 HydrophobicContact CG2-SD 4.31Å; I43-I118 HydrophobicContact CD1-CG1 4.41Å; I43-I118 HydrophobicContact CG2-CD1 4.5Å; I43-I118 HydrophobicContact CG2-CG1 4.21Å; I43-I121 HydrophobicContact CD1-CD1 3.41Å; I43-I121 VanDerWaalsContact CD1-CD1 3.41Å
44	Q	90.7	Very high	89.7	Confident	19 Å²	19	65.4 Å²	65.4	9%	0.089	35%	0.348	C	S	.	.	H	α-helix	trans	-64.2	-29.9	176.9	-73	173.2	-30.6	0	0	112.9	I40 Q41 K46	I40-Q44 WeakPolarHBondContact O-CG 3.43Å; I40-Q44 PolarHBondContact O-N 3.22Å; Q41-Q44 PolarHBondContact O-N 3.22Å; Q44-K46 PolarHBondContact O-N 2.94Å
45	R	90.1	Very high	89.6	Confident	156 Å²	156	66.1 Å²	66.1	59%	0.589	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	2.1	172.6	-69.7	172.3	-175.9	156.8	2.4	113.9	Q41 E42 I43 N47	Q41-R45 WeakPolarHBondContact O-CB 3.35Å; Q41-R45 VanDerWaalsContact O-CG 3.29Å; Q41-R45 WeakPolarHBondContact O-CG 3.47Å; Q41-R45 PolarHBondContact O-N 2.85Å; E42-R45 CarbonylContact O-C 3.59Å; E42-R45 PolarHBondContact O-N 3.24Å; E42-R45 IonicContact OE1-CZ 3.62Å; E42-R45 IonicContact OE1-NH1 3.84Å; E42-R45 PolarHBondContact OE1-NH1 2.8Å; I43-R45 VanDerWaalsContact C-N 3.26Å; I43-R45 PolarHBondContact O-N 2.79Å; R45-N47 PolarHBondContact O-N 3.34Å
46	K	89.4	Confident	89.6	Confident	123 Å²	123	62.9 Å²	62.9	54%	0.535	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	25.1	-174.5	-51.6	178.9	-178.7	-179.5	0	114.1	E42 I43 Q44 D110	E42-K46 PolarHBondContact O-N 3.21Å; I43-K46 PolarHBondContact O-N 3.3Å; Q44-K46 PolarHBondContact O-N 2.94Å; K46-D110 WeakPolarHBondContact CE-OD1 3.45Å; K46-D110 WeakPolarHBondContact CE-OD2 3.25Å; K46-D110 IonicContact NZ-OD1 3.81Å; K46-D110 PolarHBondContact NZ-OD1 3.4Å; K46-D110 IonicContact NZ-OD2 2.65Å; K46-D110 PolarHBondContact NZ-OD2 3.11Å
47	N	88.6	Confident	89.6	Confident	85 Å²	85	66.5 Å²	66.5	46%	0.455	35%	0.346	S	S	.	.			trans	-107.8	65.3	179	-170	24.4	0	0	0	110.9	E42 R45	E42-N47 PolarHBondContact O-N 2.88Å; E42-N47 WeakPolarHBondContact OE2-CB 3.24Å; E42-N47 PolarHBondContact OE2-ND2 3.37Å; R45-N47 PolarHBondContact O-N 3.34Å
48	N	84	Confident	89.5	Confident	59 Å²	59	71.1 Å²	71.1	32%	0.316	36%	0.361	S	S	.	.			trans	-100.6	-3.6	-171	58.3	3.9	0	0	0	114.8	I43 G50 L51 M117	I43-N48 HydrophobicContact CG1-CB 4.43Å; N48-G50 VanDerWaalsContact C-N 3.28Å; N48-G50 PolarHBondContact O-N 2.62Å; N48-L51 HydrophobicContact CB-CD1 4.34Å; N48-L51 PolarHBondContact O-N 3.2Å; N48-M117 PolarHBondContact ND2-SD 2.66Å
49	S	81.4	Confident	89.4	Confident	111 Å²	111	67.6 Å²	67.6	78%	0.776	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-21	-174.2	38.7	0	0	0	0	114.7
50	G	80	Confident	89.3	Confident	76 Å²	76	67.5 Å²	67.5	78%	0.784	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	2.3	177.4	0	0	0	0	0	115.4	N48	N48-G50 VanDerWaalsContact C-N 3.28Å; N48-G50 PolarHBondContact O-N 2.62Å
51	L	88.8	Confident	89.2	Confident	44 Å²	44	71.2 Å²	71.2	23%	0.23	36%	0.356	C	S	.	.			trans	-95.1	133	-172.3	-61.7	176.8	0	0	0	112.2	A39 E42 I43 N48 F53 L56	A39-L51 HydrophobicContact CB-CD1 4.31Å; A39-L51 HydrophobicContact CB-CD2 4.01Å; E42-L51 HydrophobicContact CB-CD1 4.32Å; I43-L51 HydrophobicContact CD1-CD1 4.18Å; I43-L51 HydrophobicContact CG1-CD1 3.69Å; N48-L51 HydrophobicContact CB-CD1 4.34Å; N48-L51 PolarHBondContact O-N 3.2Å; L51-F53 PolarHBondContact O-N 2.92Å; L51-L56 HydrophobicContact CB-CD1 4.09Å; L51-L56 HydrophobicContact CD2-CD1 4.5Å
52	S	91.6	Very high	89.1	Confident	55 Å²	55	70.9 Å²	70.9	39%	0.385	36%	0.357	S	S	.	.			trans	-89.4	98.9	170.1	178.5	0	0	0	0	110.6	E54 E55 L56	S52-E54 VanDerWaalsContact C-N 3.25Å; S52-E54 PolarHBondContact O-N 3.3Å; S52-E55 PolarHBondContact O-N 3.34Å; S52-E55 WeakPolarHBondContact OG-CB 3.47Å; S52-E55 PolarHBondContact OG-N 3.3Å; S52-L56 VanDerWaalsContact O-CG 3.28Å; S52-L56 WeakPolarHBondContact O-CG 3.37Å; S52-L56 PolarHBondContact O-N 2.95Å
53	F	89.4	Confident	88.9	Confident	77 Å²	77	68.6 Å²	68.6	34%	0.338	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-33.7	-179.5	-78.8	-95.7	0	0	0	113.2	L51 Y57 M117 I121	L51-F53 PolarHBondContact O-N 2.92Å; F53-Y57 VanDerWaalsContact O-CB 3.26Å; F53-Y57 WeakPolarHBondContact O-CB 3.29Å; F53-Y57 PolarHBondContact O-N 2.91Å; F53-M117 HydrophobicContact CE1-CB 4.12Å; F53-M117 HydrophobicContact CE1-CG 4.36Å; F53-M117 HydrophobicContact CZ-CB 4.46Å; F53-M117 HydrophobicContact CZ-CG 4.36Å; F53-M117 HydrophobicContact CZ-SD 4.09Å; F53-I121 HydrophobicContact CD1-CD1 3.89Å; F53-I121 HydrophobicContact CD1-CG1 3.61Å; F53-I121 HydrophobicContact CE1-CD1 3.81Å; F53-I121 HydrophobicContact CE1-CG1 3.97Å
54	E	89.6	Confident	88.7	Confident	162 Å²	162	69.1 Å²	69.1	76%	0.757	35%	0.35	S	S	*	.	H	α-helix	trans	-66.4	-43.8	176.4	-172.5	-171.9	169.4	0	0	111.6	S52 Y57 R58	S52-E54 VanDerWaalsContact C-N 3.25Å; S52-E54 PolarHBondContact O-N 3.3Å; E54-Y57 PolarHBondContact O-N 2.9Å; E54-R58 WeakPolarHBondContact O-CB 3.18Å; E54-R58 PolarHBondContact O-N 3.36Å
55	E	89.5	Confident	88.7	Confident	92 Å²	92	72.3 Å²	72.3	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-66	-44.8	178.4	-174.7	177.1	178.5	0	0	111.3	S52 Y57 R58 N59	S52-E55 PolarHBondContact O-N 3.34Å; S52-E55 WeakPolarHBondContact OG-CB 3.47Å; S52-E55 PolarHBondContact OG-N 3.3Å; E55-Y57 VanDerWaalsContact C-N 3.35Å; E55-Y57 PolarHBondContact O-N 3.42Å; E55-R58 PolarHBondContact O-N 3.13Å; E55-N59 WeakPolarHBondContact O-CB 3.33Å; E55-N59 VanDerWaalsContact O-CG 3.23Å; E55-N59 PolarHBondContact O-N 3.04Å; E55-N59 PolarHBondContact O-ND2 3.15Å
56	L	91.4	Very high	88.6	Confident	6 Å²	6	68.3 Å²	68.3	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-61.1	-43.3	176.3	-65.3	171	0	0	0	111.4	L35 L36 A39 L51 S52 N59 A60 I121	L35-L56 HydrophobicContact CD2-CD2 3.4Å; L36-L56 HydrophobicContact CD2-CB 4.26Å; L36-L56 HydrophobicContact CD2-CD2 4.02Å; L36-L56 WeakPolarHBondContact CD2-O 3.25Å; A39-L56 HydrophobicContact CB-CD1 3.67Å; A39-L56 HydrophobicContact CB-CD2 3.53Å; A39-L56 HydrophobicContact CB-CG 4.28Å; L51-L56 HydrophobicContact CB-CD1 4.09Å; L51-L56 HydrophobicContact CD2-CD1 4.5Å; S52-L56 VanDerWaalsContact O-CG 3.28Å; S52-L56 WeakPolarHBondContact O-CG 3.37Å; S52-L56 PolarHBondContact O-N 2.95Å; L56-N59 PolarHBondContact O-N 2.83Å; L56-A60 WeakPolarHBondContact O-CB 3.33Å; L56-A60 PolarHBondContact O-N 3.37Å; L56-I121 HydrophobicContact CB-CD1 4.44Å; L56-I121 HydrophobicContact CB-CG1 4.32Å; L56-I121 HydrophobicContact CB-CG2 3.77Å; L56-I121 HydrophobicContact CD1-CD1 3.93Å
57	Y	92.4	Very high	88.5	Confident	80 Å²	80	71.8 Å²	71.8	31%	0.314	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-45.4	174.5	172.9	-95.5	0	0	0	112	F53 E54 E55 N59 A60 Y61 I121 M123	F53-Y57 VanDerWaalsContact O-CB 3.26Å; F53-Y57 WeakPolarHBondContact O-CB 3.29Å; F53-Y57 PolarHBondContact O-N 2.91Å; E54-Y57 PolarHBondContact O-N 2.9Å; E55-Y57 VanDerWaalsContact C-N 3.35Å; E55-Y57 PolarHBondContact O-N 3.42Å; Y57-N59 VanDerWaalsContact C-N 3.29Å; Y57-N59 PolarHBondContact O-N 2.83Å; Y57-A60 PolarHBondContact O-N 3.5Å; Y57-Y61 VanDerWaalsContact O-CB 3.28Å; Y57-Y61 WeakPolarHBondContact O-CB 3.41Å; Y57-Y61 PolarHBondContact O-N 3.45Å; Y57-I121 WeakPolarHBondContact CD2-O 3.41Å; Y57-M123 HydrophobicContact CE2-CB 4.17Å
58	R	89.7	Confident	88.5	Confident	160 Å²	160	70.4 Å²	70.4	60%	0.604	36%	0.361	S	S	*	.	H	α-helix	trans	-62.4	-38.4	178.4	-171	178.2	70.7	179.3	-1	112	E54 E55 T62	E54-R58 WeakPolarHBondContact O-CB 3.18Å; E54-R58 PolarHBondContact O-N 3.36Å; E55-R58 PolarHBondContact O-N 3.13Å; R58-T62 WeakPolarHBondContact O-CB 3.45Å; R58-T62 PolarHBondContact O-N 3.06Å; R58-T62 PolarHBondContact O-OG1 2.95Å
59	N	90.5	Very high	88.6	Confident	16 Å²	16	67.8 Å²	67.8	9%	0.086	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-47.9	176.6	-78.1	-14.9	0	0	0	111.5	I32 L36 E55 L56 Y57 T62 M63	I32-N59 HydrophobicContact CG2-CB 3.76Å; L36-N59 HydrophobicContact CD2-CB 4.34Å; E55-N59 WeakPolarHBondContact O-CB 3.33Å; E55-N59 VanDerWaalsContact O-CG 3.23Å; E55-N59 PolarHBondContact O-N 3.04Å; E55-N59 PolarHBondContact O-ND2 3.15Å; L56-N59 PolarHBondContact O-N 2.83Å; Y57-N59 VanDerWaalsContact C-N 3.29Å; Y57-N59 PolarHBondContact O-N 2.83Å; N59-T62 PolarHBondContact O-N 3.44Å; N59-M63 PolarHBondContact O-N 3.32Å; N59-M63 VanDerWaalsContact O-N 3.12Å
60	A	89.5	Confident	89.1	Confident	3 Å²	3	68.9 Å²	68.9	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-42.6	174.2	0	0	0	0	0	112.4	L36 L56 Y57 T62 M63 V64 L72 L122	L36-A60 HydrophobicContact CD1-CB 4.2Å; L36-A60 HydrophobicContact CD2-CB 4.36Å; L56-A60 WeakPolarHBondContact O-CB 3.33Å; L56-A60 PolarHBondContact O-N 3.37Å; Y57-A60 PolarHBondContact O-N 3.5Å; A60-T62 VanDerWaalsContact C-N 3.32Å; A60-T62 PolarHBondContact O-N 2.99Å; A60-M63 PolarHBondContact O-N 2.93Å; A60-V64 WeakPolarHBondContact O-CG2 3.07Å; A60-V64 PolarHBondContact O-N 3.19Å; A60-V64 VanDerWaalsContact O-N 3.12Å; A60-L72 HydrophobicContact CB-CD2 4.31Å; A60-L122 HydrophobicContact CB-CD2 3.65Å
61	Y	90.8	Very high	89.5	Confident	81 Å²	81	69.1 Å²	69.1	32%	0.318	32%	0.32	S	S	.	.	H	α-helix	trans	-56	-46.5	174	173.6	-89.5	0	0	0	111.5	Y57 M63 V64 L65 Y124	Y57-Y61 VanDerWaalsContact O-CB 3.28Å; Y57-Y61 WeakPolarHBondContact O-CB 3.41Å; Y57-Y61 PolarHBondContact O-N 3.45Å; Y61-M63 PolarHBondContact O-N 2.65Å; Y61-V64 PolarHBondContact O-N 3.04Å; Y61-L65 HydrophobicContact CE1-CB 4.42Å; Y61-L65 HydrophobicContact CE1-CD2 3.84Å; Y61-L65 VanDerWaalsContact O-CB 3.29Å; Y61-L65 WeakPolarHBondContact O-CB 3.32Å; Y61-L65 PolarHBondContact O-N 3.47Å; Y61-Y124 AromaticContact CD2-CD1 3.47Å; Y61-Y124 HydrophobicContact CD2-CD1 3.47Å; Y61-Y124 VanDerWaalsContact CD2-CD1 3.47Å; Y61-Y124 AromaticContact CD2-CD2 3.61Å; Y61-Y124 HydrophobicContact CD2-CD2 3.61Å; Y61-Y124 AromaticContact CD2-CE1 3.66Å; Y61-Y124 HydrophobicContact CD2-CE1 3.66Å; Y61-Y124 AromaticContact CD2-CE2 3.8Å; Y61-Y124 HydrophobicContact CD2-CE2 3.8Å; Y61-Y124 AromaticContact CD2-CG 3.45Å; Y61-Y124 HydrophobicContact CD2-CG 3.45Å; Y61-Y124 VanDerWaalsContact CD2-CG 3.45Å; Y61-Y124 AromaticContact CD2-CZ 3.81Å; Y61-Y124 HydrophobicContact CE2-CD1 4Å; Y61-Y124 AromaticContact CE2-CD2 3.76Å; Y61-Y124 HydrophobicContact CE2-CD2 3.76Å; Y61-Y124 AromaticContact CE2-CE1 3.7Å; Y61-Y124 HydrophobicContact CE2-CE1 3.7Å; Y61-Y124 AromaticContact CE2-CE2 3.45Å; Y61-Y124 HydrophobicContact CE2-CE2 3.45Å; Y61-Y124 VanDerWaalsContact CE2-CE2 3.45Å; Y61-Y124 HydrophobicContact CE2-CG 4.02Å; Y61-Y124 AromaticContact CE2-CZ 3.41Å; Y61-Y124 VanDerWaalsContact CE2-CZ 3.41Å; Y61-Y124 HydrophobicContact CG-CD1 4.19Å; Y61-Y124 HydrophobicContact CG-CE1 4.44Å; Y61-Y124 HydrophobicContact CG-CG 4.41Å
62	T	89.3	Confident	89.7	Confident	33 Å²	33	67 Å²	67	20%	0.202	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-43.2	-179.8	-56.3	0	0	0	0	111.3	M24 R58 N59 A60 V64 L65 H66	M24-T62 HydrophobicContact CE-CG2 4.13Å; M24-T62 HydrophobicContact SD-CG2 4.04Å; R58-T62 WeakPolarHBondContact O-CB 3.45Å; R58-T62 PolarHBondContact O-N 3.06Å; R58-T62 PolarHBondContact O-OG1 2.95Å; N59-T62 PolarHBondContact O-N 3.44Å; A60-T62 VanDerWaalsContact C-N 3.32Å; A60-T62 PolarHBondContact O-N 2.99Å; T62-V64 PolarHBondContact O-N 3.4Å; T62-L65 PolarHBondContact O-N 2.97Å; T62-H66 PolarHBondContact O-CD2 2.98Å; T62-H66 VanDerWaalsContact O-CD2 3.3Å; T62-H66 PolarHBondContact O-N 3.33Å; T62-H66 VanDerWaalsContact O-N 3.13Å
63	M	88.1	Confident	89.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-44.5	176.6	-72.6	-172.6	73	0	0	112.5	V29 I32 W33 L36 N59 A60 Y61 H68 L72	V29-M63 HydrophobicContact CG1-CE 4Å; I32-M63 HydrophobicContact CB-CG 4.41Å; I32-M63 HydrophobicContact CB-SD 4.3Å; I32-M63 HydrophobicContact CG2-CG 3.76Å; I32-M63 HydrophobicContact CG2-SD 3.67Å; W33-M63 HydrophobicContact CB-CE 4.1Å; W33-M63 HydrophobicContact CB-SD 4.47Å; L36-M63 HydrophobicContact CD1-SD 3.67Å; N59-M63 PolarHBondContact O-N 3.32Å; N59-M63 VanDerWaalsContact O-N 3.12Å; A60-M63 PolarHBondContact O-N 2.93Å; Y61-M63 PolarHBondContact O-N 2.65Å; M63-H68 HydrophobicContact CE-CB 4.49Å; M63-H68 WeakPolarHBondContact O-CA 3.32Å; M63-H68 WeakPolarHBondContact O-CB 3.47Å; M63-H68 PolarHBondContact O-N 3.37Å; M63-L72 HydrophobicContact CB-CD2 4.37Å; M63-L72 HydrophobicContact CE-CB 4.25Å; M63-L72 HydrophobicContact CE-CD1 4.48Å; M63-L72 HydrophobicContact SD-CD1 4.15Å
64	V	88.5	Confident	90	Very high	13 Å²	13	64.5 Å²	64.5	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-70.2	-41.7	179.8	176.7	0	0	0	0	111.2	A60 Y61 T62 H66 K67 L72 Y124 M125 V128	A60-V64 WeakPolarHBondContact O-CG2 3.07Å; A60-V64 PolarHBondContact O-N 3.19Å; A60-V64 VanDerWaalsContact O-N 3.12Å; Y61-V64 PolarHBondContact O-N 3.04Å; T62-V64 PolarHBondContact O-N 3.4Å; V64-H66 VanDerWaalsContact C-N 3.26Å; V64-H66 PolarHBondContact O-N 3.45Å; V64-K67 PolarHBondContact O-N 3.19Å; V64-K67 VanDerWaalsContact O-N 3.11Å; V64-L72 HydrophobicContact CG2-CD2 3.85Å; V64-Y124 HydrophobicContact CB-CD1 3.8Å; V64-Y124 HydrophobicContact CB-CE1 4.07Å; V64-Y124 HydrophobicContact CG1-CD1 3.74Å; V64-Y124 HydrophobicContact CG1-CE1 3.78Å; V64-M125 HydrophobicContact CG2-CB 4.02Å; V64-M125 HydrophobicContact CG2-CG 4.2Å; V64-V128 HydrophobicContact CG1-CB 4.07Å; V64-V128 HydrophobicContact CG1-CG1 4.24Å
65	L	89.5	Confident	90.1	Very high	87 Å²	87	57 Å²	57	46%	0.455	26%	0.261	S	S	.	.	H	α-helix	trans	-58.2	-38.5	178.2	-177.3	68.4	0	0	0	112.1	Y61 T62 K67	Y61-L65 HydrophobicContact CE1-CB 4.42Å; Y61-L65 HydrophobicContact CE1-CD2 3.84Å; Y61-L65 VanDerWaalsContact O-CB 3.29Å; Y61-L65 WeakPolarHBondContact O-CB 3.32Å; Y61-L65 PolarHBondContact O-N 3.47Å; T62-L65 PolarHBondContact O-N 2.97Å; L65-K67 VanDerWaalsContact C-N 3.29Å; L65-K67 PolarHBondContact O-N 2.76Å
66	H	88.1	Confident	90.3	Very high	71 Å²	71	52.7 Å²	52.7	33%	0.329	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	24.9	179.1	-72.3	-79.7	0	0	0	113.9	M24 T62 V64 H68	M24-H66 HydrophobicContact CG-CB 4.09Å; M24-H66 HydrophobicContact SD-CB 3.43Å; M24-H66 WeakPolarHBondContact SD-CB 3.28Å; M24-H66 PolarHBondContact SD-CD2 3.4Å; T62-H66 PolarHBondContact O-CD2 2.98Å; T62-H66 VanDerWaalsContact O-CD2 3.3Å; T62-H66 PolarHBondContact O-N 3.33Å; T62-H66 VanDerWaalsContact O-N 3.13Å; V64-H66 VanDerWaalsContact C-N 3.26Å; V64-H66 PolarHBondContact O-N 3.45Å; H66-H68 VanDerWaalsContact C-N 3.32Å; H66-H68 PolarHBondContact O-CD2 3.42Å; H66-H68 PolarHBondContact O-N 2.92Å
67	K	87.5	Confident	90.5	Very high	196 Å²	196	59 Å²	59	85%	0.852	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	22.3	174.7	-55.2	-173.4	174.8	-174.1	0	115.9	V64 L65	V64-K67 PolarHBondContact O-N 3.19Å; V64-K67 VanDerWaalsContact O-N 3.11Å; L65-K67 VanDerWaalsContact C-N 3.29Å; L65-K67 PolarHBondContact O-N 2.76Å
68	H	88.7	Confident	90.6	Very high	57 Å²	57	61 Å²	61	26%	0.264	28%	0.277	S	S	.	.			trans	-97.6	25.4	173.5	-64.8	-72.4	0	0	0	113.5	V29 M63 H66 E70 K71 L72	V29-H68 HydrophobicContact CG1-CB 4.27Å; M63-H68 HydrophobicContact CE-CB 4.49Å; M63-H68 WeakPolarHBondContact O-CA 3.32Å; M63-H68 WeakPolarHBondContact O-CB 3.47Å; M63-H68 PolarHBondContact O-N 3.37Å; H66-H68 VanDerWaalsContact C-N 3.32Å; H66-H68 PolarHBondContact O-CD2 3.42Å; H66-H68 PolarHBondContact O-N 2.92Å; H68-E70 PolarHBondContact O-N 3.35Å; H68-K71 PolarHBondContact O-N 3.44Å; H68-L72 PolarHBondContact O-N 3.14Å
69	G	87.3	Confident	90.9	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-34.8	-178.6	0	0	0	0	0	114.4	L72 Y73 Y129	G69-L72 PolarHBondContact O-N 3.48Å; G69-Y73 WeakPolarHBondContact O-CB 3.47Å; G69-Y73 PolarHBondContact O-N 3.26Å; G69-Y129 VanDerWaalsContact C-CE2 3.47Å
70	E	90.7	Very high	91.1	Very high	134 Å²	134	53 Å²	53	63%	0.626	25%	0.246	S	C	*	.	H	α-helix	trans	-64.2	-44.2	178.8	-177.4	-177	-174.7	0	0	112.3	H68 L72 Y73 T74 Y129	H68-E70 PolarHBondContact O-N 3.35Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 2.87Å; E70-Y73 PolarHBondContact O-N 2.84Å; E70-T74 WeakPolarHBondContact O-CB 3.32Å; E70-T74 PolarHBondContact O-N 3.05Å; E70-T74 PolarHBondContact O-OG1 3.14Å; E70-Y129 VanDerWaalsContact CA-CZ 3.46Å; E70-Y129 VanDerWaalsContact CA-OH 3.23Å; E70-Y129 WeakPolarHBondContact CA-OH 3.47Å; E70-Y129 HydrophobicContact CB-CE2 4.01Å; E70-Y129 WeakPolarHBondContact CB-OH 3.49Å
71	K	89.7	Confident	91.4	Very high	82 Å²	82	54.2 Å²	54.2	36%	0.357	25%	0.254	S	S	.	.	H	α-helix	trans	-62.8	-41	176.5	-175.4	171.4	-178.4	168.4	0	111.5	V29 N30 H68 G75	V29-K71 HydrophobicContact CG1-CD 4.46Å; N30-K71 PolarHBondContact OD1-NZ 2.94Å; H68-K71 PolarHBondContact O-N 3.44Å; K71-G75 PolarHBondContact O-N 3.47Å
72	L	91.6	Very high	91.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-44.7	177.5	-177.5	60.6	0	0	0	111.8	W33 L36 A60 M63 V64 H68 G69 E70 L76 L122 M125	W33-L72 HydrophobicContact CE3-CD1 3.73Å; W33-L72 HydrophobicContact CZ3-CD1 3.65Å; L36-L72 HydrophobicContact CD1-CD1 3.79Å; A60-L72 HydrophobicContact CB-CD2 4.31Å; M63-L72 HydrophobicContact CB-CD2 4.37Å; M63-L72 HydrophobicContact CE-CB 4.25Å; M63-L72 HydrophobicContact CE-CD1 4.48Å; M63-L72 HydrophobicContact SD-CD1 4.15Å; V64-L72 HydrophobicContact CG2-CD2 3.85Å; H68-L72 PolarHBondContact O-N 3.14Å; G69-L72 PolarHBondContact O-N 3.48Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 2.87Å; L72-L76 VanDerWaalsContact O-CB 3.32Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 PolarHBondContact O-N 3.04Å; L72-L122 HydrophobicContact CD1-CD2 4.17Å; L72-L122 HydrophobicContact CD2-CD2 4.06Å; L72-L122 HydrophobicContact CG-CD2 4.32Å; L72-M125 HydrophobicContact CB-SD 4.23Å; L72-M125 HydrophobicContact CD2-SD 3.91Å; L72-M125 HydrophobicContact CG-SD 3.8Å
73	Y	93.8	Very high	91.9	Very high	19 Å²	19	55.3 Å²	55.3	8%	0.075	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-46.4	179.3	-170.8	-89.8	0	0	0	112.2	G69 E70 L76 R77 M125 Y129 V130 V135 E136 L141	G69-Y73 WeakPolarHBondContact O-CB 3.47Å; G69-Y73 PolarHBondContact O-N 3.26Å; E70-Y73 PolarHBondContact O-N 2.84Å; Y73-L76 PolarHBondContact O-N 2.95Å; Y73-R77 PolarHBondContact O-N 3.49Å; Y73-M125 HydrophobicContact CD2-CE 3.74Å; Y73-M125 HydrophobicContact CD2-SD 4.13Å; Y73-Y129 HydrophobicContact CD2-CD1 4.26Å; Y73-Y129 HydrophobicContact CD2-CE1 4.19Å; Y73-Y129 HydrophobicContact CG-CD1 4.37Å; Y73-Y129 AromaticContact CG-CE1 3.9Å; Y73-Y129 HydrophobicContact CG-CE1 3.9Å; Y73-V130 HydrophobicContact CD2-CG2 4.41Å; Y73-V130 HydrophobicContact CE2-CG2 4.16Å; Y73-V135 HydrophobicContact CD2-CG2 4.32Å; Y73-V135 HydrophobicContact CE1-CB 4.35Å; Y73-V135 HydrophobicContact CE1-CG2 4.32Å; Y73-V135 HydrophobicContact CE2-CB 4.49Å; Y73-V135 HydrophobicContact CE2-CG2 3.82Å; Y73-E136 WeakPolarHBondContact CE2-O 3.4Å; Y73-E136 PolarHBondContact OH-N 3.07Å; Y73-E136 PolarHBondContact OH-O 3.33Å; Y73-L141 HydrophobicContact CE1-CD2 4.05Å; Y73-L141 HydrophobicContact CE2-CD2 4.06Å
74	T	93	Very high	92.3	Very high	59 Å²	59	55.3 Å²	55.3	36%	0.362	26%	0.259	S	S	.	.	H	α-helix	trans	-66.9	-43.8	178.7	-52.3	0	0	0	0	110.9	E70 L76 R77 E78	E70-T74 WeakPolarHBondContact O-CB 3.32Å; E70-T74 PolarHBondContact O-N 3.05Å; E70-T74 PolarHBondContact O-OG1 3.14Å; T74-L76 PolarHBondContact O-N 3.49Å; T74-R77 WeakPolarHBondContact O-CB 3.49Å; T74-R77 PolarHBondContact O-N 3.15Å; T74-E78 WeakPolarHBondContact O-CG 3.25Å; T74-E78 PolarHBondContact O-N 3.2Å
75	G	92.6	Very high	92.6	Very high	5 Å²	5	57 Å²	57	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-42.3	175.5	0	0	0	0	0	112.5	W33 K71 R77 E78 V79	W33-G75 VanDerWaalsContact CH2-CA 3.47Å; W33-G75 WeakPolarHBondContact CH2-O 3.48Å; W33-G75 WeakPolarHBondContact CZ2-O 3.36Å; K71-G75 PolarHBondContact O-N 3.47Å; G75-R77 VanDerWaalsContact C-N 3.34Å; G75-R77 PolarHBondContact O-N 2.83Å; G75-E78 PolarHBondContact O-N 2.93Å; G75-V79 VanDerWaalsContact O-CG2 3.25Å; G75-V79 WeakPolarHBondContact O-CG2 3.21Å; G75-V79 PolarHBondContact O-N 3.29Å
76	L	94	Very high	92.8	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-58.1	-48.4	173.7	168.5	66.5	0	0	0	110.6	W33 I40 L72 Y73 T74 E78 V79 V80 I118 L122 M125 V138 L141	W33-L76 VanDerWaalsContact CH2-N 3.33Å; I40-L76 HydrophobicContact CD1-CD1 3.87Å; I40-L76 HydrophobicContact CG2-CD1 4.48Å; L72-L76 VanDerWaalsContact O-CB 3.32Å; L72-L76 WeakPolarHBondContact O-CB 3.38Å; L72-L76 PolarHBondContact O-N 3.04Å; Y73-L76 PolarHBondContact O-N 2.95Å; T74-L76 PolarHBondContact O-N 3.49Å; L76-E78 VanDerWaalsContact C-N 3.3Å; L76-E78 PolarHBondContact O-N 3.33Å; L76-V79 PolarHBondContact O-N 3.31Å; L76-V80 HydrophobicContact CD1-CG2 3.72Å; L76-V80 HydrophobicContact CG-CG2 4.39Å; L76-V80 WeakPolarHBondContact O-CB 3.33Å; L76-V80 WeakPolarHBondContact O-CG2 3.5Å; L76-V80 PolarHBondContact O-N 3Å; L76-I118 HydrophobicContact CD1-CG2 3.61Å; L76-I118 HydrophobicContact CD2-CG2 4.44Å; L76-L122 HydrophobicContact CD1-CD1 4.13Å; L76-L122 HydrophobicContact CD2-CD1 3.56Å; L76-L122 HydrophobicContact CG-CD1 4.25Å; L76-M125 HydrophobicContact CD2-CE 4.1Å; L76-V138 HydrophobicContact CD2-CB 4.34Å; L76-V138 HydrophobicContact CD2-CG1 3.71Å; L76-V138 HydrophobicContact CD2-CG2 3.93Å; L76-L141 HydrophobicContact CD2-CD2 4.33Å
77	R	95.2	Very high	93	Very high	139 Å²	139	59.3 Å²	59.3	53%	0.525	28%	0.278	S	S	.	.	H	α-helix	trans	-56.2	-46.1	178.6	-177.7	176.5	-179.9	169.3	0.9	111.3	Y73 T74 G75 T81 L141 I145	Y73-R77 PolarHBondContact O-N 3.49Å; T74-R77 WeakPolarHBondContact O-CB 3.49Å; T74-R77 PolarHBondContact O-N 3.15Å; G75-R77 VanDerWaalsContact C-N 3.34Å; G75-R77 PolarHBondContact O-N 2.83Å; R77-T81 WeakPolarHBondContact O-CB 3.42Å; R77-T81 PolarHBondContact O-N 3.16Å; R77-T81 PolarHBondContact O-OG1 3.4Å; R77-L141 HydrophobicContact CB-CD2 4.17Å; R77-L141 HydrophobicContact CG-CD1 4.29Å; R77-I145 HydrophobicContact CG-CD1 4.03Å
78	E	95	Very high	93.3	Very high	123 Å²	123	50.8 Å²	50.8	58%	0.575	24%	0.242	S	C	*	.	H	α-helix	trans	-62.4	-49.1	178.6	-72.8	172.5	-176.9	0	0	112	T74 G75 L76 V80 T81 E82	T74-E78 WeakPolarHBondContact O-CG 3.25Å; T74-E78 PolarHBondContact O-N 3.2Å; G75-E78 PolarHBondContact O-N 2.93Å; L76-E78 VanDerWaalsContact C-N 3.3Å; L76-E78 PolarHBondContact O-N 3.33Å; E78-V80 PolarHBondContact O-N 2.95Å; E78-T81 PolarHBondContact O-N 3.48Å; E78-E82 WeakPolarHBondContact O-CB 3.46Å; E78-E82 PolarHBondContact O-N 2.95Å
79	V	95.1	Very high	93.6	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-43.2	-178.4	175	0	0	0	0	111.5	W33 K37 I40 Q41 G75 L76 H83	W33-V79 HydrophobicContact CH2-CG2 4.15Å; W33-V79 HydrophobicContact CZ2-CG2 3.94Å; K37-V79 HydrophobicContact CB-CG2 4.44Å; K37-V79 HydrophobicContact CD-CG2 3.89Å; K37-V79 HydrophobicContact CG-CG2 3.71Å; I40-V79 HydrophobicContact CB-CG1 4.34Å; I40-V79 HydrophobicContact CG2-CG1 3.72Å; Q41-V79 HydrophobicContact CG-CG1 3.89Å; G75-V79 VanDerWaalsContact O-CG2 3.25Å; G75-V79 WeakPolarHBondContact O-CG2 3.21Å; G75-V79 PolarHBondContact O-N 3.29Å; L76-V79 PolarHBondContact O-N 3.31Å; V79-H83 PolarHBondContact O-N 3.26Å; V79-H83 VanDerWaalsContact O-N 3.14Å
80	V	95.4	Very high	93.9	Very high	2 Å²	2	53 Å²	53	1%	0.012	25%	0.25	C	S	.	.	H	α-helix	trans	-65.4	-42.7	175.9	175.9	0	0	0	0	111.2	L76 E78 H83 L84 M115 I145	L76-V80 HydrophobicContact CD1-CG2 3.72Å; L76-V80 HydrophobicContact CG-CG2 4.39Å; L76-V80 WeakPolarHBondContact O-CB 3.33Å; L76-V80 WeakPolarHBondContact O-CG2 3.5Å; L76-V80 PolarHBondContact O-N 3Å; E78-V80 PolarHBondContact O-N 2.95Å; V80-H83 PolarHBondContact O-N 2.98Å; V80-L84 HydrophobicContact CG1-CD1 3.9Å; V80-L84 HydrophobicContact CG1-CG 4.39Å; V80-L84 WeakPolarHBondContact O-CB 3.28Å; V80-L84 VanDerWaalsContact O-CG 3.29Å; V80-L84 WeakPolarHBondContact O-CG 3.49Å; V80-L84 PolarHBondContact O-N 3.34Å; V80-M115 HydrophobicContact CG1-SD 4.42Å; V80-M115 HydrophobicContact CG2-SD 4.23Å; V80-I145 HydrophobicContact CB-CD1 4.04Å; V80-I145 HydrophobicContact CG1-CB 4.46Å; V80-I145 HydrophobicContact CG1-CD1 3.85Å; V80-I145 HydrophobicContact CG1-CG2 4.4Å
81	T	96.4	Very high	94	Very high	30 Å²	30	49.5 Å²	49.5	18%	0.184	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-46.2	177.3	-60.1	0	0	0	0	111.4	R77 E78 H83 L84 I85 I145 Q149	R77-T81 WeakPolarHBondContact O-CB 3.42Å; R77-T81 PolarHBondContact O-N 3.16Å; R77-T81 PolarHBondContact O-OG1 3.4Å; E78-T81 PolarHBondContact O-N 3.48Å; T81-H83 PolarHBondContact O-N 2.92Å; T81-L84 PolarHBondContact O-N 3.32Å; T81-I85 HydrophobicContact CG2-CD1 3.54Å; T81-I85 HydrophobicContact CG2-CG1 4.22Å; T81-I85 WeakPolarHBondContact O-CB 3.46Å; T81-I85 VanDerWaalsContact O-CG1 3.25Å; T81-I85 WeakPolarHBondContact O-CG1 3.29Å; T81-I85 PolarHBondContact O-N 2.89Å; T81-I145 WeakPolarHBondContact OG1-CG2 3.26Å; T81-Q149 HydrophobicContact CG2-CG 4.34Å
82	E	94.9	Very high	94.3	Very high	93 Å²	93	45.6 Å²	45.6	44%	0.435	22%	0.219	S	C	.	.	H	α-helix	trans	-60.6	-44.9	-179.8	-171.1	-178.2	-178	0	0	111.7	E78 I85 N86	E78-E82 WeakPolarHBondContact O-CB 3.46Å; E78-E82 PolarHBondContact O-N 2.95Å; E82-I85 PolarHBondContact O-N 3.19Å; E82-N86 VanDerWaalsContact CG-ND2 3.29Å; E82-N86 WeakPolarHBondContact CG-ND2 3.42Å; E82-N86 VanDerWaalsContact O-CB 3.28Å; E82-N86 WeakPolarHBondContact O-CB 3.46Å; E82-N86 PolarHBondContact O-N 3.24Å; E82-N86 PolarHBondContact O-ND2 2.71Å
83	H	94.8	Very high	94.3	Very high	44 Å²	44	47.5 Å²	47.5	20%	0.204	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-45.3	176.2	177.1	69.7	0	0	0	112.3	V79 V80 T81 I85 K87 V88	V79-H83 PolarHBondContact O-N 3.26Å; V79-H83 VanDerWaalsContact O-N 3.14Å; V80-H83 PolarHBondContact O-N 2.98Å; T81-H83 PolarHBondContact O-N 2.92Å; H83-I85 VanDerWaalsContact C-N 3.34Å; H83-I85 PolarHBondContact O-N 3.37Å; H83-K87 WeakPolarHBondContact O-CB 3.23Å; H83-K87 PolarHBondContact O-N 3.35Å; H83-V88 PolarHBondContact O-N 3.45Å
84	L	95.6	Very high	94.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-65.6	-37.4	-179.7	-71.2	177.6	0	0	0	112.3	V80 T81 V88 R89 I145 F146 V150	V80-L84 HydrophobicContact CG1-CD1 3.9Å; V80-L84 HydrophobicContact CG1-CG 4.39Å; V80-L84 WeakPolarHBondContact O-CB 3.28Å; V80-L84 VanDerWaalsContact O-CG 3.29Å; V80-L84 WeakPolarHBondContact O-CG 3.49Å; V80-L84 PolarHBondContact O-N 3.34Å; T81-L84 PolarHBondContact O-N 3.32Å; L84-V88 HydrophobicContact CD2-CB 3.98Å; L84-V88 HydrophobicContact CD2-CG1 4.23Å; L84-V88 HydrophobicContact CD2-CG2 3.86Å; L84-R89 VanDerWaalsContact O-CB 3.24Å; L84-R89 WeakPolarHBondContact O-CB 3.38Å; L84-R89 PolarHBondContact O-N 3Å; L84-I145 HydrophobicContact CD1-CB 4.03Å; L84-I145 HydrophobicContact CD1-CG2 3.53Å; L84-F146 HydrophobicContact CD1-CB 4.27Å; L84-F146 HydrophobicContact CD1-CD2 4.49Å; L84-F146 HydrophobicContact CD2-CD2 3.8Å; L84-F146 HydrophobicContact CD2-CE2 4.35Å; L84-V150 HydrophobicContact CB-CG2 4.2Å; L84-V150 HydrophobicContact CD2-CG2 4.19Å
85	I	94.9	Very high	94.3	Very high	48 Å²	48	50.3 Å²	50.3	25%	0.246	24%	0.244	C	C	.	.	I	π-helix	trans	-73.1	-53	177.8	-67.3	176.8	0	0	0	111.3	T81 E82 H83 Q149	T81-I85 HydrophobicContact CG2-CD1 3.54Å; T81-I85 HydrophobicContact CG2-CG1 4.22Å; T81-I85 WeakPolarHBondContact O-CB 3.46Å; T81-I85 VanDerWaalsContact O-CG1 3.25Å; T81-I85 WeakPolarHBondContact O-CG1 3.29Å; T81-I85 PolarHBondContact O-N 2.89Å; E82-I85 PolarHBondContact O-N 3.19Å; H83-I85 VanDerWaalsContact C-N 3.34Å; H83-I85 PolarHBondContact O-N 3.37Å; I85-Q149 HydrophobicContact CG1-CB 4.34Å
86	N	93.4	Very high	94.2	Very high	103 Å²	103	51.4 Å²	51.4	55%	0.551	25%	0.248	S	C	*	.	I	π-helix	trans	-81.4	-20.2	-167.4	-66.4	-22.5	0	0	0	113.5	E82	E82-N86 VanDerWaalsContact CG-ND2 3.29Å; E82-N86 WeakPolarHBondContact CG-ND2 3.42Å; E82-N86 VanDerWaalsContact O-CB 3.28Å; E82-N86 WeakPolarHBondContact O-CB 3.46Å; E82-N86 PolarHBondContact O-N 3.24Å; E82-N86 PolarHBondContact O-ND2 2.71Å
87	K	93	Very high	93.8	Very high	104 Å²	104	59 Å²	59	45%	0.452	29%	0.289	S	S	.	.	I	π-helix	trans	-121.2	-62.5	-177.8	-173.8	53.6	179.7	148	0	113	H83 E90 D91	H83-K87 WeakPolarHBondContact O-CB 3.23Å; H83-K87 PolarHBondContact O-N 3.35Å; K87-E90 PolarHBondContact O-N 2.97Å; K87-D91 WeakPolarHBondContact CE-OD2 3.4Å; K87-D91 IonicContact NZ-OD1 2.76Å; K87-D91 PolarHBondContact NZ-OD1 3.05Å; K87-D91 IonicContact NZ-OD2 3.3Å; K87-D91 PolarHBondContact NZ-OD2 3.37Å; K87-D91 VanDerWaalsContact O-CG 3.3Å; K87-D91 PolarHBondContact O-N 3.49Å
88	V	94.8	Very high	93.4	Very high	16 Å²	16	57.8 Å²	57.8	10%	0.097	29%	0.293	C	S	.	.	I	π-helix	trans	-65.9	-47.2	-170.1	179.4	0	0	0	0	112	H83 L84 E90 D91 V92 A107 F146 V150	H83-V88 PolarHBondContact O-N 3.45Å; L84-V88 HydrophobicContact CD2-CB 3.98Å; L84-V88 HydrophobicContact CD2-CG1 4.23Å; L84-V88 HydrophobicContact CD2-CG2 3.86Å; V88-E90 PolarHBondContact O-N 2.84Å; V88-D91 PolarHBondContact O-N 3.26Å; V88-V92 WeakPolarHBondContact O-CG2 3.48Å; V88-V92 PolarHBondContact O-N 2.83Å; V88-A107 HydrophobicContact CG1-CB 3.76Å; V88-F146 HydrophobicContact CG1-CE2 4.2Å; V88-V150 HydrophobicContact CG1-CG1 4.38Å; V88-V150 HydrophobicContact CG1-CG2 4.19Å
89	R	94.9	Very high	93.1	Very high	18 Å²	18	56.4 Å²	56.4	7%	0.068	29%	0.29	C	S	.	.	I	π-helix	trans	-59	-47.4	177.5	174.8	-166.8	-69.9	177.7	-0.8	111.9	L84 D91 V92 L93 Q149 Y153 I156	L84-R89 VanDerWaalsContact O-CB 3.24Å; L84-R89 WeakPolarHBondContact O-CB 3.38Å; L84-R89 PolarHBondContact O-N 3Å; R89-D91 PolarHBondContact O-N 3.34Å; R89-V92 PolarHBondContact O-N 3.34Å; R89-L93 HydrophobicContact CG-CD1 4Å; R89-L93 HydrophobicContact CG-CG 4.38Å; R89-L93 WeakPolarHBondContact O-CG 3.34Å; R89-L93 PolarHBondContact O-N 3.12Å; R89-Q149 PolarHBondContact NE-O 3.46Å; R89-Q149 VanDerWaalsContact NH2-CA 3.32Å; R89-Q149 PolarHBondContact NH2-O 3.36Å; R89-Y153 HydrophobicContact CG-CD1 3.85Å; R89-Y153 HydrophobicContact CG-CE1 4.11Å; R89-Y153 HydrophobicContact CG-CG 4.34Å; R89-Y153 VanDerWaalsContact CZ-CE2 3.42Å; R89-I156 HydrophobicContact CG-CD1 4.47Å
90	E	93.7	Very high	93.1	Very high	88 Å²	88	56.7 Å²	56.7	41%	0.411	29%	0.291	S	S	.	.	H	α-helix	trans	-61.2	-43.5	179.7	-70.9	-62.3	138.7	0	0	111.7	K87 V88 V92 L93 N94	K87-E90 PolarHBondContact O-N 2.97Å; V88-E90 PolarHBondContact O-N 2.84Å; E90-V92 VanDerWaalsContact C-N 3.31Å; E90-V92 PolarHBondContact O-N 3.48Å; E90-L93 PolarHBondContact O-N 3.4Å; E90-N94 WeakPolarHBondContact O-CB 3.35Å; E90-N94 VanDerWaalsContact O-CG 3.25Å; E90-N94 PolarHBondContact O-N 2.87Å; E90-N94 PolarHBondContact O-ND2 2.92Å
91	D	92.7	Very high	93	Very high	62 Å²	62	57.8 Å²	57.8	33%	0.332	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-40	176.2	-69	-18.3	0	0	0	111.5	K87 V88 R89 S95	K87-D91 WeakPolarHBondContact CE-OD2 3.4Å; K87-D91 IonicContact NZ-OD1 2.76Å; K87-D91 PolarHBondContact NZ-OD1 3.05Å; K87-D91 IonicContact NZ-OD2 3.3Å; K87-D91 PolarHBondContact NZ-OD2 3.37Å; K87-D91 VanDerWaalsContact O-CG 3.3Å; K87-D91 PolarHBondContact O-N 3.49Å; V88-D91 PolarHBondContact O-N 3.26Å; R89-D91 PolarHBondContact O-N 3.34Å; D91-S95 PolarHBondContact O-N 3.29Å; D91-S95 PolarHBondContact O-OG 3.02Å
92	V	94.4	Very high	92.9	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.8	-43.8	175.3	174.6	0	0	0	0	111.5	V88 R89 E90 N94 S95 L96 F100 L104 V150 I156	V88-V92 WeakPolarHBondContact O-CG2 3.48Å; V88-V92 PolarHBondContact O-N 2.83Å; R89-V92 PolarHBondContact O-N 3.34Å; E90-V92 VanDerWaalsContact C-N 3.31Å; E90-V92 PolarHBondContact O-N 3.48Å; V92-N94 VanDerWaalsContact C-N 3.34Å; V92-N94 PolarHBondContact O-N 3.38Å; V92-S95 PolarHBondContact O-N 3.33Å; V92-S95 VanDerWaalsContact O-N 3.15Å; V92-S95 PolarHBondContact O-OG 3.38Å; V92-L96 PolarHBondContact O-N 3.42Å; V92-F100 HydrophobicContact CG1-CD2 4.22Å; V92-F100 HydrophobicContact CG1-CE2 3.6Å; V92-L104 HydrophobicContact CG1-CD1 4.25Å; V92-L104 HydrophobicContact CG2-CD1 4.09Å; V92-V150 HydrophobicContact CG2-CG1 4.2Å; V92-I156 HydrophobicContact CB-CD1 4.39Å; V92-I156 HydrophobicContact CG1-CD1 3.84Å; V92-I156 HydrophobicContact CG1-CG1 4.28Å; V92-I156 HydrophobicContact CG1-CG2 4.06Å
93	L	93.2	Very high	92.9	Very high	40 Å²	40	60.7 Å²	60.7	21%	0.209	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-41.8	176.8	-72.5	171.8	0	0	0	112.2	R89 E90 S95 L96 Y153 I156	R89-L93 HydrophobicContact CG-CD1 4Å; R89-L93 HydrophobicContact CG-CG 4.38Å; R89-L93 WeakPolarHBondContact O-CG 3.34Å; R89-L93 PolarHBondContact O-N 3.12Å; E90-L93 PolarHBondContact O-N 3.4Å; L93-S95 PolarHBondContact O-N 3.48Å; L93-L96 HydrophobicContact CD2-CD1 4.04Å; L93-L96 WeakPolarHBondContact O-CD1 3.29Å; L93-L96 VanDerWaalsContact O-CG 3.27Å; L93-L96 WeakPolarHBondContact O-CG 3.34Å; L93-L96 PolarHBondContact O-N 3.46Å; L93-Y153 HydrophobicContact CD1-CE1 4.01Å; L93-I156 HydrophobicContact CD2-CD1 3.82Å; L93-I156 HydrophobicContact CD2-CG1 3.71Å; L93-I156 HydrophobicContact CG-CD1 4.08Å; L93-I156 HydrophobicContact CG-CG1 4.48Å
94	N	92.9	Very high	93	Very high	128 Å²	128	58.7 Å²	58.7	68%	0.684	30%	0.302	S	S	*	.	H	α-helix	trans	-67	-21.5	178.6	-71.6	-39.4	0	0	0	113.1	E90 V92	E90-N94 WeakPolarHBondContact O-CB 3.35Å; E90-N94 VanDerWaalsContact O-CG 3.25Å; E90-N94 PolarHBondContact O-N 2.87Å; E90-N94 PolarHBondContact O-ND2 2.92Å; V92-N94 VanDerWaalsContact C-N 3.34Å; V92-N94 PolarHBondContact O-N 3.38Å
95	S	93.8	Very high	93	Very high	8 Å²	8	60.6 Å²	60.6	6%	0.056	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	0.4	-179.7	63.3	0	0	0	0	114.7	D91 V92 L93 N97 N98 F100 T103	D91-S95 PolarHBondContact O-N 3.29Å; D91-S95 PolarHBondContact O-OG 3.02Å; V92-S95 PolarHBondContact O-N 3.33Å; V92-S95 VanDerWaalsContact O-N 3.15Å; V92-S95 PolarHBondContact O-OG 3.38Å; L93-S95 PolarHBondContact O-N 3.48Å; S95-N97 PolarHBondContact O-N 3.01Å; S95-N97 VanDerWaalsContact O-N 3.1Å; S95-N98 WeakPolarHBondContact CB-O 3.49Å; S95-N98 CarbonylContact O-C 3.27Å; S95-N98 VanDerWaalsContact O-C 3.27Å; S95-N98 PolarHBondContact O-N 3.49Å; S95-F100 VanDerWaalsContact O-CA 3.32Å; S95-F100 WeakPolarHBondContact O-CA 3.39Å; S95-F100 VanDerWaalsContact O-CB 3.32Å; S95-F100 WeakPolarHBondContact O-CB 3.47Å; S95-F100 PolarHBondContact O-N 3.23Å; S95-T103 WeakPolarHBondContact OG-CB 3.31Å; S95-T103 WeakPolarHBondContact OG-CG2 3.29Å
96	L	90	Very high	93	Very high	28 Å²	28	63 Å²	63	15%	0.147	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-42.9	-176.7	-73.3	169.3	0	0	0	113	V92 L93 F100 H159	V92-L96 PolarHBondContact O-N 3.42Å; L93-L96 HydrophobicContact CD2-CD1 4.04Å; L93-L96 WeakPolarHBondContact O-CD1 3.29Å; L93-L96 VanDerWaalsContact O-CG 3.27Å; L93-L96 WeakPolarHBondContact O-CG 3.34Å; L93-L96 PolarHBondContact O-N 3.46Å; L96-F100 HydrophobicContact CD2-CD2 3.79Å; L96-F100 HydrophobicContact CD2-CE2 3.61Å; L96-F100 HydrophobicContact CD2-CZ 4.35Å; L96-H159 HydrophobicContact CD2-CB 4.04Å; L96-H159 PolarHBondContact O-NE2 3.1Å
97	N	85.3	Confident	93.1	Very high	161 Å²	161	58.8 Å²	58.8	86%	0.861	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-3.1	-178.1	-62.4	-44.1	0	0	0	114.3	S95	S95-N97 PolarHBondContact O-N 3.01Å; S95-N97 VanDerWaalsContact O-N 3.1Å
98	N	86.8	Confident	93.2	Very high	114 Å²	114	54.1 Å²	54.1	61%	0.61	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.6	119.6	-177.8	-164	6.1	0	0	0	112.1	S95 F100	S95-N98 WeakPolarHBondContact CB-O 3.49Å; S95-N98 CarbonylContact O-C 3.27Å; S95-N98 VanDerWaalsContact O-C 3.27Å; S95-N98 PolarHBondContact O-N 3.49Å; N98-F100 PolarHBondContact O-N 2.86Å
99	N	89.2	Confident	93.3	Very high	94 Å²	94	56.4 Å²	56.4	50%	0.503	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	23.3	-178.5	-56	-40.3	0	0	0	115.3	L101 Q102 T103	N99-L101 PolarHBondContact O-N 3.12Å; N99-Q102 HydrophobicContact CB-CB 4.45Å; N99-Q102 WeakPolarHBondContact O-CB 3.34Å; N99-Q102 PolarHBondContact O-N 3.36Å; N99-Q102 VanDerWaalsContact O-N 3.12Å; N99-T103 PolarHBondContact O-N 3.47Å; N99-T103 PolarHBondContact O-OG1 2.91Å
100	F	94.6	Very high	93.3	Very high	10 Å²	10	57.7 Å²	57.7	4%	0.044	30%	0.301	C	S	.	.	H	α-helix	trans	-47.2	-56.9	-178.1	174.5	-111.7	0	0	0	114.4	V92 S95 L96 N98 Q102 T103 L104 I156 H159 L160	V92-F100 HydrophobicContact CG1-CD2 4.22Å; V92-F100 HydrophobicContact CG1-CE2 3.6Å; S95-F100 VanDerWaalsContact O-CA 3.32Å; S95-F100 WeakPolarHBondContact O-CA 3.39Å; S95-F100 VanDerWaalsContact O-CB 3.32Å; S95-F100 WeakPolarHBondContact O-CB 3.47Å; S95-F100 PolarHBondContact O-N 3.23Å; L96-F100 HydrophobicContact CD2-CD2 3.79Å; L96-F100 HydrophobicContact CD2-CE2 3.61Å; L96-F100 HydrophobicContact CD2-CZ 4.35Å; N98-F100 PolarHBondContact O-N 2.86Å; F100-Q102 VanDerWaalsContact C-N 3.28Å; F100-Q102 PolarHBondContact O-N 3.35Å; F100-T103 PolarHBondContact O-N 2.92Å; F100-L104 HydrophobicContact CE1-CD2 4.25Å; F100-L104 HydrophobicContact CE2-CD2 4.48Å; F100-L104 HydrophobicContact CZ-CD2 3.88Å; F100-L104 WeakPolarHBondContact O-CB 3.34Å; F100-L104 PolarHBondContact O-N 3.44Å; F100-I156 HydrophobicContact CE2-CG2 4.13Å; F100-I156 HydrophobicContact CZ-CG2 3.98Å; F100-H159 AromaticContact CD1-CD2 3.79Å; F100-H159 AromaticContact CE1-CD2 3.9Å; F100-L160 HydrophobicContact CE1-CB 3.9Å; F100-L160 HydrophobicContact CE1-CD1 3.9Å; F100-L160 HydrophobicContact CZ-CB 4.06Å
101	L	94.2	Very high	93.4	Very high	25 Å²	25	54 Å²	54	13%	0.131	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-34.7	-177.5	-67.2	-178.9	0	0	0	112.3	N99 N105 L160 T163 L164 M167 A181	N99-L101 PolarHBondContact O-N 3.12Å; L101-N105 WeakPolarHBondContact O-CB 3.26Å; L101-N105 PolarHBondContact O-N 2.74Å; L101-L160 HydrophobicContact CD2-CD1 3.49Å; L101-L160 VanDerWaalsContact CD2-CD1 3.49Å; L101-T163 HydrophobicContact CD1-CG2 3.96Å; L101-T163 HydrophobicContact CD2-CG2 4.46Å; L101-T163 HydrophobicContact CG-CG2 4.13Å; L101-L164 HydrophobicContact CD1-CD2 4.3Å; L101-L164 HydrophobicContact CD2-CD2 4.35Å; L101-M167 HydrophobicContact CD1-SD 3.61Å; L101-A181 HydrophobicContact CB-CB 4.45Å; L101-A181 HydrophobicContact CD1-CB 3.98Å
102	Q	94.1	Very high	93.5	Very high	137 Å²	137	52.8 Å²	52.8	64%	0.64	28%	0.276	S	S	*	.	H	α-helix	trans	-68.8	-47.4	177.4	-174	-178.9	2.9	0	0	110.7	N99 F100 N105 Q106	N99-Q102 HydrophobicContact CB-CB 4.45Å; N99-Q102 WeakPolarHBondContact O-CB 3.34Å; N99-Q102 PolarHBondContact O-N 3.36Å; N99-Q102 VanDerWaalsContact O-N 3.12Å; F100-Q102 VanDerWaalsContact C-N 3.28Å; F100-Q102 PolarHBondContact O-N 3.35Å; Q102-N105 PolarHBondContact O-N 3.4Å; Q102-Q106 WeakPolarHBondContact O-CB 3.47Å; Q102-Q106 PolarHBondContact O-N 2.99Å
103	T	95.2	Very high	93.5	Very high	46 Å²	46	56.8 Å²	56.8	28%	0.282	30%	0.301	S	S	.	.	H	α-helix	trans	-63.1	-44.3	177.9	-63.5	0	0	0	0	111.2	S95 N99 F100 Q106 A107	S95-T103 WeakPolarHBondContact OG-CB 3.31Å; S95-T103 WeakPolarHBondContact OG-CG2 3.29Å; N99-T103 PolarHBondContact O-N 3.47Å; N99-T103 PolarHBondContact O-OG1 2.91Å; F100-T103 PolarHBondContact O-N 2.92Å; T103-Q106 PolarHBondContact O-N 3.44Å; T103-A107 WeakPolarHBondContact O-CB 3.31Å; T103-A107 PolarHBondContact O-N 3.28Å
104	L	95.9	Very high	93.6	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-44.1	177.4	-178.4	60.3	0	0	0	112	V92 F100 A107 W108 F146 V150 L160 M188	V92-L104 HydrophobicContact CG1-CD1 4.25Å; V92-L104 HydrophobicContact CG2-CD1 4.09Å; F100-L104 HydrophobicContact CE1-CD2 4.25Å; F100-L104 HydrophobicContact CE2-CD2 4.48Å; F100-L104 HydrophobicContact CZ-CD2 3.88Å; F100-L104 WeakPolarHBondContact O-CB 3.34Å; F100-L104 PolarHBondContact O-N 3.44Å; L104-A107 PolarHBondContact O-N 3.44Å; L104-W108 WeakPolarHBondContact O-CB 3.36Å; L104-W108 PolarHBondContact O-N 2.83Å; L104-F146 HydrophobicContact CD1-CZ 4.32Å; L104-V150 HydrophobicContact CD1-CG1 4.25Å; L104-L160 HydrophobicContact CD2-CD1 4.09Å; L104-L160 HydrophobicContact CD2-CD2 4.1Å; L104-M188 HydrophobicContact CD2-CE 4.01Å; L104-M188 HydrophobicContact CG-CE 4.36Å; L104-M188 HydrophobicContact CG-SD 4.35Å
105	N	95.5	Very high	93.7	Very high	39 Å²	39	49.2 Å²	49.2	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-40	177.5	-174.1	45.1	0	0	0	111.7	L101 Q102 W108 N109 N184	L101-N105 WeakPolarHBondContact O-CB 3.26Å; L101-N105 PolarHBondContact O-N 2.74Å; Q102-N105 PolarHBondContact O-N 3.4Å; N105-W108 PolarHBondContact O-N 3.23Å; N105-N109 VanDerWaalsContact O-CG 3.32Å; N105-N109 PolarHBondContact O-N 3.48Å; N105-N109 PolarHBondContact O-ND2 2.9Å; N105-N109 PolarHBondContact OD1-ND2 3.35Å; N105-N184 PolarHBondContact ND2-ND2 3.31Å
106	Q	95.1	Very high	93.7	Very high	98 Å²	98	51.2 Å²	51.2	46%	0.458	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-47.9	175.3	-174.4	60.5	53	0	0	111.1	Q102 T103 W108 N109 D110	Q102-Q106 WeakPolarHBondContact O-CB 3.47Å; Q102-Q106 PolarHBondContact O-N 2.99Å; T103-Q106 PolarHBondContact O-N 3.44Å; Q106-W108 VanDerWaalsContact C-N 3.28Å; Q106-W108 PolarHBondContact O-N 3.39Å; Q106-N109 PolarHBondContact O-N 3.02Å; Q106-D110 VanDerWaalsContact NE2-CG 3.34Å; Q106-D110 PolarHBondContact NE2-OD1 3.08Å; Q106-D110 PolarHBondContact NE2-OD2 2.85Å; Q106-D110 WeakPolarHBondContact O-CB 3.32Å; Q106-D110 PolarHBondContact O-N 2.9Å
107	A	95.3	Very high	93.9	Very high	16 Å²	16	51.5 Å²	51.5	13%	0.132	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-40.7	176.3	0	0	0	0	0	112.4	V88 T103 L104 H111	V88-A107 HydrophobicContact CG1-CB 3.76Å; T103-A107 WeakPolarHBondContact O-CB 3.31Å; T103-A107 PolarHBondContact O-N 3.28Å; L104-A107 PolarHBondContact O-N 3.44Å; A107-H111 VanDerWaalsContact O-CB 3.31Å; A107-H111 WeakPolarHBondContact O-CB 3.49Å; A107-H111 PolarHBondContact O-N 3.08Å
108	W	96.4	Very high	94.3	Very high	6 Å²	6	43.9 Å²	43.9	2%	0.023	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-50.4	175.7	170.6	-116.2	0	0	0	112.5	L104 N105 Q106 D110 H111 Q112 L143 F146 M188 I191 L192	L104-W108 WeakPolarHBondContact O-CB 3.36Å; L104-W108 PolarHBondContact O-N 2.83Å; N105-W108 PolarHBondContact O-N 3.23Å; Q106-W108 VanDerWaalsContact C-N 3.28Å; Q106-W108 PolarHBondContact O-N 3.39Å; W108-D110 VanDerWaalsContact C-N 3.3Å; W108-D110 PolarHBondContact O-N 2.86Å; W108-H111 PolarHBondContact O-N 3.12Å; W108-Q112 HydrophobicContact CD2-CG 3.98Å; W108-Q112 VanDerWaalsContact CE2-OE1 3.24Å; W108-Q112 HydrophobicContact CE3-CG 4.2Å; W108-Q112 HydrophobicContact CH2-CG 3.97Å; W108-Q112 HydrophobicContact CZ2-CG 3.67Å; W108-Q112 HydrophobicContact CZ3-CG 4.2Å; W108-Q112 WeakPolarHBondContact O-CG 3.42Å; W108-Q112 PolarHBondContact O-N 3.49Å; W108-L143 HydrophobicContact CH2-CD2 3.57Å; W108-L143 HydrophobicContact CZ3-CD2 3.84Å; W108-F146 HydrophobicContact CB-CE1 4.31Å; W108-F146 HydrophobicContact CB-CZ 3.98Å; W108-F146 HydrophobicContact CD2-CE1 4.39Å; W108-F146 AromaticContact CE3-CD1 3.61Å; W108-F146 HydrophobicContact CE3-CD1 3.61Å; W108-F146 HydrophobicContact CE3-CD2 4.42Å; W108-F146 AromaticContact CE3-CE1 3.6Å; W108-F146 HydrophobicContact CE3-CE1 3.6Å; W108-F146 HydrophobicContact CE3-CE2 4.41Å; W108-F146 HydrophobicContact CE3-CG 4.04Å; W108-F146 HydrophobicContact CE3-CZ 4.03Å; W108-F146 HydrophobicContact CZ3-CB 4.49Å; W108-F146 AromaticContact CZ3-CD1 3.88Å; W108-F146 HydrophobicContact CZ3-CD1 3.88Å; W108-F146 HydrophobicContact CZ3-CE1 4.33Å; W108-F146 HydrophobicContact CZ3-CG 4.18Å; W108-M188 HydrophobicContact CB-CG 4.48Å; W108-M188 HydrophobicContact CB-SD 3.94Å; W108-M188 HydrophobicContact CD2-CB 4.41Å; W108-M188 HydrophobicContact CD2-CG 3.64Å; W108-M188 HydrophobicContact CD2-SD 4.15Å; W108-M188 HydrophobicContact CE3-CG 4.18Å; W108-M188 HydrophobicContact CG-CB 4.29Å; W108-M188 HydrophobicContact CG-CG 3.76Å; W108-M188 HydrophobicContact CG-SD 3.86Å; W108-M188 HydrophobicContact CZ2-CG 4.25Å; W108-I191 HydrophobicContact CH2-CB 4.4Å; W108-I191 HydrophobicContact CH2-CG2 3.85Å; W108-I191 HydrophobicContact CZ2-CB 3.92Å; W108-I191 HydrophobicContact CZ2-CD1 4.2Å; W108-I191 HydrophobicContact CZ2-CG2 3.65Å; W108-L192 HydrophobicContact CE3-CD2 4.42Å; W108-L192 HydrophobicContact CH2-CD2 3.67Å; W108-L192 HydrophobicContact CH2-CG 4.15Å; W108-L192 HydrophobicContact CZ3-CD2 3.51Å; W108-L192 HydrophobicContact CZ3-CG 4.27Å
109	N	95.9	Very high	94.6	Very high	63 Å²	63	42.8 Å²	42.8	34%	0.337	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-39.6	179.2	-71.5	-46.8	0	0	0	112.1	N105 Q106 Q112 T113	N105-N109 VanDerWaalsContact O-CG 3.32Å; N105-N109 PolarHBondContact O-N 3.48Å; N105-N109 PolarHBondContact O-ND2 2.9Å; N105-N109 PolarHBondContact OD1-ND2 3.35Å; Q106-N109 PolarHBondContact O-N 3.02Å; N109-Q112 PolarHBondContact O-N 2.91Å; N109-T113 WeakPolarHBondContact O-CB 3.32Å; N109-T113 PolarHBondContact O-N 3.47Å; N109-T113 PolarHBondContact O-OG1 2.99Å
110	D	95	Very high	94.8	Very high	46 Å²	46	41.1 Å²	41.1	25%	0.246	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-45	176	-67.6	-25.7	0	0	0	111.2	K46 Q106 W108 T113 A114	K46-D110 WeakPolarHBondContact CE-OD1 3.45Å; K46-D110 WeakPolarHBondContact CE-OD2 3.25Å; K46-D110 IonicContact NZ-OD1 3.81Å; K46-D110 PolarHBondContact NZ-OD1 3.4Å; K46-D110 IonicContact NZ-OD2 2.65Å; K46-D110 PolarHBondContact NZ-OD2 3.11Å; Q106-D110 VanDerWaalsContact NE2-CG 3.34Å; Q106-D110 PolarHBondContact NE2-OD1 3.08Å; Q106-D110 PolarHBondContact NE2-OD2 2.85Å; Q106-D110 WeakPolarHBondContact O-CB 3.32Å; Q106-D110 PolarHBondContact O-N 2.9Å; W108-D110 VanDerWaalsContact C-N 3.3Å; W108-D110 PolarHBondContact O-N 2.86Å; D110-T113 PolarHBondContact O-N 3.28Å; D110-A114 WeakPolarHBondContact O-CB 3.23Å; D110-A114 PolarHBondContact O-N 2.87Å
111	H	95.9	Very high	94.7	Very high	9 Å²	9	41 Å²	41	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-43.7	177.5	-175.8	64.6	0	0	0	112.4	A107 W108 T113 A114 M115 G142 F146	A107-H111 VanDerWaalsContact O-CB 3.31Å; A107-H111 WeakPolarHBondContact O-CB 3.49Å; A107-H111 PolarHBondContact O-N 3.08Å; W108-H111 PolarHBondContact O-N 3.12Å; H111-T113 VanDerWaalsContact C-N 3.33Å; H111-T113 PolarHBondContact O-N 3.4Å; H111-A114 PolarHBondContact O-N 2.91Å; H111-M115 WeakPolarHBondContact O-CB 3.48Å; H111-M115 WeakPolarHBondContact O-CG 3.41Å; H111-M115 PolarHBondContact O-N 3.48Å; H111-G142 PolarHBondContact NE2-O 2.97Å; H111-F146 HydrophobicContact CB-CD2 3.95Å; H111-F146 HydrophobicContact CB-CE2 4.06Å; H111-F146 AromaticContact CD2-CD2 3.53Å; H111-F146 AromaticContact CD2-CG 3.84Å; H111-F146 AromaticContact CG-CD2 3.69Å
112	Q	95.2	Very high	94.7	Very high	37 Å²	37	39.8 Å²	39.8	17%	0.173	21%	0.206	C	C	.	.	H	α-helix	trans	-58.7	-46.4	175.1	-71.5	-168.8	-85.4	0	0	111.5	W108 N109 M115 V116 Y139	W108-Q112 HydrophobicContact CD2-CG 3.98Å; W108-Q112 VanDerWaalsContact CE2-OE1 3.24Å; W108-Q112 HydrophobicContact CE3-CG 4.2Å; W108-Q112 HydrophobicContact CH2-CG 3.97Å; W108-Q112 HydrophobicContact CZ2-CG 3.67Å; W108-Q112 HydrophobicContact CZ3-CG 4.2Å; W108-Q112 WeakPolarHBondContact O-CG 3.42Å; W108-Q112 PolarHBondContact O-N 3.49Å; N109-Q112 PolarHBondContact O-N 2.91Å; Q112-M115 PolarHBondContact O-N 2.88Å; Q112-V116 WeakPolarHBondContact O-CG2 3.27Å; Q112-V116 PolarHBondContact O-N 2.88Å; Q112-Y139 PolarHBondContact NE2-OH 3.47Å
113	T	94.4	Very high	94.6	Very high	85 Å²	85	36.6 Å²	36.6	52%	0.521	19%	0.191	S	C	.	.	H	α-helix	trans	-63	-43.7	179.4	-56	0	0	0	0	111.3	N109 D110 H111 V116 M117	N109-T113 WeakPolarHBondContact O-CB 3.32Å; N109-T113 PolarHBondContact O-N 3.47Å; N109-T113 PolarHBondContact O-OG1 2.99Å; D110-T113 PolarHBondContact O-N 3.28Å; H111-T113 VanDerWaalsContact C-N 3.33Å; H111-T113 PolarHBondContact O-N 3.4Å; T113-V116 PolarHBondContact O-N 3.33Å; T113-M117 HydrophobicContact CG2-CE 4.07Å; T113-M117 WeakPolarHBondContact O-CE 3.34Å; T113-M117 PolarHBondContact O-N 2.94Å
114	A	94.8	Very high	94.4	Very high	7 Å²	7	36.7 Å²	36.7	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-46.3	174.9	0	0	0	0	0	112.1	I43 D110 H111 V116 M117 I118	I43-A114 HydrophobicContact CG2-CB 4.03Å; D110-A114 WeakPolarHBondContact O-CB 3.23Å; D110-A114 PolarHBondContact O-N 2.87Å; H111-A114 PolarHBondContact O-N 2.91Å; A114-V116 PolarHBondContact O-N 3.43Å; A114-M117 PolarHBondContact O-N 2.99Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.43Å; A114-I118 PolarHBondContact O-N 3.4Å
115	M	95.4	Very high	94.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-67.9	-31.6	-177.9	-74	-54.3	-48.2	0	0	113.6	V80 H111 Q112 I118 R119 V138 Y139	V80-M115 HydrophobicContact CG1-SD 4.42Å; V80-M115 HydrophobicContact CG2-SD 4.23Å; H111-M115 WeakPolarHBondContact O-CB 3.48Å; H111-M115 WeakPolarHBondContact O-CG 3.41Å; H111-M115 PolarHBondContact O-N 3.48Å; Q112-M115 PolarHBondContact O-N 2.88Å; M115-I118 HydrophobicContact CE-CG2 4.45Å; M115-I118 PolarHBondContact O-N 3.11Å; M115-I118 HydrophobicContact SD-CD1 3.93Å; M115-R119 VanDerWaalsContact O-CB 3.27Å; M115-R119 WeakPolarHBondContact O-CB 3.21Å; M115-R119 PolarHBondContact O-N 3.05Å; M115-V138 HydrophobicContact CE-CG1 3.79Å; M115-V138 WeakPolarHBondContact CE-O 3.43Å; M115-Y139 HydrophobicContact CB-CD2 3.9Å; M115-Y139 HydrophobicContact CB-CE2 4.13Å
116	V	94.3	Very high	93.9	Very high	51 Å²	51	36.1 Å²	36.1	31%	0.309	18%	0.184	S	C	.	.	H	α-helix	trans	-61.3	-47.9	171.2	169.3	0	0	0	0	110.6	Q112 T113 A114 I118 R119 D120 Y139	Q112-V116 WeakPolarHBondContact O-CG2 3.27Å; Q112-V116 PolarHBondContact O-N 2.88Å; T113-V116 PolarHBondContact O-N 3.33Å; A114-V116 PolarHBondContact O-N 3.43Å; V116-I118 PolarHBondContact O-N 2.83Å; V116-R119 PolarHBondContact O-N 3.28Å; V116-D120 VanDerWaalsContact O-CG 3.23Å; V116-D120 PolarHBondContact O-N 3.09Å; V116-Y139 HydrophobicContact CG2-CD2 4.3Å; V116-Y139 HydrophobicContact CG2-CE2 3.84Å
117	M	92.8	Very high	93.6	Very high	34 Å²	34	38.5 Å²	38.5	17%	0.167	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-41.9	177.9	-72.5	-174.4	-81.2	0	0	112.4	I43 N48 F53 T113 A114 D120 I121	I43-M117 HydrophobicContact CD1-CB 4.41Å; I43-M117 HydrophobicContact CG2-CB 4.06Å; I43-M117 HydrophobicContact CG2-CE 3.71Å; I43-M117 HydrophobicContact CG2-SD 4.31Å; N48-M117 PolarHBondContact ND2-SD 2.66Å; F53-M117 HydrophobicContact CE1-CB 4.12Å; F53-M117 HydrophobicContact CE1-CG 4.36Å; F53-M117 HydrophobicContact CZ-CB 4.46Å; F53-M117 HydrophobicContact CZ-CG 4.36Å; F53-M117 HydrophobicContact CZ-SD 4.09Å; T113-M117 HydrophobicContact CG2-CE 4.07Å; T113-M117 WeakPolarHBondContact O-CE 3.34Å; T113-M117 PolarHBondContact O-N 2.94Å; A114-M117 PolarHBondContact O-N 2.99Å; M117-D120 PolarHBondContact O-N 3.41Å; M117-I121 WeakPolarHBondContact O-CG1 3.35Å; M117-I121 PolarHBondContact O-N 3.02Å; M117-I121 VanDerWaalsContact O-N 3.14Å
118	I	94.1	Very high	93.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-42.6	178.2	-66.7	163.2	0	0	0	110.9	I40 I43 L76 A114 M115 V116 D120 I121 L122 V138	I40-I118 HydrophobicContact CG1-CG1 4.42Å; I40-I118 HydrophobicContact CG2-CD1 3.88Å; I40-I118 HydrophobicContact CG2-CG1 4.36Å; I43-I118 HydrophobicContact CD1-CG1 4.41Å; I43-I118 HydrophobicContact CG2-CD1 4.5Å; I43-I118 HydrophobicContact CG2-CG1 4.21Å; L76-I118 HydrophobicContact CD1-CG2 3.61Å; L76-I118 HydrophobicContact CD2-CG2 4.44Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.43Å; A114-I118 PolarHBondContact O-N 3.4Å; M115-I118 HydrophobicContact CE-CG2 4.45Å; M115-I118 PolarHBondContact O-N 3.11Å; M115-I118 HydrophobicContact SD-CD1 3.93Å; V116-I118 PolarHBondContact O-N 2.83Å; I118-D120 VanDerWaalsContact C-N 3.3Å; I118-D120 PolarHBondContact O-N 2.95Å; I118-I121 PolarHBondContact O-N 2.92Å; I118-L122 HydrophobicContact CG2-CD1 3.83Å; I118-L122 HydrophobicContact CG2-CG 4.48Å; I118-L122 WeakPolarHBondContact O-CB 3.41Å; I118-L122 WeakPolarHBondContact O-CG 3.32Å; I118-L122 PolarHBondContact O-N 3.27Å; I118-V138 HydrophobicContact CG2-CG1 3.98Å
119	R	94	Very high	93.2	Very high	91 Å²	91	40.5 Å²	40.5	34%	0.343	20%	0.197	S	C	.	.	H	α-helix	trans	-58	-42.9	174	179.5	-152.7	65.3	-163	-1.9	111.3	M115 V116 I121 L122 M123 V138	M115-R119 VanDerWaalsContact O-CB 3.27Å; M115-R119 WeakPolarHBondContact O-CB 3.21Å; M115-R119 PolarHBondContact O-N 3.05Å; V116-R119 PolarHBondContact O-N 3.28Å; R119-I121 PolarHBondContact O-N 3.45Å; R119-L122 CarbonylContact O-C 3.49Å; R119-L122 VanDerWaalsContact O-C 3.29Å; R119-L122 PolarHBondContact O-N 2.84Å; R119-L122 VanDerWaalsContact O-N 3.15Å; R119-M123 WeakPolarHBondContact O-CA 3.48Å; R119-M123 PolarHBondContact O-N 3.38Å; R119-V138 HydrophobicContact CB-CB 4.49Å; R119-V138 HydrophobicContact CB-CG1 4.19Å
120	D	92.3	Very high	92.9	Very high	60 Å²	60	38 Å²	38	32%	0.321	18%	0.184	S	C	.	.	H	α-helix	trans	-66.3	-38.3	-178.4	-67.2	-14.2	0	0	0	112	V116 M117 I118 L122 M123	V116-D120 VanDerWaalsContact O-CG 3.23Å; V116-D120 PolarHBondContact O-N 3.09Å; M117-D120 PolarHBondContact O-N 3.41Å; I118-D120 VanDerWaalsContact C-N 3.3Å; I118-D120 PolarHBondContact O-N 2.95Å; D120-L122 VanDerWaalsContact C-N 3.33Å; D120-M123 WeakPolarHBondContact O-CB 3.38Å
121	I	93	Very high	92.5	Very high	6 Å²	6	43 Å²	43	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-40.5	171.6	-67.5	165.9	0	0	0	111	L36 I43 F53 L56 Y57 M117 I118 R119	L36-I121 HydrophobicContact CD2-CG2 4.29Å; I43-I121 HydrophobicContact CD1-CD1 3.41Å; I43-I121 VanDerWaalsContact CD1-CD1 3.41Å; F53-I121 HydrophobicContact CD1-CD1 3.89Å; F53-I121 HydrophobicContact CD1-CG1 3.61Å; F53-I121 HydrophobicContact CE1-CD1 3.81Å; F53-I121 HydrophobicContact CE1-CG1 3.97Å; L56-I121 HydrophobicContact CB-CD1 4.44Å; L56-I121 HydrophobicContact CB-CG1 4.32Å; L56-I121 HydrophobicContact CB-CG2 3.77Å; L56-I121 HydrophobicContact CD1-CD1 3.93Å; Y57-I121 WeakPolarHBondContact CD2-O 3.41Å; M117-I121 WeakPolarHBondContact O-CG1 3.35Å; M117-I121 PolarHBondContact O-N 3.02Å; M117-I121 VanDerWaalsContact O-N 3.14Å; I118-I121 PolarHBondContact O-N 2.92Å; R119-I121 PolarHBondContact O-N 3.45Å
122	L	93.4	Very high	92.2	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	18	-174.6	-59	179.3	0	0	0	113.5	A60 L72 L76 I118 R119 D120 Y124 M125 D126 V138	A60-L122 HydrophobicContact CB-CD2 3.65Å; L72-L122 HydrophobicContact CD1-CD2 4.17Å; L72-L122 HydrophobicContact CD2-CD2 4.06Å; L72-L122 HydrophobicContact CG-CD2 4.32Å; L76-L122 HydrophobicContact CD1-CD1 4.13Å; L76-L122 HydrophobicContact CD2-CD1 3.56Å; L76-L122 HydrophobicContact CG-CD1 4.25Å; I118-L122 HydrophobicContact CG2-CD1 3.83Å; I118-L122 HydrophobicContact CG2-CG 4.48Å; I118-L122 WeakPolarHBondContact O-CB 3.41Å; I118-L122 WeakPolarHBondContact O-CG 3.32Å; I118-L122 PolarHBondContact O-N 3.27Å; R119-L122 CarbonylContact O-C 3.49Å; R119-L122 VanDerWaalsContact O-C 3.29Å; R119-L122 PolarHBondContact O-N 2.84Å; R119-L122 VanDerWaalsContact O-N 3.15Å; D120-L122 VanDerWaalsContact C-N 3.33Å; L122-Y124 PolarHBondContact O-N 3.14Å; L122-Y124 VanDerWaalsContact O-N 3.07Å; L122-M125 HydrophobicContact CB-CB 4.39Å; L122-M125 HydrophobicContact CB-CE 4.26Å; L122-M125 HydrophobicContact CD1-CE 4.01Å; L122-M125 WeakPolarHBondContact O-CA 3.22Å; L122-M125 WeakPolarHBondContact O-CB 3.23Å; L122-M125 PolarHBondContact O-N 2.88Å; L122-D126 PolarHBondContact O-N 3.31Å; L122-V138 HydrophobicContact CB-CG2 4.1Å; L122-V138 HydrophobicContact CD1-CG1 4.38Å; L122-V138 HydrophobicContact CD1-CG2 4.28Å
123	M	92	Very high	91.9	Very high	69 Å²	69	51.6 Å²	51.6	34%	0.34	25%	0.248	S	C	.	.	H	α-helix	trans	-56.7	-33.3	-172.1	-176.9	-169	-56.2	0	0	113.3	Y57 R119 D120 M125 D126 R127	Y57-M123 HydrophobicContact CE2-CB 4.17Å; R119-M123 WeakPolarHBondContact O-CA 3.48Å; R119-M123 PolarHBondContact O-N 3.38Å; D120-M123 WeakPolarHBondContact O-CB 3.38Å; M123-M125 VanDerWaalsContact C-N 3.34Å; M123-D126 PolarHBondContact O-N 2.9Å; M123-R127 WeakPolarHBondContact O-CG 3.45Å; M123-R127 PolarHBondContact O-N 3.5Å; M123-R127 PolarHBondContact SD-NH2 3.38Å
124	Y	91.4	Very high	91.6	Very high	49 Å²	49	55 Å²	55	19%	0.192	26%	0.263	C	S	.	.	H	α-helix	trans	-71.1	-29.5	176.8	-169.1	-108.9	0	0	0	112.8	Y61 V64 L122 R127 V128	Y61-Y124 AromaticContact CD2-CD1 3.47Å; Y61-Y124 HydrophobicContact CD2-CD1 3.47Å; Y61-Y124 VanDerWaalsContact CD2-CD1 3.47Å; Y61-Y124 AromaticContact CD2-CD2 3.61Å; Y61-Y124 HydrophobicContact CD2-CD2 3.61Å; Y61-Y124 AromaticContact CD2-CE1 3.66Å; Y61-Y124 HydrophobicContact CD2-CE1 3.66Å; Y61-Y124 AromaticContact CD2-CE2 3.8Å; Y61-Y124 HydrophobicContact CD2-CE2 3.8Å; Y61-Y124 AromaticContact CD2-CG 3.45Å; Y61-Y124 HydrophobicContact CD2-CG 3.45Å; Y61-Y124 VanDerWaalsContact CD2-CG 3.45Å; Y61-Y124 AromaticContact CD2-CZ 3.81Å; Y61-Y124 HydrophobicContact CE2-CD1 4Å; Y61-Y124 AromaticContact CE2-CD2 3.76Å; Y61-Y124 HydrophobicContact CE2-CD2 3.76Å; Y61-Y124 AromaticContact CE2-CE1 3.7Å; Y61-Y124 HydrophobicContact CE2-CE1 3.7Å; Y61-Y124 AromaticContact CE2-CE2 3.45Å; Y61-Y124 HydrophobicContact CE2-CE2 3.45Å; Y61-Y124 VanDerWaalsContact CE2-CE2 3.45Å; Y61-Y124 HydrophobicContact CE2-CG 4.02Å; Y61-Y124 AromaticContact CE2-CZ 3.41Å; Y61-Y124 VanDerWaalsContact CE2-CZ 3.41Å; Y61-Y124 HydrophobicContact CG-CD1 4.19Å; Y61-Y124 HydrophobicContact CG-CE1 4.44Å; Y61-Y124 HydrophobicContact CG-CG 4.41Å; V64-Y124 HydrophobicContact CB-CD1 3.8Å; V64-Y124 HydrophobicContact CB-CE1 4.07Å; V64-Y124 HydrophobicContact CG1-CD1 3.74Å; V64-Y124 HydrophobicContact CG1-CE1 3.78Å; L122-Y124 PolarHBondContact O-N 3.14Å; L122-Y124 VanDerWaalsContact O-N 3.07Å; Y124-R127 PolarHBondContact O-N 3.19Å; Y124-V128 HydrophobicContact CD1-CG2 4.31Å; Y124-V128 HydrophobicContact CD2-CG2 4.13Å; Y124-V128 HydrophobicContact CE1-CB 4.47Å; Y124-V128 HydrophobicContact CE1-CG2 3.88Å; Y124-V128 HydrophobicContact CE2-CG2 3.65Å; Y124-V128 HydrophobicContact CG-CG2 4.44Å; Y124-V128 PolarHBondContact O-N 3.36Å
125	M	90.8	Very high	91.5	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-43.5	173.8	-168.5	175.8	69.6	0	0	111.1	V64 L72 Y73 L76 L122 M123 R127 V128 Y129 V130 V138	V64-M125 HydrophobicContact CG2-CB 4.02Å; V64-M125 HydrophobicContact CG2-CG 4.2Å; L72-M125 HydrophobicContact CB-SD 4.23Å; L72-M125 HydrophobicContact CD2-SD 3.91Å; L72-M125 HydrophobicContact CG-SD 3.8Å; Y73-M125 HydrophobicContact CD2-CE 3.74Å; Y73-M125 HydrophobicContact CD2-SD 4.13Å; L76-M125 HydrophobicContact CD2-CE 4.1Å; L122-M125 HydrophobicContact CB-CB 4.39Å; L122-M125 HydrophobicContact CB-CE 4.26Å; L122-M125 HydrophobicContact CD1-CE 4.01Å; L122-M125 WeakPolarHBondContact O-CA 3.22Å; L122-M125 WeakPolarHBondContact O-CB 3.23Å; L122-M125 PolarHBondContact O-N 2.88Å; M123-M125 VanDerWaalsContact C-N 3.34Å; M125-R127 VanDerWaalsContact C-N 3.3Å; M125-R127 PolarHBondContact O-N 2.98Å; M125-V128 PolarHBondContact O-N 2.98Å; M125-Y129 HydrophobicContact CG-CD1 4.29Å; M125-Y129 HydrophobicContact CG-CG 4.41Å; M125-Y129 PolarHBondContact O-N 3.4Å; M125-V130 PolarHBondContact O-N 3.35Å; M125-V138 HydrophobicContact CE-CG2 3.12Å
126	D	90.4	Very high	91.3	Very high	28 Å²	28	61 Å²	61	15%	0.15	29%	0.294	C	S	.	.	I	π-helix	trans	-61.3	-37.7	175.2	-81.8	-19.1	0	0	0	112.3	L122 M123 N137 V138	L122-D126 PolarHBondContact O-N 3.31Å; M123-D126 PolarHBondContact O-N 2.9Å; D126-N137 WeakPolarHBondContact OD1-CA 3.47Å; D126-N137 WeakPolarHBondContact OD1-CB 3.27Å; D126-V138 WeakPolarHBondContact OD1-CG2 3.34Å; D126-V138 PolarHBondContact OD1-N 3.02Å
127	R	89.7	Confident	91.3	Very high	148 Å²	148	61 Å²	61	56%	0.558	29%	0.292	S	S	*	.	I	π-helix	trans	-75	-32.3	-179.2	-70.1	-179.6	-174.7	-173.1	3.5	113.9	M123 Y124 M125 Q131	M123-R127 WeakPolarHBondContact O-CG 3.45Å; M123-R127 PolarHBondContact O-N 3.5Å; M123-R127 PolarHBondContact SD-NH2 3.38Å; Y124-R127 PolarHBondContact O-N 3.19Å; M125-R127 VanDerWaalsContact C-N 3.3Å; M125-R127 PolarHBondContact O-N 2.98Å; R127-Q131 VanDerWaalsContact O-CD 3.28Å; R127-Q131 PolarHBondContact O-OE1 3.35Å; R127-Q131 VanDerWaalsContact O-OE1 3.13Å
128	V	91	Very high	91.3	Very high	34 Å²	34	59.4 Å²	59.4	21%	0.206	28%	0.284	C	S	.	.	I	π-helix	trans	-112.8	-63.8	-170.9	-177.3	0	0	0	0	111.4	V64 Y124 M125 Q132	V64-V128 HydrophobicContact CG1-CB 4.07Å; V64-V128 HydrophobicContact CG1-CG1 4.24Å; Y124-V128 HydrophobicContact CD1-CG2 4.31Å; Y124-V128 HydrophobicContact CD2-CG2 4.13Å; Y124-V128 HydrophobicContact CE1-CB 4.47Å; Y124-V128 HydrophobicContact CE1-CG2 3.88Å; Y124-V128 HydrophobicContact CE2-CG2 3.65Å; Y124-V128 HydrophobicContact CG-CG2 4.44Å; Y124-V128 PolarHBondContact O-N 3.36Å; M125-V128 PolarHBondContact O-N 2.98Å; V128-Q132 VanDerWaalsContact O-CB 3.31Å; V128-Q132 WeakPolarHBondContact O-CB 3.05Å; V128-Q132 WeakPolarHBondContact O-CG 3.48Å; V128-Q132 PolarHBondContact O-N 3.28Å
129	Y	90.6	Very high	91.3	Very high	30 Å²	30	61.7 Å²	61.7	12%	0.118	29%	0.293	C	S	.	.	I	π-helix	trans	-69.4	-46.3	-171.4	179.7	-95.4	0	0	0	112.2	G69 E70 Y73 M125 Q131 Q132 N133 V135	G69-Y129 VanDerWaalsContact C-CE2 3.47Å; E70-Y129 VanDerWaalsContact CA-CZ 3.46Å; E70-Y129 VanDerWaalsContact CA-OH 3.23Å; E70-Y129 WeakPolarHBondContact CA-OH 3.47Å; E70-Y129 HydrophobicContact CB-CE2 4.01Å; E70-Y129 WeakPolarHBondContact CB-OH 3.49Å; Y73-Y129 HydrophobicContact CD2-CD1 4.26Å; Y73-Y129 HydrophobicContact CD2-CE1 4.19Å; Y73-Y129 HydrophobicContact CG-CD1 4.37Å; Y73-Y129 AromaticContact CG-CE1 3.9Å; Y73-Y129 HydrophobicContact CG-CE1 3.9Å; M125-Y129 HydrophobicContact CG-CD1 4.29Å; M125-Y129 HydrophobicContact CG-CG 4.41Å; M125-Y129 PolarHBondContact O-N 3.4Å; Y129-Q131 PolarHBondContact O-N 2.91Å; Y129-Q132 PolarHBondContact O-N 2.9Å; Y129-N133 WeakPolarHBondContact CD2-ND2 3.32Å; Y129-N133 HydrophobicContact CE1-CB 4.49Å; Y129-N133 WeakPolarHBondContact CE2-ND2 3.38Å; Y129-N133 WeakPolarHBondContact O-CB 3.26Å; Y129-N133 PolarHBondContact O-N 3.28Å; Y129-N133 PolarHBondContact O-ND2 3.43Å; Y129-V135 HydrophobicContact CD1-CG2 4.4Å; Y129-V135 HydrophobicContact CE1-CG2 4.15Å
130	V	90	Very high	91.3	Very high	12 Å²	12	58.6 Å²	58.6	7%	0.073	28%	0.284	C	S	.	.	I	π-helix	trans	-61.2	-45.6	-178.3	172.1	0	0	0	0	110.9	Y73 M125 N134 V135 N137	Y73-V130 HydrophobicContact CD2-CG2 4.41Å; Y73-V130 HydrophobicContact CE2-CG2 4.16Å; M125-V130 PolarHBondContact O-N 3.35Å; V130-N134 PolarHBondContact O-N 3.4Å; V130-V135 HydrophobicContact CB-CG2 4.28Å; V130-V135 HydrophobicContact CG1-CG2 4.34Å; V130-V135 WeakPolarHBondContact CG1-O 3.17Å; V130-V135 HydrophobicContact CG2-CG2 4.15Å; V130-V135 PolarHBondContact O-N 2.97Å; V130-N137 HydrophobicContact CG1-CB 4.26Å
131	Q	87.3	Confident	91.4	Very high	151 Å²	151	56.2 Å²	56.2	71%	0.706	27%	0.271	S	S	*	.	H	α-helix	trans	-65.5	-41	176.9	-66.4	-172.7	-3.3	0	0	113	R127 Y129	R127-Q131 VanDerWaalsContact O-CD 3.28Å; R127-Q131 PolarHBondContact O-OE1 3.35Å; R127-Q131 VanDerWaalsContact O-OE1 3.13Å; Y129-Q131 PolarHBondContact O-N 2.91Å
132	Q	89.6	Confident	91.5	Very high	146 Å²	146	56 Å²	56	68%	0.682	27%	0.27	S	S	*	.	H	α-helix	trans	-70	-32.6	-178.6	-76	173.1	-1.1	0	0	113.3	V128 Y129	V128-Q132 VanDerWaalsContact O-CB 3.31Å; V128-Q132 WeakPolarHBondContact O-CB 3.05Å; V128-Q132 WeakPolarHBondContact O-CG 3.48Å; V128-Q132 PolarHBondContact O-N 3.28Å; Y129-Q132 PolarHBondContact O-N 2.9Å
133	N	89.4	Confident	91.6	Very high	80 Å²	80	56.1 Å²	56.1	43%	0.428	27%	0.271	S	S	.	.	H	α-helix	trans	-104.5	0.7	-174.5	-64.1	-85.4	0	0	0	113.3	Y129 V135	Y129-N133 WeakPolarHBondContact CD2-ND2 3.32Å; Y129-N133 HydrophobicContact CE1-CB 4.49Å; Y129-N133 WeakPolarHBondContact CE2-ND2 3.38Å; Y129-N133 WeakPolarHBondContact O-CB 3.26Å; Y129-N133 PolarHBondContact O-N 3.28Å; Y129-N133 PolarHBondContact O-ND2 3.43Å; N133-V135 VanDerWaalsContact C-N 3.27Å; N133-V135 HydrophobicContact CB-CG1 4.32Å; N133-V135 PolarHBondContact O-N 2.88Å
134	N	88.1	Confident	91.7	Very high	156 Å²	156	54.3 Å²	54.3	83%	0.834	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	44.9	-179.5	-164.3	54.9	0	0	0	112.9	V130	V130-N134 PolarHBondContact O-N 3.4Å
135	V	91.3	Very high	92	Very high	54 Å²	54	52.3 Å²	52.3	33%	0.327	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-103.4	169.4	174.7	-64.3	0	0	0	0	110.2	Y73 Y129 V130 N133	Y73-V135 HydrophobicContact CD2-CG2 4.32Å; Y73-V135 HydrophobicContact CE1-CB 4.35Å; Y73-V135 HydrophobicContact CE1-CG2 4.32Å; Y73-V135 HydrophobicContact CE2-CB 4.49Å; Y73-V135 HydrophobicContact CE2-CG2 3.82Å; Y129-V135 HydrophobicContact CD1-CG2 4.4Å; Y129-V135 HydrophobicContact CE1-CG2 4.15Å; V130-V135 HydrophobicContact CB-CG2 4.28Å; V130-V135 HydrophobicContact CG1-CG2 4.34Å; V130-V135 WeakPolarHBondContact CG1-O 3.17Å; V130-V135 HydrophobicContact CG2-CG2 4.15Å; V130-V135 PolarHBondContact O-N 2.97Å; N133-V135 VanDerWaalsContact C-N 3.27Å; N133-V135 HydrophobicContact CB-CG1 4.32Å; N133-V135 PolarHBondContact O-N 2.88Å
136	E	91.8	Very high	92.3	Very high	80 Å²	80	52.2 Å²	52.2	37%	0.374	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-68.7	144.2	178	-70	-65	161.7	0	0	111.7	Y73 N140 I144	Y73-E136 WeakPolarHBondContact CE2-O 3.4Å; Y73-E136 PolarHBondContact OH-N 3.07Å; Y73-E136 PolarHBondContact OH-O 3.33Å; E136-N140 HydrophobicContact CB-CB 4.3Å; E136-N140 PolarHBondContact OE2-ND2 3.43Å; E136-N140 VanDerWaalsContact OE2-ND2 3.16Å; E136-I144 HydrophobicContact CB-CD1 4.39Å; E136-I144 HydrophobicContact CG-CD1 3.75Å
137	N	93.8	Very high	92.5	Very high	52 Å²	52	53.2 Å²	53.2	28%	0.278	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-63.1	160	173	72.9	57.1	0	0	0	111.1	D126 V130 Y139 N140 L141	D126-N137 WeakPolarHBondContact OD1-CA 3.47Å; D126-N137 WeakPolarHBondContact OD1-CB 3.27Å; V130-N137 HydrophobicContact CG1-CB 4.26Å; N137-Y139 VanDerWaalsContact C-N 3.28Å; N137-Y139 PolarHBondContact O-N 3.44Å; N137-Y139 PolarHBondContact OD1-N 2.92Å; N137-Y139 VanDerWaalsContact OD1-N 3.1Å; N137-N140 VanDerWaalsContact ND2-CG 3.28Å; N137-N140 PolarHBondContact ND2-ND2 3.06Å; N137-N140 VanDerWaalsContact ND2-ND2 3.16Å; N137-N140 PolarHBondContact O-N 2.96Å; N137-N140 WeakPolarHBondContact OD1-CB 3.41Å; N137-N140 PolarHBondContact OD1-N 2.66Å; N137-N140 PolarHBondContact OD1-OD1 2.82Å; N137-L141 WeakPolarHBondContact O-CB 3.27Å; N137-L141 PolarHBondContact O-N 3.31Å
138	V	93.5	Very high	92.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-54.9	-43.2	-174.4	169.2	0	0	0	0	112.6	L76 M115 I118 R119 L122 M125 D126 G142	L76-V138 HydrophobicContact CD2-CB 4.34Å; L76-V138 HydrophobicContact CD2-CG1 3.71Å; L76-V138 HydrophobicContact CD2-CG2 3.93Å; M115-V138 HydrophobicContact CE-CG1 3.79Å; M115-V138 WeakPolarHBondContact CE-O 3.43Å; I118-V138 HydrophobicContact CG2-CG1 3.98Å; R119-V138 HydrophobicContact CB-CB 4.49Å; R119-V138 HydrophobicContact CB-CG1 4.19Å; L122-V138 HydrophobicContact CB-CG2 4.1Å; L122-V138 HydrophobicContact CD1-CG1 4.38Å; L122-V138 HydrophobicContact CD1-CG2 4.28Å; M125-V138 HydrophobicContact CE-CG2 3.12Å; D126-V138 WeakPolarHBondContact OD1-CG2 3.34Å; D126-V138 PolarHBondContact OD1-N 3.02Å; V138-G142 PolarHBondContact O-N 2.88Å; V138-G142 VanDerWaalsContact O-N 3.12Å
139	Y	94.4	Very high	93	Very high	47 Å²	47	50.3 Å²	50.3	18%	0.184	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-49.7	-178.3	-174.5	-99	0	0	0	111.2	Q112 M115 V116 N137 L141 G142 L143	Q112-Y139 PolarHBondContact NE2-OH 3.47Å; M115-Y139 HydrophobicContact CB-CD2 3.9Å; M115-Y139 HydrophobicContact CB-CE2 4.13Å; V116-Y139 HydrophobicContact CG2-CD2 4.3Å; V116-Y139 HydrophobicContact CG2-CE2 3.84Å; N137-Y139 VanDerWaalsContact C-N 3.28Å; N137-Y139 PolarHBondContact O-N 3.44Å; N137-Y139 PolarHBondContact OD1-N 2.92Å; N137-Y139 VanDerWaalsContact OD1-N 3.1Å; Y139-L141 VanDerWaalsContact C-N 3.33Å; Y139-L141 PolarHBondContact O-N 3.35Å; Y139-G142 WeakPolarHBondContact O-CA 3.28Å; Y139-G142 PolarHBondContact O-N 2.98Å; Y139-G142 VanDerWaalsContact O-N 3.08Å; Y139-L143 HydrophobicContact CD1-CD1 4.14Å; Y139-L143 HydrophobicContact CD1-CG 4.3Å; Y139-L143 HydrophobicContact CE1-CD1 3.7Å; Y139-L143 HydrophobicContact CE1-CD2 4.18Å; Y139-L143 HydrophobicContact CE1-CG 4.08Å; Y139-L143 WeakPolarHBondContact O-CG 3.4Å; Y139-L143 PolarHBondContact O-N 2.94Å; Y139-L143 VanDerWaalsContact O-N 3.08Å
140	N	94	Very high	93.2	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-42	176.6	-73.6	7.2	0	0	0	112	E136 N137 G142 L143 I144 L194	E136-N140 HydrophobicContact CB-CB 4.3Å; E136-N140 PolarHBondContact OE2-ND2 3.43Å; E136-N140 VanDerWaalsContact OE2-ND2 3.16Å; N137-N140 VanDerWaalsContact ND2-CG 3.28Å; N137-N140 PolarHBondContact ND2-ND2 3.06Å; N137-N140 VanDerWaalsContact ND2-ND2 3.16Å; N137-N140 PolarHBondContact O-N 2.96Å; N137-N140 WeakPolarHBondContact OD1-CB 3.41Å; N137-N140 PolarHBondContact OD1-N 2.66Å; N137-N140 PolarHBondContact OD1-OD1 2.82Å; N140-G142 VanDerWaalsContact C-N 3.29Å; N140-G142 PolarHBondContact O-N 3.42Å; N140-L143 WeakPolarHBondContact O-CB 3.35Å; N140-L143 PolarHBondContact O-N 3.28Å; N140-L143 VanDerWaalsContact O-N 3.11Å; N140-I144 WeakPolarHBondContact O-CG1 3.46Å; N140-I144 PolarHBondContact O-N 2.69Å; N140-L194 HydrophobicContact CB-CD2 4.03Å
141	L	94	Very high	93.5	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-56.1	-46.3	174.1	175	66.7	0	0	0	110.7	Y73 L76 R77 N137 Y139 L143 I144 I145	Y73-L141 HydrophobicContact CE1-CD2 4.05Å; Y73-L141 HydrophobicContact CE2-CD2 4.06Å; L76-L141 HydrophobicContact CD2-CD2 4.33Å; R77-L141 HydrophobicContact CB-CD2 4.17Å; R77-L141 HydrophobicContact CG-CD1 4.29Å; N137-L141 WeakPolarHBondContact O-CB 3.27Å; N137-L141 PolarHBondContact O-N 3.31Å; Y139-L141 VanDerWaalsContact C-N 3.33Å; Y139-L141 PolarHBondContact O-N 3.35Å; L141-L143 VanDerWaalsContact C-N 3.31Å; L141-L143 PolarHBondContact O-N 2.91Å; L141-I144 PolarHBondContact O-N 2.83Å; L141-I145 HydrophobicContact CD1-CD1 4.08Å; L141-I145 HydrophobicContact CD1-CG1 4.29Å; L141-I145 HydrophobicContact CG-CD1 3.93Å; L141-I145 VanDerWaalsContact O-CG1 3.23Å; L141-I145 WeakPolarHBondContact O-CG1 3.39Å; L141-I145 PolarHBondContact O-N 3.39Å
142	G	94.9	Very high	93.8	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-39.9	175.7	0	0	0	0	0	113.1	H111 V138 Y139 N140 F146	H111-G142 PolarHBondContact NE2-O 2.97Å; V138-G142 PolarHBondContact O-N 2.88Å; V138-G142 VanDerWaalsContact O-N 3.12Å; Y139-G142 WeakPolarHBondContact O-CA 3.28Å; Y139-G142 PolarHBondContact O-N 2.98Å; Y139-G142 VanDerWaalsContact O-N 3.08Å; N140-G142 VanDerWaalsContact C-N 3.29Å; N140-G142 PolarHBondContact O-N 3.42Å; G142-F146 PolarHBondContact O-N 3.37Å
143	L	95.8	Very high	94	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-67.1	-42.9	176.7	-56.9	-166.4	0	0	0	112	W108 Y139 N140 L141 I145 F146 R147 I191 L192 L194	W108-L143 HydrophobicContact CH2-CD2 3.57Å; W108-L143 HydrophobicContact CZ3-CD2 3.84Å; Y139-L143 HydrophobicContact CD1-CD1 4.14Å; Y139-L143 HydrophobicContact CD1-CG 4.3Å; Y139-L143 HydrophobicContact CE1-CD1 3.7Å; Y139-L143 HydrophobicContact CE1-CD2 4.18Å; Y139-L143 HydrophobicContact CE1-CG 4.08Å; Y139-L143 WeakPolarHBondContact O-CG 3.4Å; Y139-L143 PolarHBondContact O-N 2.94Å; Y139-L143 VanDerWaalsContact O-N 3.08Å; N140-L143 WeakPolarHBondContact O-CB 3.35Å; N140-L143 PolarHBondContact O-N 3.28Å; N140-L143 VanDerWaalsContact O-N 3.11Å; L141-L143 VanDerWaalsContact C-N 3.31Å; L141-L143 PolarHBondContact O-N 2.91Å; L143-I145 VanDerWaalsContact C-N 3.34Å; L143-I145 PolarHBondContact O-N 3.49Å; L143-F146 PolarHBondContact O-N 2.69Å; L143-R147 WeakPolarHBondContact O-CB 3.45Å; L143-R147 PolarHBondContact O-N 3.3Å; L143-I191 HydrophobicContact CD1-CG2 3.77Å; L143-L192 HydrophobicContact CB-CD2 4.4Å; L143-L192 WeakPolarHBondContact O-CD2 3.39Å; L143-L194 HydrophobicContact CB-CD2 3.97Å; L143-L194 HydrophobicContact CD1-CD2 3.83Å; L143-L194 HydrophobicContact CG-CD2 4.42Å
144	I	94.9	Very high	94	Very high	30 Å²	30	40.6 Å²	40.6	15%	0.154	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-45.7	176.5	-71	165.7	0	0	0	110.6	E136 N140 L141 F146 R147 D148 L194	E136-I144 HydrophobicContact CB-CD1 4.39Å; E136-I144 HydrophobicContact CG-CD1 3.75Å; N140-I144 WeakPolarHBondContact O-CG1 3.46Å; N140-I144 PolarHBondContact O-N 2.69Å; L141-I144 PolarHBondContact O-N 2.83Å; I144-F146 VanDerWaalsContact C-N 3.35Å; I144-F146 PolarHBondContact O-N 3.46Å; I144-R147 WeakPolarHBondContact O-CB 3.39Å; I144-R147 PolarHBondContact O-N 2.78Å; I144-D148 WeakPolarHBondContact O-CB 3.27Å; I144-D148 PolarHBondContact O-N 3.32Å; I144-L194 HydrophobicContact CD1-CD1 3.88Å; I144-L194 HydrophobicContact CG1-CD1 3.86Å
145	I	96	Very high	94.2	Very high	7 Å²	7	36.4 Å²	36.4	4%	0.036	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-41.3	179.1	-57.3	162.2	0	0	0	110.1	R77 V80 T81 L84 L141 L143 D148 Q149	R77-I145 HydrophobicContact CG-CD1 4.03Å; V80-I145 HydrophobicContact CB-CD1 4.04Å; V80-I145 HydrophobicContact CG1-CB 4.46Å; V80-I145 HydrophobicContact CG1-CD1 3.85Å; V80-I145 HydrophobicContact CG1-CG2 4.4Å; T81-I145 WeakPolarHBondContact OG1-CG2 3.26Å; L84-I145 HydrophobicContact CD1-CB 4.03Å; L84-I145 HydrophobicContact CD1-CG2 3.53Å; L141-I145 HydrophobicContact CD1-CD1 4.08Å; L141-I145 HydrophobicContact CD1-CG1 4.29Å; L141-I145 HydrophobicContact CG-CD1 3.93Å; L141-I145 VanDerWaalsContact O-CG1 3.23Å; L141-I145 WeakPolarHBondContact O-CG1 3.39Å; L141-I145 PolarHBondContact O-N 3.39Å; L143-I145 VanDerWaalsContact C-N 3.34Å; L143-I145 PolarHBondContact O-N 3.49Å; I145-D148 PolarHBondContact O-N 2.94Å; I145-Q149 HydrophobicContact CG2-CB 4.39Å; I145-Q149 HydrophobicContact CG2-CG 3.76Å; I145-Q149 WeakPolarHBondContact O-CA 3.37Å; I145-Q149 WeakPolarHBondContact O-CB 3.48Å; I145-Q149 WeakPolarHBondContact O-CG 3.47Å; I145-Q149 PolarHBondContact O-N 3.47Å
146	F	97	Very high	94.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-43.9	175.8	-168.2	-86.6	0	0	0	112.2	L84 V88 L104 W108 H111 G142 L143 I144 V150 V151 M188 L192	L84-F146 HydrophobicContact CD1-CB 4.27Å; L84-F146 HydrophobicContact CD1-CD2 4.49Å; L84-F146 HydrophobicContact CD2-CD2 3.8Å; L84-F146 HydrophobicContact CD2-CE2 4.35Å; V88-F146 HydrophobicContact CG1-CE2 4.2Å; L104-F146 HydrophobicContact CD1-CZ 4.32Å; W108-F146 HydrophobicContact CB-CE1 4.31Å; W108-F146 HydrophobicContact CB-CZ 3.98Å; W108-F146 HydrophobicContact CD2-CE1 4.39Å; W108-F146 AromaticContact CE3-CD1 3.61Å; W108-F146 HydrophobicContact CE3-CD1 3.61Å; W108-F146 HydrophobicContact CE3-CD2 4.42Å; W108-F146 AromaticContact CE3-CE1 3.6Å; W108-F146 HydrophobicContact CE3-CE1 3.6Å; W108-F146 HydrophobicContact CE3-CE2 4.41Å; W108-F146 HydrophobicContact CE3-CG 4.04Å; W108-F146 HydrophobicContact CE3-CZ 4.03Å; W108-F146 HydrophobicContact CZ3-CB 4.49Å; W108-F146 AromaticContact CZ3-CD1 3.88Å; W108-F146 HydrophobicContact CZ3-CD1 3.88Å; W108-F146 HydrophobicContact CZ3-CE1 4.33Å; W108-F146 HydrophobicContact CZ3-CG 4.18Å; H111-F146 HydrophobicContact CB-CD2 3.95Å; H111-F146 HydrophobicContact CB-CE2 4.06Å; H111-F146 AromaticContact CD2-CD2 3.53Å; H111-F146 AromaticContact CD2-CG 3.84Å; H111-F146 AromaticContact CG-CD2 3.69Å; G142-F146 PolarHBondContact O-N 3.37Å; L143-F146 PolarHBondContact O-N 2.69Å; I144-F146 VanDerWaalsContact C-N 3.35Å; I144-F146 PolarHBondContact O-N 3.46Å; F146-V150 HydrophobicContact CD1-CB 4.48Å; F146-V150 HydrophobicContact CD2-CB 4.47Å; F146-V150 HydrophobicContact CD2-CG2 4.13Å; F146-V150 HydrophobicContact CE1-CB 4.41Å; F146-V150 HydrophobicContact CE1-CG1 4.49Å; F146-V150 HydrophobicContact CE2-CB 4.4Å; F146-V150 HydrophobicContact CE2-CG1 4.43Å; F146-V150 HydrophobicContact CE2-CG2 4.25Å; F146-V150 HydrophobicContact CG-CG2 4.49Å; F146-V150 HydrophobicContact CZ-CB 4.37Å; F146-V150 HydrophobicContact CZ-CG1 4.17Å; F146-V150 WeakPolarHBondContact O-CA 3.35Å; F146-V150 VanDerWaalsContact O-CB 3.29Å; F146-V150 WeakPolarHBondContact O-CB 3.31Å; F146-V150 PolarHBondContact O-N 2.84Å; F146-V151 HydrophobicContact CD1-CG2 3.85Å; F146-V151 HydrophobicContact CE1-CG2 3.59Å; F146-V151 PolarHBondContact O-N 3.29Å; F146-M188 HydrophobicContact CE1-SD 4.08Å; F146-L192 HydrophobicContact CD1-CD1 4.44Å; F146-L192 HydrophobicContact CD1-CD2 4.11Å
147	R	95.9	Very high	94.5	Very high	48 Å²	48	34.1 Å²	34.1	18%	0.181	17%	0.172	C	C	.	.	I	π-helix	trans	-56	-54.8	175	-176.3	-168	66.8	-159.4	-1.7	111	L143 I144 V151 R152 L192 V199	L143-R147 WeakPolarHBondContact O-CB 3.45Å; L143-R147 PolarHBondContact O-N 3.3Å; I144-R147 WeakPolarHBondContact O-CB 3.39Å; I144-R147 PolarHBondContact O-N 2.78Å; R147-V151 PolarHBondContact O-N 3.49Å; R147-R152 HydrophobicContact CG-CG 4.31Å; R147-R152 WeakPolarHBondContact O-CB 3.04Å; R147-R152 PolarHBondContact O-N 3.32Å; R147-L192 HydrophobicContact CB-CB 4.44Å; R147-L192 HydrophobicContact CB-CD2 4.09Å; R147-L192 HydrophobicContact CG-CB 4.45Å; R147-V199 HydrophobicContact CG-CG2 4.27Å
148	D	95.1	Very high	94.5	Very high	62 Å²	62	34.8 Å²	34.8	33%	0.332	18%	0.176	S	C	.	.	I	π-helix	trans	-77.7	-35.2	-169.5	-65.1	-17.5	0	0	0	112.2	I144 I145	I144-D148 WeakPolarHBondContact O-CB 3.27Å; I144-D148 PolarHBondContact O-N 3.32Å; I145-D148 PolarHBondContact O-N 2.94Å
149	Q	95.5	Very high	94.6	Very high	59 Å²	59	37.4 Å²	37.4	28%	0.276	19%	0.188	S	C	.	.	I	π-helix	trans	-96.4	-18.7	-174.6	-55.3	-58.9	-33.4	0	0	113.6	T81 I85 R89 I145 Y153	T81-Q149 HydrophobicContact CG2-CG 4.34Å; I85-Q149 HydrophobicContact CG1-CB 4.34Å; R89-Q149 PolarHBondContact NE-O 3.46Å; R89-Q149 VanDerWaalsContact NH2-CA 3.32Å; R89-Q149 PolarHBondContact NH2-O 3.36Å; I145-Q149 HydrophobicContact CG2-CB 4.39Å; I145-Q149 HydrophobicContact CG2-CG 3.76Å; I145-Q149 WeakPolarHBondContact O-CA 3.37Å; I145-Q149 WeakPolarHBondContact O-CB 3.48Å; I145-Q149 WeakPolarHBondContact O-CG 3.47Å; I145-Q149 PolarHBondContact O-N 3.47Å; Q149-Y153 WeakPolarHBondContact O-CB 3.2Å
150	V	95.5	Very high	94.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-117.3	-65.2	-179.9	-173.4	0	0	0	0	110.5	L84 V88 V92 L104 F146 Y153 I156	L84-V150 HydrophobicContact CB-CG2 4.2Å; L84-V150 HydrophobicContact CD2-CG2 4.19Å; V88-V150 HydrophobicContact CG1-CG1 4.38Å; V88-V150 HydrophobicContact CG1-CG2 4.19Å; V92-V150 HydrophobicContact CG2-CG1 4.2Å; L104-V150 HydrophobicContact CD1-CG1 4.25Å; F146-V150 HydrophobicContact CD1-CB 4.48Å; F146-V150 HydrophobicContact CD2-CB 4.47Å; F146-V150 HydrophobicContact CD2-CG2 4.13Å; F146-V150 HydrophobicContact CE1-CB 4.41Å; F146-V150 HydrophobicContact CE1-CG1 4.49Å; F146-V150 HydrophobicContact CE2-CB 4.4Å; F146-V150 HydrophobicContact CE2-CG1 4.43Å; F146-V150 HydrophobicContact CE2-CG2 4.25Å; F146-V150 HydrophobicContact CG-CG2 4.49Å; F146-V150 HydrophobicContact CZ-CB 4.37Å; F146-V150 HydrophobicContact CZ-CG1 4.17Å; F146-V150 WeakPolarHBondContact O-CA 3.35Å; F146-V150 VanDerWaalsContact O-CB 3.29Å; F146-V150 WeakPolarHBondContact O-CB 3.31Å; F146-V150 PolarHBondContact O-N 2.84Å; V150-Y153 WeakPolarHBondContact O-CB 3.41Å; V150-Y153 PolarHBondContact O-N 3.29Å; V150-I156 WeakPolarHBondContact O-CD1 3.43Å
151	V	95.1	Very high	94.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-68.1	-44.1	-170.6	179.1	0	0	0	0	112.3	F146 R147 Y153 R157 L160 M188 L189 L192	F146-V151 HydrophobicContact CD1-CG2 3.85Å; F146-V151 HydrophobicContact CE1-CG2 3.59Å; F146-V151 PolarHBondContact O-N 3.29Å; R147-V151 PolarHBondContact O-N 3.49Å; V151-Y153 VanDerWaalsContact C-N 3.3Å; V151-Y153 PolarHBondContact O-N 3.45Å; V151-R157 VanDerWaalsContact O-CA 3.31Å; V151-R157 WeakPolarHBondContact O-CA 3.28Å; V151-R157 WeakPolarHBondContact O-CB 3.39Å; V151-R157 PolarHBondContact O-N 2.96Å; V151-R157 VanDerWaalsContact O-N 3.16Å; V151-L160 HydrophobicContact CG1-CD2 4.18Å; V151-M188 HydrophobicContact CG2-CE 4.03Å; V151-M188 HydrophobicContact CG2-SD 4.25Å; V151-L189 HydrophobicContact CG1-CD2 3.99Å; V151-L192 HydrophobicContact CB-CD1 4.25Å; V151-L192 HydrophobicContact CG1-CD1 4.42Å; V151-L192 HydrophobicContact CG2-CD1 3.72Å
152	R	94.6	Very high	94.7	Very high	71 Å²	71	40.7 Å²	40.7	27%	0.268	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	7.6	179.4	-68.5	-173.2	166	-168.7	-11.6	113.8	R147 E202 D203	R147-R152 HydrophobicContact CG-CG 4.31Å; R147-R152 WeakPolarHBondContact O-CB 3.04Å; R147-R152 PolarHBondContact O-N 3.32Å; R152-E202 IonicContact CZ-OE2 3.87Å; R152-E202 IonicContact NH1-OE2 2.79Å; R152-E202 IonicContact NH2-OE2 2.62Å; R152-E202 PolarHBondContact NH2-OE2 3.31Å; R152-D203 IonicContact CZ-OD2 2.81Å; R152-D203 IonicContact NE-OD1 3.75Å; R152-D203 IonicContact NE-OD2 2.8Å; R152-D203 PolarHBondContact NE-OD2 3.5Å; R152-D203 IonicContact NH2-OD1 2.87Å; R152-D203 IonicContact NH2-OD2 3.85Å; R152-D203 PolarHBondContact NH2-OD2 2.99Å
153	Y	94	Very high	94.7	Very high	92 Å²	92	42.2 Å²	42.2	36%	0.361	21%	0.211	S	C	.	.	S	Bend	trans	-81.2	125.6	-177.7	178.9	-97.8	0	0	0	112.5	R89 L93 Q149 V150 V151 C155 I156	R89-Y153 HydrophobicContact CG-CD1 3.85Å; R89-Y153 HydrophobicContact CG-CE1 4.11Å; R89-Y153 HydrophobicContact CG-CG 4.34Å; R89-Y153 VanDerWaalsContact CZ-CE2 3.42Å; L93-Y153 HydrophobicContact CD1-CE1 4.01Å; Q149-Y153 WeakPolarHBondContact O-CB 3.2Å; V150-Y153 WeakPolarHBondContact O-CB 3.41Å; V150-Y153 PolarHBondContact O-N 3.29Å; V151-Y153 VanDerWaalsContact C-N 3.3Å; V151-Y153 PolarHBondContact O-N 3.45Å; Y153-C155 PolarHBondContact O-N 3.49Å; Y153-I156 HydrophobicContact CD1-CD1 4.14Å; Y153-I156 WeakPolarHBondContact O-CB 3.33Å; Y153-I156 PolarHBondContact O-N 3.1Å
154	G	89.1	Confident	94.7	Very high	53 Å²	53	42 Å²	42	55%	0.546	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	-124.7	169.5	0	0	0	0	0	112.7
155	C	92.6	Very high	94.8	Very high	67 Å²	67	41.1 Å²	41.1	45%	0.453	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.5	-179.4	61	0	0	0	0	114.7	Y153 R157 D158 H159	Y153-C155 PolarHBondContact O-N 3.49Å; C155-R157 PolarHBondContact O-N 3.27Å; C155-D158 PolarHBondContact O-N 2.97Å; C155-H159 WeakPolarHBondContact O-CB 3.47Å; C155-H159 PolarHBondContact O-N 3.34Å
156	I	94.7	Very high	94.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-44.9	-174.2	-63.6	173.9	0	0	0	110.6	R89 V92 L93 F100 V150 Y153 H159 L160	R89-I156 HydrophobicContact CG-CD1 4.47Å; V92-I156 HydrophobicContact CB-CD1 4.39Å; V92-I156 HydrophobicContact CG1-CD1 3.84Å; V92-I156 HydrophobicContact CG1-CG1 4.28Å; V92-I156 HydrophobicContact CG1-CG2 4.06Å; L93-I156 HydrophobicContact CD2-CD1 3.82Å; L93-I156 HydrophobicContact CD2-CG1 3.71Å; L93-I156 HydrophobicContact CG-CD1 4.08Å; L93-I156 HydrophobicContact CG-CG1 4.48Å; F100-I156 HydrophobicContact CE2-CG2 4.13Å; F100-I156 HydrophobicContact CZ-CG2 3.98Å; V150-I156 WeakPolarHBondContact O-CD1 3.43Å; Y153-I156 HydrophobicContact CD1-CD1 4.14Å; Y153-I156 WeakPolarHBondContact O-CB 3.33Å; Y153-I156 PolarHBondContact O-N 3.1Å; I156-H159 PolarHBondContact O-N 3.36Å; I156-L160 VanDerWaalsContact O-CB 3.29Å; I156-L160 WeakPolarHBondContact O-CB 3.14Å; I156-L160 PolarHBondContact O-N 3.43Å
157	R	93.8	Very high	94.6	Very high	86 Å²	86	44.9 Å²	44.9	33%	0.325	23%	0.225	S	C	.	.	H	α-helix	trans	-58	-53.5	179.1	-175.6	-167.1	64.1	-166	-7.4	111.7	V151 C155 H159 L160 R161 D203	V151-R157 VanDerWaalsContact O-CA 3.31Å; V151-R157 WeakPolarHBondContact O-CA 3.28Å; V151-R157 WeakPolarHBondContact O-CB 3.39Å; V151-R157 PolarHBondContact O-N 2.96Å; V151-R157 VanDerWaalsContact O-N 3.16Å; C155-R157 PolarHBondContact O-N 3.27Å; R157-H159 VanDerWaalsContact C-N 3.31Å; R157-H159 PolarHBondContact O-N 3.5Å; R157-L160 PolarHBondContact O-N 3.28Å; R157-R161 WeakPolarHBondContact O-CB 3.26Å; R157-R161 PolarHBondContact O-N 3.27Å; R157-D203 WeakPolarHBondContact CD-OD1 3.44Å; R157-D203 HydrophobicContact CG-CB 4.36Å
158	D	93.9	Very high	94.6	Very high	66 Å²	66	42.6 Å²	42.6	35%	0.353	22%	0.217	S	C	.	.	H	α-helix	trans	-70	-33.4	-174.6	-61.2	-32.9	0	0	0	110.6	C155 R161 Q162	C155-D158 PolarHBondContact O-N 2.97Å; D158-R161 IonicContact OD1-CZ 3.51Å; D158-R161 IonicContact OD1-NH1 2.86Å; D158-R161 PolarHBondContact OD1-NH1 3.15Å; D158-R161 IonicContact OD1-NH2 2.97Å; D158-Q162 WeakPolarHBondContact O-CB 3.39Å; D158-Q162 PolarHBondContact O-N 3.07Å
159	H	95.1	Very high	94.5	Very high	56 Å²	56	40.8 Å²	40.8	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-68.2	-42.8	173	-169.4	81.9	0	0	0	112.9	L96 F100 C155 I156 R157 Q162 T163	L96-H159 HydrophobicContact CD2-CB 4.04Å; L96-H159 PolarHBondContact O-NE2 3.1Å; F100-H159 AromaticContact CD1-CD2 3.79Å; F100-H159 AromaticContact CE1-CD2 3.9Å; C155-H159 WeakPolarHBondContact O-CB 3.47Å; C155-H159 PolarHBondContact O-N 3.34Å; I156-H159 PolarHBondContact O-N 3.36Å; R157-H159 VanDerWaalsContact C-N 3.31Å; R157-H159 PolarHBondContact O-N 3.5Å; H159-Q162 PolarHBondContact O-N 2.84Å; H159-T163 WeakPolarHBondContact O-CB 3.15Å; H159-T163 PolarHBondContact O-N 3.47Å; H159-T163 PolarHBondContact O-OG1 2.95Å
160	L	95.4	Very high	94.4	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-58.5	-50.1	173.7	174.6	61.9	0	0	0	110.7	F100 L101 L104 V151 I156 R157 Q162 T163 L164 A185 M188 L189	F100-L160 HydrophobicContact CE1-CB 3.9Å; F100-L160 HydrophobicContact CE1-CD1 3.9Å; F100-L160 HydrophobicContact CZ-CB 4.06Å; L101-L160 HydrophobicContact CD2-CD1 3.49Å; L101-L160 VanDerWaalsContact CD2-CD1 3.49Å; L104-L160 HydrophobicContact CD2-CD1 4.09Å; L104-L160 HydrophobicContact CD2-CD2 4.1Å; V151-L160 HydrophobicContact CG1-CD2 4.18Å; I156-L160 VanDerWaalsContact O-CB 3.29Å; I156-L160 WeakPolarHBondContact O-CB 3.14Å; I156-L160 PolarHBondContact O-N 3.43Å; R157-L160 PolarHBondContact O-N 3.28Å; L160-Q162 PolarHBondContact O-N 3.05Å; L160-T163 PolarHBondContact O-N 3.38Å; L160-L164 HydrophobicContact CD1-CD1 3.99Å; L160-L164 HydrophobicContact CD1-CG 4.14Å; L160-L164 HydrophobicContact CG-CD1 4.2Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.14Å; L160-L164 PolarHBondContact O-N 3.48Å; L160-A185 HydrophobicContact CD1-CB 4.32Å; L160-M188 HydrophobicContact CD2-CE 4.06Å; L160-L189 HydrophobicContact CD2-CD2 4.27Å
161	R	95.1	Very high	94.3	Very high	52 Å²	52	43.8 Å²	43.8	20%	0.196	22%	0.22	C	C	.	.	H	α-helix	trans	-54	-55.6	175	-178.7	-170.1	-62.8	141.8	0	110.7	R157 D158 T163 L164 L165 D203 P207	R157-R161 WeakPolarHBondContact O-CB 3.26Å; R157-R161 PolarHBondContact O-N 3.27Å; D158-R161 IonicContact OD1-CZ 3.51Å; D158-R161 IonicContact OD1-NH1 2.86Å; D158-R161 PolarHBondContact OD1-NH1 3.15Å; D158-R161 IonicContact OD1-NH2 2.97Å; R161-T163 VanDerWaalsContact C-N 3.31Å; R161-T163 PolarHBondContact O-N 2.69Å; R161-L164 PolarHBondContact O-N 3.28Å; R161-L165 HydrophobicContact CG-CD1 3.86Å; R161-L165 HydrophobicContact CG-CG 4.33Å; R161-L165 WeakPolarHBondContact O-CB 3.43Å; R161-L165 VanDerWaalsContact O-CG 3.26Å; R161-L165 WeakPolarHBondContact O-CG 3.32Å; R161-L165 PolarHBondContact O-N 3.32Å; R161-D203 PolarHBondContact NE-O 3.22Å; R161-P207 HydrophobicContact CG-CB 4.19Å; R161-P207 HydrophobicContact CG-CG 4.41Å
162	Q	95.1	Very high	94.2	Very high	95 Å²	95	44.4 Å²	44.4	44%	0.444	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-41.6	-176.9	-170.7	60.6	43.5	0	0	112.1	D158 H159 L160 L164 L165 D166	D158-Q162 WeakPolarHBondContact O-CB 3.39Å; D158-Q162 PolarHBondContact O-N 3.07Å; H159-Q162 PolarHBondContact O-N 2.84Å; L160-Q162 PolarHBondContact O-N 3.05Å; Q162-L164 PolarHBondContact O-N 3.41Å; Q162-L165 PolarHBondContact O-N 3.34Å; Q162-D166 VanDerWaalsContact NE2-CG 3.28Å; Q162-D166 PolarHBondContact NE2-OD1 2.96Å; Q162-D166 PolarHBondContact NE2-OD2 3.09Å; Q162-D166 WeakPolarHBondContact O-CB 3.48Å; Q162-D166 VanDerWaalsContact O-CG 3.24Å; Q162-D166 PolarHBondContact O-N 2.88Å
163	T	95.1	Very high	94	Very high	33 Å²	33	48.4 Å²	48.4	20%	0.202	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-45.6	179.3	-59.8	0	0	0	0	111.5	L101 H159 L160 R161 D166 M167	L101-T163 HydrophobicContact CD1-CG2 3.96Å; L101-T163 HydrophobicContact CD2-CG2 4.46Å; L101-T163 HydrophobicContact CG-CG2 4.13Å; H159-T163 WeakPolarHBondContact O-CB 3.15Å; H159-T163 PolarHBondContact O-N 3.47Å; H159-T163 PolarHBondContact O-OG1 2.95Å; L160-T163 PolarHBondContact O-N 3.38Å; R161-T163 VanDerWaalsContact C-N 3.31Å; R161-T163 PolarHBondContact O-N 2.69Å; T163-D166 PolarHBondContact O-N 3.01Å; T163-M167 HydrophobicContact CG2-SD 4.3Å; T163-M167 VanDerWaalsContact O-CG 3.25Å; T163-M167 WeakPolarHBondContact O-CG 3.28Å; T163-M167 PolarHBondContact O-N 3.3Å
164	L	95.7	Very high	93.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-44.2	177.9	-65.5	176.3	0	0	0	111.5	L101 L160 R161 Q162 M167 I168 I182 A185 F204	L101-L164 HydrophobicContact CD1-CD2 4.3Å; L101-L164 HydrophobicContact CD2-CD2 4.35Å; L160-L164 HydrophobicContact CD1-CD1 3.99Å; L160-L164 HydrophobicContact CD1-CG 4.14Å; L160-L164 HydrophobicContact CG-CD1 4.2Å; L160-L164 VanDerWaalsContact O-CG 3.31Å; L160-L164 WeakPolarHBondContact O-CG 3.14Å; L160-L164 PolarHBondContact O-N 3.48Å; R161-L164 PolarHBondContact O-N 3.28Å; Q162-L164 PolarHBondContact O-N 3.41Å; L164-M167 PolarHBondContact O-N 3.47Å; L164-I168 WeakPolarHBondContact O-CG1 3.42Å; L164-I168 PolarHBondContact O-N 3.11Å; L164-I168 VanDerWaalsContact O-N 3.1Å; L164-I182 HydrophobicContact CD2-CB 4.4Å; L164-I182 HydrophobicContact CD2-CG1 4.24Å; L164-I182 HydrophobicContact CD2-CG2 4.4Å; L164-A185 HydrophobicContact CD1-CB 4.02Å; L164-A185 HydrophobicContact CD2-CB 3.88Å; L164-F204 HydrophobicContact CB-CD2 4.02Å; L164-F204 HydrophobicContact CB-CE2 3.73Å; L164-F204 HydrophobicContact CD1-CD2 3.8Å; L164-F204 HydrophobicContact CD1-CE2 4.13Å
165	L	95.8	Very high	94	Very high	10 Å²	10	48.9 Å²	48.9	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-43.9	177.6	-68.4	-176.6	0	0	0	112.1	R161 Q162 M167 I168 A169 F204 P207 F208 M211	R161-L165 HydrophobicContact CG-CD1 3.86Å; R161-L165 HydrophobicContact CG-CG 4.33Å; R161-L165 WeakPolarHBondContact O-CB 3.43Å; R161-L165 VanDerWaalsContact O-CG 3.26Å; R161-L165 WeakPolarHBondContact O-CG 3.32Å; R161-L165 PolarHBondContact O-N 3.32Å; Q162-L165 PolarHBondContact O-N 3.34Å; L165-M167 PolarHBondContact O-N 3.4Å; L165-I168 PolarHBondContact O-N 3.24Å; L165-A169 WeakPolarHBondContact O-CB 3.42Å; L165-A169 PolarHBondContact O-N 3.27Å; L165-F204 HydrophobicContact CD2-CE2 4.21Å; L165-P207 HydrophobicContact CD1-CB 4.18Å; L165-F208 VanDerWaalsContact CD2-CA 3.47Å; L165-F208 HydrophobicContact CD2-CB 3.69Å; L165-F208 HydrophobicContact CD2-CD2 4.21Å; L165-F208 HydrophobicContact CD2-CG 4.47Å; L165-M211 HydrophobicContact CB-CE 4.11Å; L165-M211 HydrophobicContact CB-SD 3.75Å; L165-M211 HydrophobicContact CD1-SD 4.4Å; L165-M211 HydrophobicContact CD2-CE 3.89Å; L165-M211 HydrophobicContact CD2-SD 4.25Å; L165-M211 HydrophobicContact CG-SD 4.35Å
166	D	94.7	Very high	93.9	Very high	72 Å²	72	52.6 Å²	52.6	39%	0.385	27%	0.272	S	S	.	.	H	α-helix	trans	-66.1	-36.4	178	-74.9	-22	0	0	0	112.4	Q162 T163 A169 R170	Q162-D166 VanDerWaalsContact NE2-CG 3.28Å; Q162-D166 PolarHBondContact NE2-OD1 2.96Å; Q162-D166 PolarHBondContact NE2-OD2 3.09Å; Q162-D166 WeakPolarHBondContact O-CB 3.48Å; Q162-D166 VanDerWaalsContact O-CG 3.24Å; Q162-D166 PolarHBondContact O-N 2.88Å; T163-D166 PolarHBondContact O-N 3.01Å; D166-A169 PolarHBondContact O-N 3.31Å; D166-R170 WeakPolarHBondContact O-CB 3.5Å; D166-R170 WeakPolarHBondContact O-CG 3.39Å; D166-R170 PolarHBondContact O-N 3.02Å; D166-R170 PolarHBondContact O-NE 2.87Å
167	M	94.9	Very high	93.8	Very high	14 Å²	14	53.7 Å²	53.7	7%	0.069	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-45.6	172.5	-72.7	176.7	73.3	0	0	111	L101 T163 L164 L165 A169 R170 E171 V177 D178 A181 I182	L101-M167 HydrophobicContact CD1-SD 3.61Å; T163-M167 HydrophobicContact CG2-SD 4.3Å; T163-M167 VanDerWaalsContact O-CG 3.25Å; T163-M167 WeakPolarHBondContact O-CG 3.28Å; T163-M167 PolarHBondContact O-N 3.3Å; L164-M167 PolarHBondContact O-N 3.47Å; L165-M167 PolarHBondContact O-N 3.4Å; M167-A169 PolarHBondContact O-N 3.44Å; M167-R170 PolarHBondContact O-N 3.3Å; M167-E171 PolarHBondContact O-N 3.03Å; M167-V177 HydrophobicContact CE-CB 4.28Å; M167-V177 WeakPolarHBondContact O-CG1 3.38Å; M167-D178 HydrophobicContact CE-CB 4.19Å; M167-D178 WeakPolarHBondContact CE-O 3.35Å; M167-A181 HydrophobicContact CE-CB 4.48Å; M167-I182 HydrophobicContact CB-CD1 3.99Å; M167-I182 HydrophobicContact CB-CG1 4.4Å; M167-I182 HydrophobicContact CE-CD1 4.15Å; M167-I182 HydrophobicContact CE-CG1 3.84Å; M167-I182 HydrophobicContact SD-CG1 4.2Å
168	I	95.3	Very high	93.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-39.6	177.9	-64.5	167	0	0	0	111.3	L164 L165 R170 E171 R172 I182 F204 F208 L251	L164-I168 WeakPolarHBondContact O-CG1 3.42Å; L164-I168 PolarHBondContact O-N 3.11Å; L164-I168 VanDerWaalsContact O-N 3.1Å; L165-I168 PolarHBondContact O-N 3.24Å; I168-R170 VanDerWaalsContact C-N 3.33Å; I168-R170 PolarHBondContact O-N 3.31Å; I168-E171 WeakPolarHBondContact O-CB 3.39Å; I168-E171 PolarHBondContact O-N 3.13Å; I168-R172 PolarHBondContact O-N 2.88Å; I168-I182 HydrophobicContact CG1-CD1 4.18Å; I168-F204 HydrophobicContact CD1-CE2 4.1Å; I168-F204 HydrophobicContact CD1-CZ 3.76Å; I168-F208 HydrophobicContact CD1-CD2 3.9Å; I168-F208 HydrophobicContact CD1-CE2 3.98Å; I168-F208 HydrophobicContact CG2-CE2 3.97Å; I168-L251 HydrophobicContact CD1-CD2 4.44Å
169	A	93.9	Very high	93.6	Very high	25 Å²	25	56.2 Å²	56.2	21%	0.207	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-38.2	177.3	0	0	0	0	0	112.6	L165 D166 M167 K173	L165-A169 WeakPolarHBondContact O-CB 3.42Å; L165-A169 PolarHBondContact O-N 3.27Å; D166-A169 PolarHBondContact O-N 3.31Å; M167-A169 PolarHBondContact O-N 3.44Å; A169-K173 WeakPolarHBondContact O-CG 3.49Å
170	R	93.4	Very high	93.6	Very high	103 Å²	103	54.5 Å²	54.5	39%	0.389	29%	0.288	S	S	.	.	H	α-helix	trans	-70.2	-40.2	174.1	-74.1	-176.3	-59.3	133	-9.5	112	D166 M167 I168 R172 K173 G174 E175 V177	D166-R170 WeakPolarHBondContact O-CB 3.5Å; D166-R170 WeakPolarHBondContact O-CG 3.39Å; D166-R170 PolarHBondContact O-N 3.02Å; D166-R170 PolarHBondContact O-NE 2.87Å; M167-R170 PolarHBondContact O-N 3.3Å; I168-R170 VanDerWaalsContact C-N 3.33Å; I168-R170 PolarHBondContact O-N 3.31Å; R170-R172 VanDerWaalsContact C-N 3.34Å; R170-R172 PolarHBondContact O-N 3.12Å; R170-K173 WeakPolarHBondContact O-CA 3.43Å; R170-K173 WeakPolarHBondContact O-CB 3.48Å; R170-K173 PolarHBondContact O-N 3.48Å; R170-G174 PolarHBondContact O-N 3.47Å; R170-E175 HydrophobicContact CB-CB 4.07Å; R170-E175 HydrophobicContact CB-CG 4.32Å; R170-E175 VanDerWaalsContact CD-OE2 3.27Å; R170-E175 WeakPolarHBondContact CD-OE2 3.4Å; R170-E175 IonicContact NH1-OE2 3.39Å; R170-E175 WeakPolarHBondContact O-CB 3.43Å; R170-E175 PolarHBondContact O-N 3.32Å; R170-E175 VanDerWaalsContact O-N 3.09Å; R170-V177 HydrophobicContact CB-CG1 4.35Å
171	E	94.1	Very high	93.5	Very high	19 Å²	19	55 Å²	55	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-43.4	174.1	-169.8	-169.6	-151.5	0	0	112	M167 I168 K173 G174 V177 R179 R246	M167-E171 PolarHBondContact O-N 3.03Å; I168-E171 WeakPolarHBondContact O-CB 3.39Å; I168-E171 PolarHBondContact O-N 3.13Å; E171-K173 PolarHBondContact O-N 3.29Å; E171-K173 VanDerWaalsContact O-N 3.15Å; E171-G174 WeakPolarHBondContact O-CA 3.43Å; E171-G174 PolarHBondContact O-N 3.32Å; E171-V177 HydrophobicContact CB-CG1 4.35Å; E171-V177 HydrophobicContact CB-CG2 3.79Å; E171-V177 HydrophobicContact CG-CG2 3.98Å; E171-R179 IonicContact OE1-CZ 2.63Å; E171-R179 IonicContact OE1-NE 3.42Å; E171-R179 PolarHBondContact OE1-NE 2.74Å; E171-R179 IonicContact OE1-NH2 3.77Å; E171-R179 PolarHBondContact OE1-NH2 3.29Å; E171-R246 IonicContact OE2-CZ 2.66Å; E171-R246 IonicContact OE2-NE 2.78Å; E171-R246 PolarHBondContact OE2-NE 3.5Å; E171-R246 IonicContact OE2-NH2 2.83Å
172	R	92.5	Very high	93.5	Very high	12 Å²	12	52.5 Å²	52.5	5%	0.045	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-22.5	176	-76.4	-179.5	174.8	149.3	5.6	113.8	I168 R170 G174 S212 F215 E243	I168-R172 PolarHBondContact O-N 2.88Å; R170-R172 VanDerWaalsContact C-N 3.34Å; R170-R172 PolarHBondContact O-N 3.12Å; R172-G174 VanDerWaalsContact C-N 3.34Å; R172-S212 PolarHBondContact NH1-OG 3.14Å; R172-S212 PolarHBondContact NH2-OG 3.02Å; R172-F215 HydrophobicContact CB-CE2 4.37Å; R172-F215 HydrophobicContact CB-CZ 4.07Å; R172-E243 IonicContact CZ-OE1 3.02Å; R172-E243 IonicContact CZ-OE2 2.83Å; R172-E243 IonicContact NE-OE1 2.74Å; R172-E243 PolarHBondContact NE-OE1 2.9Å; R172-E243 IonicContact NE-OE2 3.37Å; R172-E243 VanDerWaalsContact NH2-CD 3.27Å; R172-E243 IonicContact NH2-OE1 3.01Å; R172-E243 PolarHBondContact NH2-OE1 3.11Å; R172-E243 VanDerWaalsContact NH2-OE1 3.16Å; R172-E243 IonicContact NH2-OE2 2.64Å; R172-E243 PolarHBondContact NH2-OE2 2.9Å
173	K	90.2	Very high	93.6	Very high	155 Å²	155	53.6 Å²	53.6	67%	0.674	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.2	174.2	-65.2	174.1	-176.1	175.1	0	113.1	A169 R170 E171	A169-K173 WeakPolarHBondContact O-CG 3.49Å; R170-K173 WeakPolarHBondContact O-CA 3.43Å; R170-K173 WeakPolarHBondContact O-CB 3.48Å; R170-K173 PolarHBondContact O-N 3.48Å; E171-K173 PolarHBondContact O-N 3.29Å; E171-K173 VanDerWaalsContact O-N 3.15Å
174	G	89.4	Confident	93.6	Very high	67 Å²	67	54.2 Å²	54.2	69%	0.691	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	10.5	179.2	0	0	0	0	0	114.6	R170 E171 R172	R170-G174 PolarHBondContact O-N 3.47Å; E171-G174 WeakPolarHBondContact O-CA 3.43Å; E171-G174 PolarHBondContact O-N 3.32Å; R172-G174 VanDerWaalsContact C-N 3.34Å
175	E	93.4	Very high	93.6	Very high	89 Å²	89	54.6 Å²	54.6	42%	0.416	29%	0.288	S	S	.	.			trans	-76.8	144.7	174.7	-61.7	179.6	-142.7	0	0	111.4	R170 V177	R170-E175 HydrophobicContact CB-CB 4.07Å; R170-E175 HydrophobicContact CB-CG 4.32Å; R170-E175 VanDerWaalsContact CD-OE2 3.27Å; R170-E175 WeakPolarHBondContact CD-OE2 3.4Å; R170-E175 IonicContact NH1-OE2 3.39Å; R170-E175 WeakPolarHBondContact O-CB 3.43Å; R170-E175 PolarHBondContact O-N 3.32Å; R170-E175 VanDerWaalsContact O-N 3.09Å; E175-V177 PolarHBondContact O-N 3.12Å
176	V	90.7	Very high	93.6	Very high	145 Å²	145	54.2 Å²	54.2	88%	0.879	29%	0.287	S	S	*	.			trans	-76.8	123.9	174.8	-178.5	0	0	0	0	109.1
177	V	92.5	Very high	93.6	Very high	22 Å²	22	55.5 Å²	55.5	13%	0.133	29%	0.291	C	S	.	.			trans	-124.9	154.5	178.5	-59.6	0	0	0	0	111.5	M167 R170 E171 E175 R179 I182	M167-V177 HydrophobicContact CE-CB 4.28Å; M167-V177 WeakPolarHBondContact O-CG1 3.38Å; R170-V177 HydrophobicContact CB-CG1 4.35Å; E171-V177 HydrophobicContact CB-CG1 4.35Å; E171-V177 HydrophobicContact CB-CG2 3.79Å; E171-V177 HydrophobicContact CG-CG2 3.98Å; E175-V177 PolarHBondContact O-N 3.12Å; V177-R179 HydrophobicContact CG2-CG 4.46Å; V177-R179 PolarHBondContact O-N 3.42Å; V177-I182 HydrophobicContact CG2-CD1 4.38Å
178	D	91.8	Very high	93.7	Very high	102 Å²	102	55 Å²	55	55%	0.545	29%	0.288	S	S	.	.			trans	-73.9	89	173.9	-174.4	-4.4	0	0	0	110.7	M167 G180 A181 I182	M167-D178 HydrophobicContact CE-CB 4.19Å; M167-D178 WeakPolarHBondContact CE-O 3.35Å; D178-G180 PolarHBondContact O-N 2.96Å; D178-G180 WeakPolarHBondContact OD1-CA 3.22Å; D178-G180 PolarHBondContact OD1-N 3.16Å; D178-A181 HydrophobicContact CB-CB 4.11Å; D178-A181 PolarHBondContact O-N 3.41Å; D178-A181 PolarHBondContact OD1-N 3.25Å; D178-A181 VanDerWaalsContact OD1-N 3.12Å; D178-I182 PolarHBondContact O-N 3.23Å
179	R	92.5	Very high	93.7	Very high	104 Å²	104	55.2 Å²	55.2	39%	0.392	29%	0.289	S	S	.	.	H	α-helix	trans	-57.8	-30.1	174.2	-70	-172.1	173.9	179.9	0.8	112.8	E171 V177 I182 R183 C250	E171-R179 IonicContact OE1-CZ 2.63Å; E171-R179 IonicContact OE1-NE 3.42Å; E171-R179 PolarHBondContact OE1-NE 2.74Å; E171-R179 IonicContact OE1-NH2 3.77Å; E171-R179 PolarHBondContact OE1-NH2 3.29Å; V177-R179 HydrophobicContact CG2-CG 4.46Å; V177-R179 PolarHBondContact O-N 3.42Å; R179-I182 PolarHBondContact O-N 2.86Å; R179-R183 WeakPolarHBondContact O-CB 3.47Å; R179-R183 PolarHBondContact O-N 2.95Å; R179-C250 WeakPolarHBondContact CB-SG 3.34Å; R179-C250 WeakPolarHBondContact CG-SG 3.21Å
180	G	93.9	Very high	93.8	Very high	20 Å²	20	56.1 Å²	56.1	21%	0.206	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-41.5	178.3	0	0	0	0	0	111.9	D178 R183 N184	D178-G180 PolarHBondContact O-N 2.96Å; D178-G180 WeakPolarHBondContact OD1-CA 3.22Å; D178-G180 PolarHBondContact OD1-N 3.16Å; G180-R183 PolarHBondContact O-N 3.33Å; G180-N184 WeakPolarHBondContact O-CB 3.47Å; G180-N184 PolarHBondContact O-N 3.35Å; G180-N184 PolarHBondContact O-ND2 2.88Å; G180-N184 PolarHBondContact O-OD1 3.39Å
181	A	93.6	Very high	93.8	Very high	16 Å²	16	54.3 Å²	54.3	13%	0.132	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-43.2	176.2	0	0	0	0	0	112.4	L101 M167 D178 N184 A185	L101-A181 HydrophobicContact CB-CB 4.45Å; L101-A181 HydrophobicContact CD1-CB 3.98Å; M167-A181 HydrophobicContact CE-CB 4.48Å; D178-A181 HydrophobicContact CB-CB 4.11Å; D178-A181 PolarHBondContact O-N 3.41Å; D178-A181 PolarHBondContact OD1-N 3.25Å; D178-A181 VanDerWaalsContact OD1-N 3.12Å; A181-N184 PolarHBondContact O-N 2.94Å; A181-A185 WeakPolarHBondContact O-CB 3.19Å; A181-A185 PolarHBondContact O-N 3.25Å
182	I	95.4	Very high	93.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-48.5	175.9	-59.4	172.1	0	0	0	110.1	L164 M167 I168 V177 D178 R179 N184 A185 C186 C250 L251	L164-I182 HydrophobicContact CD2-CB 4.4Å; L164-I182 HydrophobicContact CD2-CG1 4.24Å; L164-I182 HydrophobicContact CD2-CG2 4.4Å; M167-I182 HydrophobicContact CB-CD1 3.99Å; M167-I182 HydrophobicContact CB-CG1 4.4Å; M167-I182 HydrophobicContact CE-CD1 4.15Å; M167-I182 HydrophobicContact CE-CG1 3.84Å; M167-I182 HydrophobicContact SD-CG1 4.2Å; I168-I182 HydrophobicContact CG1-CD1 4.18Å; V177-I182 HydrophobicContact CG2-CD1 4.38Å; D178-I182 PolarHBondContact O-N 3.23Å; R179-I182 PolarHBondContact O-N 2.86Å; I182-N184 PolarHBondContact O-N 2.81Å; I182-A185 PolarHBondContact O-N 3.48Å; I182-C186 WeakPolarHBondContact O-CB 3.24Å; I182-C186 PolarHBondContact O-N 3.14Å; I182-C186 PolarHBondContact O-SG 3.48Å; I182-C250 HydrophobicContact CB-CB 4.25Å; I182-C250 HydrophobicContact CG2-CB 3.94Å; I182-L251 HydrophobicContact CG2-CD2 3.99Å
183	R	96.1	Very high	93.7	Very high	118 Å²	118	53.4 Å²	53.4	45%	0.445	29%	0.286	S	S	.	.	H	α-helix	trans	-58.3	-47.8	179.3	-172.2	-177.6	64.6	-165.5	-2.9	112.2	R179 G180 A185 C186 Q187 C250	R179-R183 WeakPolarHBondContact O-CB 3.47Å; R179-R183 PolarHBondContact O-N 2.95Å; G180-R183 PolarHBondContact O-N 3.33Å; R183-A185 VanDerWaalsContact C-N 3.34Å; R183-A185 PolarHBondContact O-N 3.47Å; R183-C186 PolarHBondContact O-N 2.98Å; R183-Q187 HydrophobicContact CG-CG 4.43Å; R183-Q187 WeakPolarHBondContact O-CB 3.09Å; R183-Q187 VanDerWaalsContact O-CG 3.26Å; R183-Q187 WeakPolarHBondContact O-CG 3.04Å; R183-Q187 PolarHBondContact O-N 3.14Å; R183-C250 VanDerWaalsContact CA-O 3.26Å; R183-C250 WeakPolarHBondContact CA-O 3.36Å
184	N	95.8	Very high	93.6	Very high	45 Å²	45	48.4 Å²	48.4	24%	0.241	27%	0.266	C	S	.	.	H	α-helix	trans	-63.9	-41.2	-178.6	-65	-11.4	0	0	0	111.2	N105 G180 A181 I182 Q187 M188	N105-N184 PolarHBondContact ND2-ND2 3.31Å; G180-N184 WeakPolarHBondContact O-CB 3.47Å; G180-N184 PolarHBondContact O-N 3.35Å; G180-N184 PolarHBondContact O-ND2 2.88Å; G180-N184 PolarHBondContact O-OD1 3.39Å; A181-N184 PolarHBondContact O-N 2.94Å; I182-N184 PolarHBondContact O-N 2.81Å; N184-Q187 PolarHBondContact O-N 3.35Å; N184-M188 WeakPolarHBondContact O-CB 3.42Å; N184-M188 PolarHBondContact O-N 2.89Å
185	A	95.8	Very high	93.3	Very high	8 Å²	8	54.7 Å²	54.7	7%	0.066	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-44	175.8	0	0	0	0	0	112.2	L160 L164 A181 I182 R183 M188 L189	L160-A185 HydrophobicContact CD1-CB 4.32Å; L164-A185 HydrophobicContact CD1-CB 4.02Å; L164-A185 HydrophobicContact CD2-CB 3.88Å; A181-A185 WeakPolarHBondContact O-CB 3.19Å; A181-A185 PolarHBondContact O-N 3.25Å; I182-A185 PolarHBondContact O-N 3.48Å; R183-A185 VanDerWaalsContact C-N 3.34Å; R183-A185 PolarHBondContact O-N 3.47Å; A185-M188 WeakPolarHBondContact O-CB 3.45Å; A185-M188 PolarHBondContact O-N 3.06Å; A185-L189 WeakPolarHBondContact O-CG 3.45Å; A185-L189 PolarHBondContact O-N 3Å
186	C	95.9	Very high	93	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.02	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-43	176.6	-66.5	0	0	0	0	111.7	I182 R183 M188 L189 M190 Y200	I182-C186 WeakPolarHBondContact O-CB 3.24Å; I182-C186 PolarHBondContact O-N 3.14Å; I182-C186 PolarHBondContact O-SG 3.48Å; R183-C186 PolarHBondContact O-N 2.98Å; C186-M188 PolarHBondContact O-N 3.15Å; C186-L189 PolarHBondContact O-N 3.34Å; C186-M190 WeakPolarHBondContact O-CG 3.46Å; C186-M190 PolarHBondContact O-N 3.42Å; C186-Y200 HydrophobicContact CB-CD2 4.31Å; C186-Y200 HydrophobicContact CB-CE2 3.77Å
187	Q	95.2	Very high	93	Very high	99 Å²	99	48.5 Å²	48.5	46%	0.463	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-41.9	175.5	-75	175.5	-11	0	0	112.1	R183 N184 M190 I191	R183-Q187 HydrophobicContact CG-CG 4.43Å; R183-Q187 WeakPolarHBondContact O-CB 3.09Å; R183-Q187 VanDerWaalsContact O-CG 3.26Å; R183-Q187 WeakPolarHBondContact O-CG 3.04Å; R183-Q187 PolarHBondContact O-N 3.14Å; N184-Q187 PolarHBondContact O-N 3.35Å; Q187-M190 PolarHBondContact O-N 3.43Å; Q187-I191 VanDerWaalsContact O-CG1 3.29Å; Q187-I191 WeakPolarHBondContact O-CG1 3.19Å; Q187-I191 PolarHBondContact O-N 3.02Å
188	M	96.3	Very high	93	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-58.7	-50.8	173.1	175.6	-170.4	71.8	0	0	110.8	L104 W108 F146 V151 L160 N184 A185 C186 M190 I191 L192	L104-M188 HydrophobicContact CD2-CE 4.01Å; L104-M188 HydrophobicContact CG-CE 4.36Å; L104-M188 HydrophobicContact CG-SD 4.35Å; W108-M188 HydrophobicContact CB-CG 4.48Å; W108-M188 HydrophobicContact CB-SD 3.94Å; W108-M188 HydrophobicContact CD2-CB 4.41Å; W108-M188 HydrophobicContact CD2-CG 3.64Å; W108-M188 HydrophobicContact CD2-SD 4.15Å; W108-M188 HydrophobicContact CE3-CG 4.18Å; W108-M188 HydrophobicContact CG-CB 4.29Å; W108-M188 HydrophobicContact CG-CG 3.76Å; W108-M188 HydrophobicContact CG-SD 3.86Å; W108-M188 HydrophobicContact CZ2-CG 4.25Å; F146-M188 HydrophobicContact CE1-SD 4.08Å; V151-M188 HydrophobicContact CG2-CE 4.03Å; V151-M188 HydrophobicContact CG2-SD 4.25Å; L160-M188 HydrophobicContact CD2-CE 4.06Å; N184-M188 WeakPolarHBondContact O-CB 3.42Å; N184-M188 PolarHBondContact O-N 2.89Å; A185-M188 WeakPolarHBondContact O-CB 3.45Å; A185-M188 PolarHBondContact O-N 3.06Å; C186-M188 PolarHBondContact O-N 3.15Å; M188-M190 VanDerWaalsContact C-N 3.27Å; M188-M190 PolarHBondContact O-N 2.92Å; M188-I191 PolarHBondContact O-N 3.19Å; M188-I191 VanDerWaalsContact O-N 3.13Å; M188-L192 HydrophobicContact CG-CD1 3.85Å; M188-L192 HydrophobicContact CG-CG 4.28Å; M188-L192 VanDerWaalsContact O-CG 3.27Å; M188-L192 WeakPolarHBondContact O-CG 3.38Å; M188-L192 PolarHBondContact O-N 3.45Å; M188-L192 HydrophobicContact SD-CD1 4.46Å
189	L	95.7	Very high	93.1	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-36.3	179.5	-67.4	173.4	0	0	0	112.5	V151 L160 A185 C186 G193 V199 Y200 F204	V151-L189 HydrophobicContact CG1-CD2 3.99Å; L160-L189 HydrophobicContact CD2-CD2 4.27Å; A185-L189 WeakPolarHBondContact O-CG 3.45Å; A185-L189 PolarHBondContact O-N 3Å; C186-L189 PolarHBondContact O-N 3.34Å; L189-G193 PolarHBondContact O-N 2.59Å; L189-V199 HydrophobicContact CB-CG1 4.44Å; L189-V199 HydrophobicContact CD2-CG1 3.86Å; L189-V199 WeakPolarHBondContact O-CB 3.37Å; L189-Y200 HydrophobicContact CB-CD2 4.19Å; L189-F204 HydrophobicContact CD1-CB 3.79Å
190	M	94.9	Very high	93.3	Very high	45 Å²	45	40.1 Å²	40.1	22%	0.222	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-48.5	173.1	-73.9	-64.5	-67.7	0	0	111.7	C186 Q187 M188 L192 G193 R197 Y200 D252	C186-M190 WeakPolarHBondContact O-CG 3.46Å; C186-M190 PolarHBondContact O-N 3.42Å; Q187-M190 PolarHBondContact O-N 3.43Å; M188-M190 VanDerWaalsContact C-N 3.27Å; M188-M190 PolarHBondContact O-N 2.92Å; M190-L192 VanDerWaalsContact C-N 3.31Å; M190-L192 PolarHBondContact O-N 3.29Å; M190-G193 PolarHBondContact O-N 2.84Å; M190-G193 VanDerWaalsContact O-N 3.07Å; M190-R197 HydrophobicContact CE-CB 4.07Å; M190-R197 HydrophobicContact SD-CB 3.99Å; M190-Y200 HydrophobicContact CG-CD2 4.09Å; M190-Y200 HydrophobicContact CG-CG 3.99Å; M190-Y200 WeakPolarHBondContact SD-CB 3.42Å; M190-Y200 HydrophobicContact SD-CD1 3.66Å; M190-Y200 HydrophobicContact SD-CD2 4.19Å; M190-Y200 HydrophobicContact SD-CE1 4.45Å; M190-Y200 HydrophobicContact SD-CG 3.5Å; M190-Y200 VanDerWaalsContact SD-CG 3.5Å; M190-D252 HydrophobicContact CE-CB 4.48Å; M190-D252 HydrophobicContact CG-CB 4.27Å; M190-D252 HydrophobicContact SD-CB 4.24Å
191	I	94.7	Very high	93.3	Very high	65 Å²	65	43.6 Å²	43.6	33%	0.333	23%	0.225	S	C	.	.	H	α-helix	trans	-64.7	-35.7	-179.5	-65.3	164.3	0	0	0	111.5	W108 L143 Q187 M188 G193 L194	W108-I191 HydrophobicContact CH2-CB 4.4Å; W108-I191 HydrophobicContact CH2-CG2 3.85Å; W108-I191 HydrophobicContact CZ2-CB 3.92Å; W108-I191 HydrophobicContact CZ2-CD1 4.2Å; W108-I191 HydrophobicContact CZ2-CG2 3.65Å; L143-I191 HydrophobicContact CD1-CG2 3.77Å; Q187-I191 VanDerWaalsContact O-CG1 3.29Å; Q187-I191 WeakPolarHBondContact O-CG1 3.19Å; Q187-I191 PolarHBondContact O-N 3.02Å; M188-I191 PolarHBondContact O-N 3.19Å; M188-I191 VanDerWaalsContact O-N 3.13Å; I191-G193 PolarHBondContact O-N 3.1Å; I191-L194 PolarHBondContact O-N 3.41Å
192	L	94.3	Very high	93.4	Very high	1 Å²	1	48 Å²	48	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-15.3	176.3	-67.7	174.1	0	0	0	113.4	W108 L143 F146 R147 V151 M188 M190 L194 V199	W108-L192 HydrophobicContact CE3-CD2 4.42Å; W108-L192 HydrophobicContact CH2-CD2 3.67Å; W108-L192 HydrophobicContact CH2-CG 4.15Å; W108-L192 HydrophobicContact CZ3-CD2 3.51Å; W108-L192 HydrophobicContact CZ3-CG 4.27Å; L143-L192 HydrophobicContact CB-CD2 4.4Å; L143-L192 WeakPolarHBondContact O-CD2 3.39Å; F146-L192 HydrophobicContact CD1-CD1 4.44Å; F146-L192 HydrophobicContact CD1-CD2 4.11Å; R147-L192 HydrophobicContact CB-CB 4.44Å; R147-L192 HydrophobicContact CB-CD2 4.09Å; R147-L192 HydrophobicContact CG-CB 4.45Å; V151-L192 HydrophobicContact CB-CD1 4.25Å; V151-L192 HydrophobicContact CG1-CD1 4.42Å; V151-L192 HydrophobicContact CG2-CD1 3.72Å; M188-L192 HydrophobicContact CG-CD1 3.85Å; M188-L192 HydrophobicContact CG-CG 4.28Å; M188-L192 VanDerWaalsContact O-CG 3.27Å; M188-L192 WeakPolarHBondContact O-CG 3.38Å; M188-L192 PolarHBondContact O-N 3.45Å; M188-L192 HydrophobicContact SD-CD1 4.46Å; M190-L192 VanDerWaalsContact C-N 3.31Å; M190-L192 PolarHBondContact O-N 3.29Å; L192-L194 PolarHBondContact O-N 3.39Å; L192-V199 HydrophobicContact CB-CB 4.42Å; L192-V199 HydrophobicContact CB-CG1 4.04Å; L192-V199 HydrophobicContact CB-CG2 4.41Å
193	G	89.6	Confident	93.3	Very high	10 Å²	10	48.5 Å²	48.5	10%	0.103	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-4.5	170.2	0	0	0	0	0	114.5	L189 M190 I191 E195 G196	L189-G193 PolarHBondContact O-N 2.59Å; M190-G193 PolarHBondContact O-N 2.84Å; M190-G193 VanDerWaalsContact O-N 3.07Å; I191-G193 PolarHBondContact O-N 3.1Å; G193-E195 PolarHBondContact O-N 3.24Å; G193-E195 VanDerWaalsContact O-N 3.14Å; G193-G196 CarbonylContact C-O 3.59Å; G193-G196 WeakPolarHBondContact CA-O 3.38Å; G193-G196 PolarHBondContact O-N 3.07Å
194	L	89	Confident	93.3	Very high	51 Å²	51	42.9 Å²	42.9	27%	0.267	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	-107.2	-177.2	-56.1	176.2	0	0	0	112.1	N140 L143 I144 I191 L192 G196	N140-L194 HydrophobicContact CB-CD2 4.03Å; L143-L194 HydrophobicContact CB-CD2 3.97Å; L143-L194 HydrophobicContact CD1-CD2 3.83Å; L143-L194 HydrophobicContact CG-CD2 4.42Å; I144-L194 HydrophobicContact CD1-CD1 3.88Å; I144-L194 HydrophobicContact CG1-CD1 3.86Å; I191-L194 PolarHBondContact O-N 3.41Å; L192-L194 PolarHBondContact O-N 3.39Å; L194-G196 VanDerWaalsContact C-N 3.32Å
195	E	81.7	Confident	93.3	Very high	198 Å²	198	41.1 Å²	41.1	93%	0.925	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-5	178.8	-60.5	-170.2	166.1	0	0	113.1	G193	G193-E195 PolarHBondContact O-N 3.24Å; G193-E195 VanDerWaalsContact O-N 3.14Å
196	G	86.8	Confident	93.4	Very high	41 Å²	41	43.1 Å²	43.1	42%	0.423	23%	0.231	S	C	.	.	S	Bend	trans	-130.4	-175.5	-178.2	0	0	0	0	0	113.7	G193 L194	G193-G196 CarbonylContact C-O 3.59Å; G193-G196 WeakPolarHBondContact CA-O 3.38Å; G193-G196 PolarHBondContact O-N 3.07Å; L194-G196 VanDerWaalsContact C-N 3.32Å
197	R	92.6	Very high	93.4	Very high	64 Å²	64	44.2 Å²	44.2	24%	0.242	24%	0.238	C	C	.	.	S	Bend	trans	-110.2	9.2	-179.3	68.9	178.6	-62.3	179.3	8.2	114.1	M190 V199 Y200 E201 E205 S254	M190-R197 HydrophobicContact CE-CB 4.07Å; M190-R197 HydrophobicContact SD-CB 3.99Å; R197-V199 VanDerWaalsContact C-N 3.3Å; R197-V199 PolarHBondContact O-N 3.35Å; R197-Y200 PolarHBondContact O-N 2.95Å; R197-Y200 VanDerWaalsContact O-N 3.1Å; R197-E201 HydrophobicContact CG-CB 4.47Å; R197-E201 WeakPolarHBondContact O-CB 3.48Å; R197-E201 PolarHBondContact O-N 3.5Å; R197-E205 IonicContact CZ-OE1 3.39Å; R197-E205 IonicContact CZ-OE2 2.75Å; R197-E205 VanDerWaalsContact CZ-OE2 3.24Å; R197-E205 IonicContact NE-OE2 2.68Å; R197-E205 IonicContact NH1-OE1 3.28Å; R197-E205 IonicContact NH1-OE2 2.67Å; R197-E205 IonicContact NH2-OE1 2.69Å; R197-E205 PolarHBondContact NH2-OE1 3.13Å; R197-E205 IonicContact NH2-OE2 2.75Å; R197-E205 PolarHBondContact NH2-OE2 3.36Å; R197-S254 PolarHBondContact NH1-O 2.93Å; R197-S254 PolarHBondContact NH1-OG 3.23Å; R197-S254 PolarHBondContact NH2-OG 2.97Å
198	S	91.4	Very high	93.5	Very high	51 Å²	51	39.5 Å²	39.5	36%	0.357	22%	0.216	S	C	.	.	H	α-helix	trans	-56.9	-40.6	-168.9	53.8	0	0	0	0	113.4	E201 E202	S198-E201 PolarHBondContact O-N 3Å; S198-E202 VanDerWaalsContact O-CB 3.23Å; S198-E202 WeakPolarHBondContact O-CB 3.35Å; S198-E202 WeakPolarHBondContact O-CG 3.36Å; S198-E202 PolarHBondContact O-N 3.31Å
199	V	94.2	Very high	93.6	Very high	1 Å²	1	41 Å²	41	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-45.7	178.6	178.7	0	0	0	0	111	R147 L189 L192 R197 D203	R147-V199 HydrophobicContact CG-CG2 4.27Å; L189-V199 HydrophobicContact CB-CG1 4.44Å; L189-V199 HydrophobicContact CD2-CG1 3.86Å; L189-V199 WeakPolarHBondContact O-CB 3.37Å; L192-V199 HydrophobicContact CB-CB 4.42Å; L192-V199 HydrophobicContact CB-CG1 4.04Å; L192-V199 HydrophobicContact CB-CG2 4.41Å; R197-V199 VanDerWaalsContact C-N 3.3Å; R197-V199 PolarHBondContact O-N 3.35Å; V199-D203 WeakPolarHBondContact O-CB 3.48Å; V199-D203 PolarHBondContact O-N 2.96Å
200	Y	96.1	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-43.7	174.8	175.4	-99.2	0	0	0	112.3	C186 L189 M190 R197 F204 E205 D252 T255	C186-Y200 HydrophobicContact CB-CD2 4.31Å; C186-Y200 HydrophobicContact CB-CE2 3.77Å; L189-Y200 HydrophobicContact CB-CD2 4.19Å; M190-Y200 HydrophobicContact CG-CD2 4.09Å; M190-Y200 HydrophobicContact CG-CG 3.99Å; M190-Y200 WeakPolarHBondContact SD-CB 3.42Å; M190-Y200 HydrophobicContact SD-CD1 3.66Å; M190-Y200 HydrophobicContact SD-CD2 4.19Å; M190-Y200 HydrophobicContact SD-CE1 4.45Å; M190-Y200 HydrophobicContact SD-CG 3.5Å; M190-Y200 VanDerWaalsContact SD-CG 3.5Å; R197-Y200 PolarHBondContact O-N 2.95Å; R197-Y200 VanDerWaalsContact O-N 3.1Å; Y200-F204 HydrophobicContact CD2-CD1 4.09Å; Y200-F204 AromaticContact CE2-CD1 3.45Å; Y200-F204 HydrophobicContact CE2-CD1 3.45Å; Y200-F204 VanDerWaalsContact CE2-CD1 3.45Å; Y200-F204 AromaticContact CE2-CE1 3.92Å; Y200-F204 HydrophobicContact CE2-CE1 3.92Å; Y200-F204 HydrophobicContact CE2-CG 4.46Å; Y200-F204 AromaticContact CZ-CD1 3.78Å; Y200-F204 PolarHBondContact O-N 3.26Å; Y200-F204 VanDerWaalsContact O-N 3.11Å; Y200-E205 HydrophobicContact CD1-CB 4.11Å; Y200-E205 HydrophobicContact CE1-CB 3.8Å; Y200-E205 HydrophobicContact CE1-CG 4.09Å; Y200-E205 PolarHBondContact O-N 3.43Å; Y200-D252 HydrophobicContact CE1-CB 4.22Å; Y200-T255 WeakPolarHBondContact CE1-OG1 3.48Å; Y200-T255 PolarHBondContact OH-OG1 3.04Å
201	E	94.9	Very high	93.7	Very high	93 Å²	93	46.8 Å²	46.8	44%	0.435	25%	0.251	S	S	.	.	I	π-helix	trans	-65.2	-51.6	-177.7	-173.8	173.3	175.2	0	0	112	R197 S198 E205 A206	R197-E201 HydrophobicContact CG-CB 4.47Å; R197-E201 WeakPolarHBondContact O-CB 3.48Å; R197-E201 PolarHBondContact O-N 3.5Å; S198-E201 PolarHBondContact O-N 3Å; E201-E205 PolarHBondContact O-N 3.47Å; E201-A206 WeakPolarHBondContact O-CB 3.47Å; E201-A206 PolarHBondContact O-N 3.48Å
202	E	94.3	Very high	93.8	Very high	109 Å²	109	43.7 Å²	43.7	51%	0.509	24%	0.235	S	C	.	.	I	π-helix	trans	-72.3	-44.7	-177.9	-67.6	169.4	-176.9	0	0	112.5	R152 S198	R152-E202 IonicContact CZ-OE2 3.87Å; R152-E202 IonicContact NH1-OE2 2.79Å; R152-E202 IonicContact NH2-OE2 2.62Å; R152-E202 PolarHBondContact NH2-OE2 3.31Å; S198-E202 VanDerWaalsContact O-CB 3.23Å; S198-E202 WeakPolarHBondContact O-CB 3.35Å; S198-E202 WeakPolarHBondContact O-CG 3.36Å; S198-E202 PolarHBondContact O-N 3.31Å
203	D	93.8	Very high	94	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.048	24%	0.24	C	C	.	.	I	π-helix	trans	-86.2	-22	-169.2	-61.4	-33.4	0	0	0	112.2	R152 R157 R161 V199	R152-D203 IonicContact CZ-OD2 2.81Å; R152-D203 IonicContact NE-OD1 3.75Å; R152-D203 IonicContact NE-OD2 2.8Å; R152-D203 PolarHBondContact NE-OD2 3.5Å; R152-D203 IonicContact NH2-OD1 2.87Å; R152-D203 IonicContact NH2-OD2 3.85Å; R152-D203 PolarHBondContact NH2-OD2 2.99Å; R157-D203 WeakPolarHBondContact CD-OD1 3.44Å; R157-D203 HydrophobicContact CG-CB 4.36Å; R161-D203 PolarHBondContact NE-O 3.22Å; V199-D203 WeakPolarHBondContact O-CB 3.48Å; V199-D203 PolarHBondContact O-N 2.96Å
204	F	96.1	Very high	94.3	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	26%	0.26	C	S	.	.	I	π-helix	trans	-133.6	-57.4	-177.6	172.9	-100	0	0	0	115.2	L164 L165 I168 L189 Y200 A206 P207 F208 L251	L164-F204 HydrophobicContact CB-CD2 4.02Å; L164-F204 HydrophobicContact CB-CE2 3.73Å; L164-F204 HydrophobicContact CD1-CD2 3.8Å; L164-F204 HydrophobicContact CD1-CE2 4.13Å; L165-F204 HydrophobicContact CD2-CE2 4.21Å; I168-F204 HydrophobicContact CD1-CE2 4.1Å; I168-F204 HydrophobicContact CD1-CZ 3.76Å; L189-F204 HydrophobicContact CD1-CB 3.79Å; Y200-F204 HydrophobicContact CD2-CD1 4.09Å; Y200-F204 AromaticContact CE2-CD1 3.45Å; Y200-F204 HydrophobicContact CE2-CD1 3.45Å; Y200-F204 VanDerWaalsContact CE2-CD1 3.45Å; Y200-F204 AromaticContact CE2-CE1 3.92Å; Y200-F204 HydrophobicContact CE2-CE1 3.92Å; Y200-F204 HydrophobicContact CE2-CG 4.46Å; Y200-F204 AromaticContact CZ-CD1 3.78Å; Y200-F204 PolarHBondContact O-N 3.26Å; Y200-F204 VanDerWaalsContact O-N 3.11Å; F204-A206 PolarHBondContact O-N 3.31Å; F204-P207 WeakPolarHBondContact O-CD 3.46Å; F204-F208 HydrophobicContact CE1-CB 4.24Å; F204-F208 HydrophobicContact CE1-CG 4.37Å; F204-F208 HydrophobicContact CE2-CB 4.26Å; F204-F208 HydrophobicContact CZ-CB 4.04Å; F204-F208 HydrophobicContact CZ-CD2 4.39Å; F204-F208 HydrophobicContact CZ-CG 4.12Å; F204-F208 VanDerWaalsContact O-CB 3.26Å; F204-F208 WeakPolarHBondContact O-CB 3.4Å; F204-F208 PolarHBondContact O-N 3.14Å; F204-L251 HydrophobicContact CE1-CD2 3.77Å; F204-L251 HydrophobicContact CZ-CD2 3.75Å
205	E	96.9	Very high	94.6	Very high	7 Å²	7	49.3 Å²	49.3	3%	0.033	26%	0.258	C	S	.	.	I	π-helix	trans	-64.7	-46.9	-166.4	-170.2	-173	-152.4	0	0	113.1	R197 Y200 E201 F208 L209 T255	R197-E205 IonicContact CZ-OE1 3.39Å; R197-E205 IonicContact CZ-OE2 2.75Å; R197-E205 VanDerWaalsContact CZ-OE2 3.24Å; R197-E205 IonicContact NE-OE2 2.68Å; R197-E205 IonicContact NH1-OE1 3.28Å; R197-E205 IonicContact NH1-OE2 2.67Å; R197-E205 IonicContact NH2-OE1 2.69Å; R197-E205 PolarHBondContact NH2-OE1 3.13Å; R197-E205 IonicContact NH2-OE2 2.75Å; R197-E205 PolarHBondContact NH2-OE2 3.36Å; Y200-E205 HydrophobicContact CD1-CB 4.11Å; Y200-E205 HydrophobicContact CE1-CB 3.8Å; Y200-E205 HydrophobicContact CE1-CG 4.09Å; Y200-E205 PolarHBondContact O-N 3.43Å; E201-E205 PolarHBondContact O-N 3.47Å; E205-F208 WeakPolarHBondContact O-CB 3.47Å; E205-F208 PolarHBondContact O-N 3.45Å; E205-F208 VanDerWaalsContact O-N 3.14Å; E205-L209 HydrophobicContact CG-CD1 4.02Å; E205-L209 HydrophobicContact CG-CG 4.26Å; E205-L209 VanDerWaalsContact O-CG 3.27Å; E205-L209 WeakPolarHBondContact O-CG 3.46Å; E205-L209 PolarHBondContact O-N 2.71Å; E205-T255 HydrophobicContact CG-CG2 3.98Å; E205-T255 WeakPolarHBondContact OE1-CA 3.28Å; E205-T255 PolarHBondContact OE1-OG1 3.47Å
206	A	96.8	Very high	95.4	Very high	51 Å²	51	39.9 Å²	39.9	42%	0.421	21%	0.214	S	C	.	.	H	α-helix	trans	-60.4	-49.6	179.4	0	0	0	0	0	111.9	E201 F204 F208 L209 E210	E201-A206 WeakPolarHBondContact O-CB 3.47Å; E201-A206 PolarHBondContact O-N 3.48Å; F204-A206 PolarHBondContact O-N 3.31Å; A206-F208 VanDerWaalsContact C-N 3.31Å; A206-F208 PolarHBondContact O-N 3.46Å; A206-L209 PolarHBondContact O-N 3.27Å; A206-E210 PolarHBondContact O-N 3.46Å
207	P	96.6	Very high	95.8	Very high	26 Å²	26	42.1 Å²	42.1	17%	0.169	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-38	170.1	-25.6	32.1	0	0	0	114.4	R161 L165 F204 E210 M211	R161-P207 HydrophobicContact CG-CB 4.19Å; R161-P207 HydrophobicContact CG-CG 4.41Å; L165-P207 HydrophobicContact CD1-CB 4.18Å; F204-P207 WeakPolarHBondContact O-CD 3.46Å; P207-E210 PolarHBondContact O-N 2.88Å; P207-M211 WeakPolarHBondContact O-CB 3.38Å; P207-M211 PolarHBondContact O-N 3.1Å
208	F	97.2	Very high	96	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-43.7	176.7	162.5	-107.7	0	0	0	112.1	L165 I168 F204 E205 A206 S212 L251 T255 I259	L165-F208 VanDerWaalsContact CD2-CA 3.47Å; L165-F208 HydrophobicContact CD2-CB 3.69Å; L165-F208 HydrophobicContact CD2-CD2 4.21Å; L165-F208 HydrophobicContact CD2-CG 4.47Å; I168-F208 HydrophobicContact CD1-CD2 3.9Å; I168-F208 HydrophobicContact CD1-CE2 3.98Å; I168-F208 HydrophobicContact CG2-CE2 3.97Å; F204-F208 HydrophobicContact CE1-CB 4.24Å; F204-F208 HydrophobicContact CE1-CG 4.37Å; F204-F208 HydrophobicContact CE2-CB 4.26Å; F204-F208 HydrophobicContact CZ-CB 4.04Å; F204-F208 HydrophobicContact CZ-CD2 4.39Å; F204-F208 HydrophobicContact CZ-CG 4.12Å; F204-F208 VanDerWaalsContact O-CB 3.26Å; F204-F208 WeakPolarHBondContact O-CB 3.4Å; F204-F208 PolarHBondContact O-N 3.14Å; E205-F208 WeakPolarHBondContact O-CB 3.47Å; E205-F208 PolarHBondContact O-N 3.45Å; E205-F208 VanDerWaalsContact O-N 3.14Å; A206-F208 VanDerWaalsContact C-N 3.31Å; A206-F208 PolarHBondContact O-N 3.46Å; F208-S212 WeakPolarHBondContact CE2-OG 3.42Å; F208-S212 WeakPolarHBondContact O-CB 3.21Å; F208-S212 PolarHBondContact O-N 2.9Å; F208-S212 PolarHBondContact O-OG 2.85Å; F208-L251 HydrophobicContact CE1-CD1 3.93Å; F208-L251 HydrophobicContact CZ-CD1 3.96Å; F208-T255 HydrophobicContact CD1-CG2 4.16Å; F208-T255 HydrophobicContact CE1-CG2 3.88Å; F208-I259 HydrophobicContact CE1-CB 4.2Å; F208-I259 HydrophobicContact CE1-CD1 3.81Å; F208-I259 HydrophobicContact CE1-CG1 4.02Å; F208-I259 HydrophobicContact CZ-CD1 3.72Å; F208-I259 HydrophobicContact CZ-CG1 3.96Å
209	L	98	Very high	96.1	Very high	34 Å²	34	43.5 Å²	43.5	18%	0.178	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-37.9	177.4	-67	173.5	0	0	0	111.5	E205 A206 S212 A213 P258 I259 V262	E205-L209 HydrophobicContact CG-CD1 4.02Å; E205-L209 HydrophobicContact CG-CG 4.26Å; E205-L209 VanDerWaalsContact O-CG 3.27Å; E205-L209 WeakPolarHBondContact O-CG 3.46Å; E205-L209 PolarHBondContact O-N 2.71Å; A206-L209 PolarHBondContact O-N 3.27Å; L209-S212 PolarHBondContact O-N 3.49Å; L209-A213 WeakPolarHBondContact O-CB 3.37Å; L209-A213 PolarHBondContact O-N 2.95Å; L209-P258 HydrophobicContact CD1-CB 3.68Å; L209-P258 HydrophobicContact CD2-CB 3.94Å; L209-P258 HydrophobicContact CG-CB 4.48Å; L209-I259 HydrophobicContact CD2-CB 3.99Å; L209-I259 HydrophobicContact CD2-CD1 4.02Å; L209-V262 HydrophobicContact CB-CG2 4.4Å; L209-V262 HydrophobicContact CD2-CG2 4.12Å
210	E	96.8	Very high	96.1	Very high	130 Å²	130	43.5 Å²	43.5	61%	0.607	22%	0.221	S	C	*	.	H	α-helix	trans	-64	-53.3	175.8	-173.8	170.7	-156.1	0	0	111.6	A206 P207 S212 A213 E214	A206-E210 PolarHBondContact O-N 3.46Å; P207-E210 PolarHBondContact O-N 2.88Å; E210-S212 PolarHBondContact O-N 2.82Å; E210-A213 WeakPolarHBondContact O-CB 3.42Å; E210-A213 PolarHBondContact O-N 3.05Å; E210-E214 PolarHBondContact O-N 3.24Å; E210-E214 VanDerWaalsContact O-N 3.09Å
211	M	96	Very high	96.1	Very high	41 Å²	41	48.8 Å²	48.8	20%	0.202	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-37.2	175.8	-176.1	-163.6	68.4	0	0	111.8	L165 P207 E214 F215	L165-M211 HydrophobicContact CB-CE 4.11Å; L165-M211 HydrophobicContact CB-SD 3.75Å; L165-M211 HydrophobicContact CD1-SD 4.4Å; L165-M211 HydrophobicContact CD2-CE 3.89Å; L165-M211 HydrophobicContact CD2-SD 4.25Å; L165-M211 HydrophobicContact CG-SD 4.35Å; P207-M211 WeakPolarHBondContact O-CB 3.38Å; P207-M211 PolarHBondContact O-N 3.1Å; M211-E214 PolarHBondContact O-N 2.94Å; M211-F215 WeakPolarHBondContact O-CB 3.46Å; M211-F215 PolarHBondContact O-N 3.47Å
212	S	97.1	Very high	96	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-38.1	176.2	-61.6	0	0	0	0	112.1	R172 F208 L209 E210 F215 F216	R172-S212 PolarHBondContact NH1-OG 3.14Å; R172-S212 PolarHBondContact NH2-OG 3.02Å; F208-S212 WeakPolarHBondContact CE2-OG 3.42Å; F208-S212 WeakPolarHBondContact O-CB 3.21Å; F208-S212 PolarHBondContact O-N 2.9Å; F208-S212 PolarHBondContact O-OG 2.85Å; L209-S212 PolarHBondContact O-N 3.49Å; E210-S212 PolarHBondContact O-N 2.82Å; S212-F215 PolarHBondContact O-N 3.19Å; S212-F216 WeakPolarHBondContact O-CD2 3.47Å; S212-F216 PolarHBondContact O-N 3.3Å
213	A	97.6	Very high	96	Very high	13 Å²	13	45.4 Å²	45.4	11%	0.107	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-44.8	175.2	0	0	0	0	0	111.5	L209 E210 F216 Q217 V262 E266	L209-A213 WeakPolarHBondContact O-CB 3.37Å; L209-A213 PolarHBondContact O-N 2.95Å; E210-A213 WeakPolarHBondContact O-CB 3.42Å; E210-A213 PolarHBondContact O-N 3.05Å; A213-F216 PolarHBondContact O-N 3.43Å; A213-Q217 VanDerWaalsContact O-CB 3.28Å; A213-Q217 WeakPolarHBondContact O-CB 3.29Å; A213-Q217 PolarHBondContact O-N 2.92Å; A213-V262 HydrophobicContact CB-CG1 3.75Å; A213-E266 HydrophobicContact CB-CG 4.31Å
214	E	96.4	Very high	96	Very high	114 Å²	114	46.7 Å²	46.7	53%	0.533	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-43.9	175.9	-66.8	-177.3	171.9	0	0	112	E210 M211 Q217 L218	E210-E214 PolarHBondContact O-N 3.24Å; E210-E214 VanDerWaalsContact O-N 3.09Å; M211-E214 PolarHBondContact O-N 2.94Å; E214-Q217 PolarHBondContact O-N 3.18Å; E214-L218 PolarHBondContact O-N 3.01Å; E214-L218 VanDerWaalsContact O-N 3.12Å
215	F	96	Very high	95.8	Very high	52 Å²	52	51.1 Å²	51.1	23%	0.228	27%	0.265	C	S	.	.	H	α-helix	trans	-58.1	-52.3	176.2	174.8	-93	0	0	0	111.8	R172 M211 S212 Q217 L218 E219	R172-F215 HydrophobicContact CB-CE2 4.37Å; R172-F215 HydrophobicContact CB-CZ 4.07Å; M211-F215 WeakPolarHBondContact O-CB 3.46Å; M211-F215 PolarHBondContact O-N 3.47Å; S212-F215 PolarHBondContact O-N 3.19Å; F215-Q217 VanDerWaalsContact C-N 3.3Å; F215-Q217 PolarHBondContact O-N 3.32Å; F215-L218 PolarHBondContact O-N 3.44Å; F215-E219 WeakPolarHBondContact O-CB 3.45Å; F215-E219 PolarHBondContact O-N 3.44Å
216	F	97.6	Very high	95.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.9	-27.9	-179.2	-70.3	-54.9	0	0	0	112.8	S212 A213 E219 S220 R239 E243 V262 V263 E266 L267	S212-F216 WeakPolarHBondContact O-CD2 3.47Å; S212-F216 PolarHBondContact O-N 3.3Å; A213-F216 PolarHBondContact O-N 3.43Å; F216-E219 PolarHBondContact O-N 2.6Å; F216-S220 VanDerWaalsContact O-CB 3.28Å; F216-S220 WeakPolarHBondContact O-CB 3.47Å; F216-S220 PolarHBondContact O-N 2.79Å; F216-S220 PolarHBondContact O-OG 3.29Å; F216-R239 HydrophobicContact CE1-CB 4.28Å; F216-R239 HydrophobicContact CE1-CG 4.27Å; F216-E243 HydrophobicContact CE2-CG 4.25Å; F216-E243 HydrophobicContact CZ-CG 3.8Å; F216-E243 WeakPolarHBondContact CZ-OE1 3.37Å; F216-V262 HydrophobicContact CD2-CG1 4.37Å; F216-V263 HydrophobicContact CD2-CG2 3.96Å; F216-V263 HydrophobicContact CE1-CG2 4.46Å; F216-V263 HydrophobicContact CE2-CG2 3.46Å; F216-V263 VanDerWaalsContact CE2-CG2 3.46Å; F216-V263 HydrophobicContact CZ-CG2 3.74Å; F216-E266 HydrophobicContact CB-CB 3.73Å; F216-E266 HydrophobicContact CB-CG 4.26Å; F216-L267 HydrophobicContact CB-CD2 3.99Å; F216-L267 HydrophobicContact CB-CG 4.25Å; F216-L267 HydrophobicContact CD1-CD1 3.94Å; F216-L267 HydrophobicContact CD1-CD2 4.26Å; F216-L267 HydrophobicContact CD1-CG 4.24Å; F216-L267 HydrophobicContact CE1-CD1 4.43Å; F216-L267 HydrophobicContact CG-CG 4.45Å; F216-L267 WeakPolarHBondContact O-CD2 3.37Å
217	Q	96.5	Very high	95.4	Very high	88 Å²	88	55.5 Å²	55.5	41%	0.411	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-49.5	172.1	-174.8	179.8	19.5	0	0	111	A213 E214 F215 S220 Q221	A213-Q217 VanDerWaalsContact O-CB 3.28Å; A213-Q217 WeakPolarHBondContact O-CB 3.29Å; A213-Q217 PolarHBondContact O-N 2.92Å; E214-Q217 PolarHBondContact O-N 3.18Å; F215-Q217 VanDerWaalsContact C-N 3.3Å; F215-Q217 PolarHBondContact O-N 3.32Å; Q217-S220 PolarHBondContact O-N 2.76Å; Q217-S220 PolarHBondContact O-OG 3.12Å; Q217-Q221 PolarHBondContact O-N 3.23Å
218	L	95.1	Very high	95.3	Very high	121 Å²	121	56.6 Å²	56.6	63%	0.634	29%	0.287	S	S	*	.	H	α-helix	trans	-64.7	-42.2	177.1	-68.6	171.8	0	0	0	111.8	E214 F215 S220 Q221 K222	E214-L218 PolarHBondContact O-N 3.01Å; E214-L218 VanDerWaalsContact O-N 3.12Å; F215-L218 PolarHBondContact O-N 3.44Å; L218-S220 PolarHBondContact O-N 2.8Å; L218-Q221 PolarHBondContact O-N 3.36Å; L218-K222 PolarHBondContact O-N 2.93Å
219	E	94.8	Very high	95.1	Very high	23 Å²	23	56.6 Å²	56.6	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-38.6	179.3	-173.8	165.3	-113.4	0	0	112.2	F215 F216 Q221 K222 F223 R239	F215-E219 WeakPolarHBondContact O-CB 3.45Å; F215-E219 PolarHBondContact O-N 3.44Å; F216-E219 PolarHBondContact O-N 2.6Å; E219-Q221 VanDerWaalsContact C-N 3.32Å; E219-Q221 PolarHBondContact O-N 2.92Å; E219-K222 PolarHBondContact O-N 3.36Å; E219-F223 HydrophobicContact CG-CD1 3.93Å; E219-F223 HydrophobicContact CG-CD2 4.1Å; E219-F223 HydrophobicContact CG-CE1 3.54Å; E219-F223 HydrophobicContact CG-CE2 3.72Å; E219-F223 HydrophobicContact CG-CG 4.19Å; E219-F223 HydrophobicContact CG-CZ 3.43Å; E219-F223 VanDerWaalsContact CG-CZ 3.43Å; E219-F223 WeakPolarHBondContact O-CB 3.44Å; E219-F223 WeakPolarHBondContact O-CG 3.32Å; E219-F223 PolarHBondContact O-N 2.9Å; E219-F223 WeakPolarHBondContact OE1-CZ 3.36Å; E219-R239 IonicContact OE1-CZ 3.95Å; E219-R239 IonicContact OE1-NE 3.3Å; E219-R239 PolarHBondContact OE1-NE 2.62Å; E219-R239 IonicContact OE1-NH2 3.41Å; E219-R239 PolarHBondContact OE1-NH2 3.16Å; E219-R239 IonicContact OE2-CZ 3.89Å; E219-R239 IonicContact OE2-NE 3.28Å; E219-R239 PolarHBondContact OE2-NE 2.88Å; E219-R239 IonicContact OE2-NH2 3.26Å
220	S	94.8	Very high	94.7	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.007	28%	0.283	C	S	.	.	H	α-helix	trans	-57.8	-44.2	177.5	72.3	0	0	0	0	112.2	F216 Q217 L218 F223 L224 H271	F216-S220 VanDerWaalsContact O-CB 3.28Å; F216-S220 WeakPolarHBondContact O-CB 3.47Å; F216-S220 PolarHBondContact O-N 2.79Å; F216-S220 PolarHBondContact O-OG 3.29Å; Q217-S220 PolarHBondContact O-N 2.76Å; Q217-S220 PolarHBondContact O-OG 3.12Å; L218-S220 PolarHBondContact O-N 2.8Å; S220-F223 PolarHBondContact O-N 3.05Å; S220-L224 WeakPolarHBondContact O-CB 3.37Å; S220-L224 VanDerWaalsContact O-CG 3.26Å; S220-L224 WeakPolarHBondContact O-CG 3.26Å; S220-L224 PolarHBondContact O-N 3.36Å; S220-H271 VanDerWaalsContact CB-NE2 3.32Å; S220-H271 WeakPolarHBondContact CB-NE2 3.21Å; S220-H271 PolarHBondContact OG-NE2 2.86Å
221	Q	94.1	Very high	94.5	Very high	112 Å²	112	52.4 Å²	52.4	52%	0.523	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-45.5	179.9	-66.1	178.8	5.2	0	0	110.9	Q217 L218 E219 F223 L224 S225	Q217-Q221 PolarHBondContact O-N 3.23Å; L218-Q221 PolarHBondContact O-N 3.36Å; E219-Q221 VanDerWaalsContact C-N 3.32Å; E219-Q221 PolarHBondContact O-N 2.92Å; Q221-F223 PolarHBondContact O-N 3.28Å; Q221-L224 PolarHBondContact O-N 3.21Å; Q221-S225 PolarHBondContact O-N 2.75Å; Q221-S225 VanDerWaalsContact O-N 3.07Å; Q221-S225 PolarHBondContact O-OG 3.26Å
222	K	94.5	Very high	94.5	Very high	114 Å²	114	50.5 Å²	50.5	50%	0.496	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-44.5	176.1	-175.3	-179.9	179.8	-179.2	0	111.8	L218 E219 L224 S225 E226	L218-K222 PolarHBondContact O-N 2.93Å; E219-K222 PolarHBondContact O-N 3.36Å; K222-L224 VanDerWaalsContact C-N 3.35Å; K222-L224 PolarHBondContact O-N 3.16Å; K222-S225 PolarHBondContact O-N 2.85Å; K222-S225 PolarHBondContact O-OG 3.28Å; K222-E226 VanDerWaalsContact CE-CD 3.48Å; K222-E226 WeakPolarHBondContact CE-OE1 3.47Å; K222-E226 VanDerWaalsContact CE-OE2 3.22Å; K222-E226 WeakPolarHBondContact CE-OE2 3.46Å; K222-E226 HydrophobicContact CG-CG 4.4Å; K222-E226 WeakPolarHBondContact CG-OE1 3.47Å; K222-E226 WeakPolarHBondContact O-CB 3.48Å; K222-E226 WeakPolarHBondContact O-CG 3.4Å; K222-E226 PolarHBondContact O-N 2.87Å; K222-E226 VanDerWaalsContact O-N 3.1Å
223	F	94.4	Very high	94.3	Very high	17 Å²	17	50.6 Å²	50.6	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-41.4	179.7	-77.2	5.3	0	0	0	111.7	E219 S220 Q221 N227 Y232 K235	E219-F223 HydrophobicContact CG-CD1 3.93Å; E219-F223 HydrophobicContact CG-CD2 4.1Å; E219-F223 HydrophobicContact CG-CE1 3.54Å; E219-F223 HydrophobicContact CG-CE2 3.72Å; E219-F223 HydrophobicContact CG-CG 4.19Å; E219-F223 HydrophobicContact CG-CZ 3.43Å; E219-F223 VanDerWaalsContact CG-CZ 3.43Å; E219-F223 WeakPolarHBondContact O-CB 3.44Å; E219-F223 WeakPolarHBondContact O-CG 3.32Å; E219-F223 PolarHBondContact O-N 2.9Å; E219-F223 WeakPolarHBondContact OE1-CZ 3.36Å; S220-F223 PolarHBondContact O-N 3.05Å; Q221-F223 PolarHBondContact O-N 3.28Å; F223-N227 WeakPolarHBondContact CA-ND2 3.26Å; F223-N227 VanDerWaalsContact O-CB 3.28Å; F223-N227 WeakPolarHBondContact O-CB 3.41Å; F223-N227 PolarHBondContact O-N 2.68Å; F223-N227 VanDerWaalsContact O-N 3.16Å; F223-N227 PolarHBondContact O-ND2 2.72Å; F223-Y232 HydrophobicContact CB-CD2 3.5Å; F223-Y232 HydrophobicContact CB-CE2 3.47Å; F223-Y232 VanDerWaalsContact CB-CE2 3.47Å; F223-Y232 HydrophobicContact CD2-CE2 4.47Å; F223-K235 HydrophobicContact CD1-CD 4.19Å; F223-K235 HydrophobicContact CD2-CB 3.96Å; F223-K235 HydrophobicContact CD2-CD 4.2Å; F223-K235 HydrophobicContact CE1-CD 4.01Å; F223-K235 HydrophobicContact CE2-CB 3.61Å; F223-K235 HydrophobicContact CE2-CD 4.04Å; F223-K235 HydrophobicContact CE2-CG 4.39Å; F223-K235 HydrophobicContact CG-CD 4.28Å; F223-K235 HydrophobicContact CZ-CB 4.18Å; F223-K235 HydrophobicContact CZ-CD 3.93Å
224	L	93.1	Very high	94.1	Very high	35 Å²	35	55.8 Å²	55.8	18%	0.183	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-35.3	177.2	-71.4	171.1	0	0	0	112.9	S220 Q221 K222 Y232 H271 T274 I275 M278	S220-L224 WeakPolarHBondContact O-CB 3.37Å; S220-L224 VanDerWaalsContact O-CG 3.26Å; S220-L224 WeakPolarHBondContact O-CG 3.26Å; S220-L224 PolarHBondContact O-N 3.36Å; Q221-L224 PolarHBondContact O-N 3.21Å; K222-L224 VanDerWaalsContact C-N 3.35Å; K222-L224 PolarHBondContact O-N 3.16Å; L224-Y232 HydrophobicContact CD2-CD2 3.87Å; L224-Y232 HydrophobicContact CD2-CE2 3.64Å; L224-Y232 HydrophobicContact CG-CD2 4.18Å; L224-Y232 HydrophobicContact CG-CE2 3.66Å; L224-H271 HydrophobicContact CD1-CB 4.16Å; L224-T274 HydrophobicContact CD1-CG2 4.44Å; L224-T274 HydrophobicContact CD2-CG2 4.34Å; L224-I275 HydrophobicContact CD2-CG1 4.03Å; L224-M278 HydrophobicContact CD2-CE 3.66Å
225	S	92.6	Very high	94	Very high	94 Å²	94	53.7 Å²	53.7	66%	0.657	27%	0.272	S	S	*	.	H	α-helix	trans	-77.8	-31.6	-179.9	58.6	0	0	0	0	113.9	Q221 K222	Q221-S225 PolarHBondContact O-N 2.75Å; Q221-S225 VanDerWaalsContact O-N 3.07Å; Q221-S225 PolarHBondContact O-OG 3.26Å; K222-S225 PolarHBondContact O-N 2.85Å; K222-S225 PolarHBondContact O-OG 3.28Å
226	E	93.1	Very high	93.9	Very high	121 Å²	121	51.2 Å²	51.2	57%	0.565	26%	0.261	S	S	*	.	H	α-helix	trans	-101	-12.4	-170.5	-66.4	175.4	178.1	0	0	114.1	K222	K222-E226 VanDerWaalsContact CE-CD 3.48Å; K222-E226 WeakPolarHBondContact CE-OE1 3.47Å; K222-E226 VanDerWaalsContact CE-OE2 3.22Å; K222-E226 WeakPolarHBondContact CE-OE2 3.46Å; K222-E226 HydrophobicContact CG-CG 4.4Å; K222-E226 WeakPolarHBondContact CG-OE1 3.47Å; K222-E226 WeakPolarHBondContact O-CB 3.48Å; K222-E226 WeakPolarHBondContact O-CG 3.4Å; K222-E226 PolarHBondContact O-N 2.87Å; K222-E226 VanDerWaalsContact O-N 3.1Å
227	N	92.3	Very high	93.8	Very high	29 Å²	29	55 Å²	55	16%	0.155	28%	0.279	C	S	.	.	S	Bend	trans	-131.7	152.6	-166.8	-52.9	-94.7	0	0	0	112.5	F223 V231 K235	F223-N227 WeakPolarHBondContact CA-ND2 3.26Å; F223-N227 VanDerWaalsContact O-CB 3.28Å; F223-N227 WeakPolarHBondContact O-CB 3.41Å; F223-N227 PolarHBondContact O-N 2.68Å; F223-N227 VanDerWaalsContact O-N 3.16Å; F223-N227 PolarHBondContact O-ND2 2.72Å; N227-V231 HydrophobicContact CB-CB 4.08Å; N227-V231 HydrophobicContact CB-CG1 3.91Å; N227-V231 WeakPolarHBondContact OD1-CG1 3.44Å; N227-K235 PolarHBondContact OD1-NZ 2.88Å
228	S	93.1	Very high	93.7	Very high	50 Å²	50	52.7 Å²	52.7	35%	0.35	28%	0.275	S	S	.	.			trans	-73	160.8	167.2	64.3	0	0	0	0	111.3	S230 V231 Y232	S228-S230 VanDerWaalsContact C-N 3.3Å; S228-S230 PolarHBondContact O-N 3.42Å; S228-V231 PolarHBondContact O-N 3.27Å; S228-V231 VanDerWaalsContact O-N 3.07Å; S228-V231 WeakPolarHBondContact OG-CG2 3.46Å; S228-Y232 WeakPolarHBondContact O-CB 3.33Å; S228-Y232 PolarHBondContact O-N 3.33Å
229	A	92.5	Very high	93.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-54	-42.7	179.6	0	0	0	0	0	113.2	V231 Y232 I233 I275 M278 S281 M286 M298	A229-V231 PolarHBondContact O-N 3.34Å; A229-Y232 WeakPolarHBondContact O-CB 3.37Å; A229-Y232 PolarHBondContact O-N 3.07Å; A229-I233 WeakPolarHBondContact O-CD1 3.28Å; A229-I233 WeakPolarHBondContact O-CG1 3.34Å; A229-I233 PolarHBondContact O-N 2.95Å; A229-I275 HydrophobicContact CB-CG2 4.42Å; A229-M278 HydrophobicContact CB-CB 4.44Å; A229-M278 HydrophobicContact CB-SD 3.98Å; A229-M278 PolarHBondContact N-SD 3.4Å; A229-M278 VanDerWaalsContact N-SD 3.36Å; A229-S281 WeakPolarHBondContact CB-O 3.37Å; A229-S281 PolarHBondContact N-OG 3.41Å; A229-M286 HydrophobicContact CB-CE 3.97Å; A229-M298 HydrophobicContact CB-CE 4.36Å
230	S	90.2	Very high	93.8	Very high	16 Å²	16	47.6 Å²	47.6	11%	0.112	25%	0.247	C	C	.	.	H	α-helix	trans	-63.3	-39.9	178.6	-47.3	0	0	0	0	112.5	S228 K234 M286 D294	S228-S230 VanDerWaalsContact C-N 3.3Å; S228-S230 PolarHBondContact O-N 3.42Å; S230-K234 WeakPolarHBondContact O-CG 3.15Å; S230-K234 PolarHBondContact O-N 2.83Å; S230-M286 WeakPolarHBondContact OG-CE 3.41Å; S230-D294 PolarHBondContact OG-OD2 2.87Å
231	V	93.3	Very high	93.8	Very high	60 Å²	60	51.2 Å²	51.2	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-72.1	-40.6	178.2	175.4	0	0	0	0	110.5	N227 S228 A229 I233 K234 K235	N227-V231 HydrophobicContact CB-CB 4.08Å; N227-V231 HydrophobicContact CB-CG1 3.91Å; N227-V231 WeakPolarHBondContact OD1-CG1 3.44Å; S228-V231 PolarHBondContact O-N 3.27Å; S228-V231 VanDerWaalsContact O-N 3.07Å; S228-V231 WeakPolarHBondContact OG-CG2 3.46Å; A229-V231 PolarHBondContact O-N 3.34Å; V231-I233 PolarHBondContact O-N 3.16Å; V231-K234 PolarHBondContact O-N 3.1Å; V231-K235 HydrophobicContact CG1-CD 4.35Å; V231-K235 WeakPolarHBondContact O-CG 3.41Å; V231-K235 PolarHBondContact O-N 3.5Å
232	Y	94.7	Very high	93.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-54.6	-52.3	173.5	-176.4	-83.8	0	0	0	110.9	F223 L224 S228 A229 K234 K235 V236 L267 I275	F223-Y232 HydrophobicContact CB-CD2 3.5Å; F223-Y232 HydrophobicContact CB-CE2 3.47Å; F223-Y232 VanDerWaalsContact CB-CE2 3.47Å; F223-Y232 HydrophobicContact CD2-CE2 4.47Å; L224-Y232 HydrophobicContact CD2-CD2 3.87Å; L224-Y232 HydrophobicContact CD2-CE2 3.64Å; L224-Y232 HydrophobicContact CG-CD2 4.18Å; L224-Y232 HydrophobicContact CG-CE2 3.66Å; S228-Y232 WeakPolarHBondContact O-CB 3.33Å; S228-Y232 PolarHBondContact O-N 3.33Å; A229-Y232 WeakPolarHBondContact O-CB 3.37Å; A229-Y232 PolarHBondContact O-N 3.07Å; Y232-K234 VanDerWaalsContact C-N 3.33Å; Y232-K234 PolarHBondContact O-N 3.42Å; Y232-K235 PolarHBondContact O-N 3.47Å; Y232-K235 VanDerWaalsContact O-N 3.11Å; Y232-V236 HydrophobicContact CD1-CG2 3.82Å; Y232-V236 HydrophobicContact CE1-CG2 3.41Å; Y232-V236 VanDerWaalsContact CE1-CG2 3.41Å; Y232-V236 WeakPolarHBondContact O-CG2 3.31Å; Y232-V236 PolarHBondContact O-N 3.07Å; Y232-L267 WeakPolarHBondContact CE1-O 3.4Å; Y232-L267 PolarHBondContact OH-O 2.84Å; Y232-I275 HydrophobicContact CD1-CD1 3.9Å; Y232-I275 HydrophobicContact CD1-CG1 4.08Å; Y232-I275 HydrophobicContact CE1-CD1 3.37Å; Y232-I275 HydrophobicContact CE1-CG1 3.91Å
233	I	93.4	Very high	93.9	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-55.7	-46.8	-179.8	-70.7	160.2	0	0	0	111.5	A229 V231 K235 V236 E237 C297 M298 L301	A229-I233 WeakPolarHBondContact O-CD1 3.28Å; A229-I233 WeakPolarHBondContact O-CG1 3.34Å; A229-I233 PolarHBondContact O-N 2.95Å; V231-I233 PolarHBondContact O-N 3.16Å; I233-K235 VanDerWaalsContact C-N 3.35Å; I233-K235 PolarHBondContact O-N 3.37Å; I233-V236 PolarHBondContact O-N 2.94Å; I233-E237 PolarHBondContact O-N 3.07Å; I233-C297 HydrophobicContact CG2-CB 3.96Å; I233-M298 HydrophobicContact CD1-CB 3.71Å; I233-M298 HydrophobicContact CD1-CE 3.75Å; I233-M298 HydrophobicContact CD1-CG 3.97Å; I233-L301 HydrophobicContact CB-CD2 4.18Å; I233-L301 HydrophobicContact CG1-CD2 3.8Å; I233-L301 HydrophobicContact CG2-CB 4.26Å; I233-L301 HydrophobicContact CG2-CD2 4.02Å
234	K	92.9	Very high	94	Very high	122 Å²	122	45.1 Å²	45.1	53%	0.53	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-39.6	178.4	-71.9	178.5	-179.6	-179.9	0	112.5	S230 V231 Y232 E237 A238	S230-K234 WeakPolarHBondContact O-CG 3.15Å; S230-K234 PolarHBondContact O-N 2.83Å; V231-K234 PolarHBondContact O-N 3.1Å; Y232-K234 VanDerWaalsContact C-N 3.33Å; Y232-K234 PolarHBondContact O-N 3.42Å; K234-E237 PolarHBondContact O-N 2.54Å; K234-A238 WeakPolarHBondContact O-CB 3.29Å; K234-A238 PolarHBondContact O-N 2.73Å
235	K	94.6	Very high	94.1	Very high	70 Å²	70	48.2 Å²	48.2	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-65.8	-39.5	176	-75.2	-176.8	168.3	-179.9	0	112	F223 N227 V231 Y232 I233 A238 R239	F223-K235 HydrophobicContact CD1-CD 4.19Å; F223-K235 HydrophobicContact CD2-CB 3.96Å; F223-K235 HydrophobicContact CD2-CD 4.2Å; F223-K235 HydrophobicContact CE1-CD 4.01Å; F223-K235 HydrophobicContact CE2-CB 3.61Å; F223-K235 HydrophobicContact CE2-CD 4.04Å; F223-K235 HydrophobicContact CE2-CG 4.39Å; F223-K235 HydrophobicContact CG-CD 4.28Å; F223-K235 HydrophobicContact CZ-CB 4.18Å; F223-K235 HydrophobicContact CZ-CD 3.93Å; N227-K235 PolarHBondContact OD1-NZ 2.88Å; V231-K235 HydrophobicContact CG1-CD 4.35Å; V231-K235 WeakPolarHBondContact O-CG 3.41Å; V231-K235 PolarHBondContact O-N 3.5Å; Y232-K235 PolarHBondContact O-N 3.47Å; Y232-K235 VanDerWaalsContact O-N 3.11Å; I233-K235 VanDerWaalsContact C-N 3.35Å; I233-K235 PolarHBondContact O-N 3.37Å; K235-A238 PolarHBondContact O-N 3.44Å; K235-R239 WeakPolarHBondContact O-CG 3.28Å; K235-R239 PolarHBondContact O-N 3.07Å
236	V	95.6	Very high	94.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-44.2	174.9	177.9	0	0	0	0	111.1	Y232 I233 A238 R239 I240 L267 I268 L301	Y232-V236 HydrophobicContact CD1-CG2 3.82Å; Y232-V236 HydrophobicContact CE1-CG2 3.41Å; Y232-V236 VanDerWaalsContact CE1-CG2 3.41Å; Y232-V236 WeakPolarHBondContact O-CG2 3.31Å; Y232-V236 PolarHBondContact O-N 3.07Å; I233-V236 PolarHBondContact O-N 2.94Å; V236-A238 VanDerWaalsContact C-N 3.34Å; V236-A238 PolarHBondContact O-N 3.03Å; V236-R239 PolarHBondContact O-N 3.29Å; V236-I240 HydrophobicContact CG1-CD1 4.14Å; V236-I240 WeakPolarHBondContact O-CG1 3.49Å; V236-I240 PolarHBondContact O-N 3Å; V236-L267 HydrophobicContact CB-CD1 4.46Å; V236-L267 HydrophobicContact CG1-CB 3.92Å; V236-L267 HydrophobicContact CG1-CD1 4.15Å; V236-L267 HydrophobicContact CG2-CB 3.86Å; V236-L267 HydrophobicContact CG2-CD1 4.09Å; V236-I268 HydrophobicContact CG1-CD1 4.1Å; V236-I268 HydrophobicContact CG1-CG1 3.81Å; V236-L301 HydrophobicContact CB-CD1 4.32Å; V236-L301 HydrophobicContact CG1-CD1 3.82Å
237	E	93.9	Very high	94.4	Very high	79 Å²	79	38.6 Å²	38.6	37%	0.369	20%	0.198	S	C	.	.	H	α-helix	trans	-61.4	-42.2	176.4	-174.5	169.8	-148.5	0	0	112	I233 K234 R239 I240 N241	I233-E237 PolarHBondContact O-N 3.07Å; K234-E237 PolarHBondContact O-N 2.54Å; E237-R239 PolarHBondContact O-N 3.35Å; E237-I240 PolarHBondContact O-N 3.28Å; E237-N241 PolarHBondContact O-N 3.35Å; E237-N241 VanDerWaalsContact O-N 3.1Å; E237-N241 PolarHBondContact O-ND2 3.4Å
238	A	94.8	Very high	94.5	Very high	41 Å²	41	43.1 Å²	43.1	34%	0.339	22%	0.22	S	C	.	.	H	α-helix	trans	-59	-46.7	173.4	0	0	0	0	0	111.8	K234 K235 V236 I240 N241 E242	K234-A238 WeakPolarHBondContact O-CB 3.29Å; K234-A238 PolarHBondContact O-N 2.73Å; K235-A238 PolarHBondContact O-N 3.44Å; V236-A238 VanDerWaalsContact C-N 3.34Å; V236-A238 PolarHBondContact O-N 3.03Å; A238-I240 PolarHBondContact O-N 3.1Å; A238-N241 PolarHBondContact O-N 3.01Å; A238-E242 VanDerWaalsContact O-CG 3.31Å; A238-E242 WeakPolarHBondContact O-CG 3.26Å; A238-E242 PolarHBondContact O-N 3.49Å
239	R	95.6	Very high	94.4	Very high	36 Å²	36	45.1 Å²	45.1	14%	0.136	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-40.4	177.2	-73.1	-54.5	-163.9	-166.1	-0.4	113	F216 E219 K235 V236 E237 N241 E242 E243 L267	F216-R239 HydrophobicContact CE1-CB 4.28Å; F216-R239 HydrophobicContact CE1-CG 4.27Å; E219-R239 IonicContact OE1-CZ 3.95Å; E219-R239 IonicContact OE1-NE 3.3Å; E219-R239 PolarHBondContact OE1-NE 2.62Å; E219-R239 IonicContact OE1-NH2 3.41Å; E219-R239 PolarHBondContact OE1-NH2 3.16Å; E219-R239 IonicContact OE2-CZ 3.89Å; E219-R239 IonicContact OE2-NE 3.28Å; E219-R239 PolarHBondContact OE2-NE 2.88Å; E219-R239 IonicContact OE2-NH2 3.26Å; K235-R239 WeakPolarHBondContact O-CG 3.28Å; K235-R239 PolarHBondContact O-N 3.07Å; V236-R239 PolarHBondContact O-N 3.29Å; E237-R239 PolarHBondContact O-N 3.35Å; R239-N241 VanDerWaalsContact C-N 3.33Å; R239-N241 PolarHBondContact O-N 3.12Å; R239-E242 WeakPolarHBondContact CD-OE2 3.19Å; R239-E242 IonicContact CZ-OE2 3.36Å; R239-E242 IonicContact NE-OE2 2.86Å; R239-E242 IonicContact NH1-OE2 3.82Å; R239-E242 PolarHBondContact NH1-OE2 3.05Å; R239-E242 PolarHBondContact O-N 2.91Å; R239-E243 WeakPolarHBondContact O-CG 3.36Å; R239-E243 PolarHBondContact O-N 3.41Å; R239-L267 HydrophobicContact CB-CD1 4.2Å; R239-L267 HydrophobicContact CG-CD1 4.4Å
240	I	95.9	Very high	94.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-59.3	-47.4	175.1	-68.8	168.5	0	0	0	110.2	V236 E237 A238 E243 I244 V263 I268 L301	V236-I240 HydrophobicContact CG1-CD1 4.14Å; V236-I240 WeakPolarHBondContact O-CG1 3.49Å; V236-I240 PolarHBondContact O-N 3Å; E237-I240 PolarHBondContact O-N 3.28Å; A238-I240 PolarHBondContact O-N 3.1Å; I240-E243 PolarHBondContact O-N 3.08Å; I240-I244 HydrophobicContact CG2-CD1 3.79Å; I240-I244 VanDerWaalsContact O-CG1 3.3Å; I240-I244 WeakPolarHBondContact O-CG1 3.47Å; I240-I244 PolarHBondContact O-N 3.36Å; I240-V263 HydrophobicContact CG1-CB 4.38Å; I240-V263 HydrophobicContact CG1-CG1 3.64Å; I240-I268 HydrophobicContact CD1-CD1 4.45Å; I240-L301 HydrophobicContact CD1-CD1 4.48Å
241	N	95.8	Very high	94.7	Very high	76 Å²	76	45.4 Å²	45.4	41%	0.406	22%	0.224	S	C	.	.	H	α-helix	trans	-65.6	-41.9	180	-66.4	-29.5	0	0	0	112.1	E237 A238 R239 E243 I244 E245	E237-N241 PolarHBondContact O-N 3.35Å; E237-N241 VanDerWaalsContact O-N 3.1Å; E237-N241 PolarHBondContact O-ND2 3.4Å; A238-N241 PolarHBondContact O-N 3.01Å; R239-N241 VanDerWaalsContact C-N 3.33Å; R239-N241 PolarHBondContact O-N 3.12Å; N241-E243 VanDerWaalsContact C-N 3.34Å; N241-E243 PolarHBondContact O-N 3.12Å; N241-I244 PolarHBondContact O-N 2.83Å; N241-E245 WeakPolarHBondContact O-CB 3.36Å; N241-E245 WeakPolarHBondContact O-CG 3.48Å; N241-E245 PolarHBondContact O-N 3.2Å
242	E	95.1	Very high	94.8	Very high	76 Å²	76	45 Å²	45	36%	0.355	22%	0.22	S	C	.	.	H	α-helix	trans	-60.4	-40.8	176.2	-73.2	170.2	-163.4	0	0	112.3	A238 R239 R246	A238-E242 VanDerWaalsContact O-CG 3.31Å; A238-E242 WeakPolarHBondContact O-CG 3.26Å; A238-E242 PolarHBondContact O-N 3.49Å; R239-E242 WeakPolarHBondContact CD-OE2 3.19Å; R239-E242 IonicContact CZ-OE2 3.36Å; R239-E242 IonicContact NE-OE2 2.86Å; R239-E242 IonicContact NH1-OE2 3.82Å; R239-E242 PolarHBondContact NH1-OE2 3.05Å; R239-E242 PolarHBondContact O-N 2.91Å; E242-R246 WeakPolarHBondContact O-CB 3.27Å; E242-R246 PolarHBondContact O-N 3.03Å
243	E	96.2	Very high	94.8	Very high	1 Å²	1	53 Å²	53	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-40.9	175.7	-65.7	-60.2	131.9	0	0	112.3	R172 F216 R239 I240 N241 R246 V247 I259 V263	R172-E243 IonicContact CZ-OE1 3.02Å; R172-E243 IonicContact CZ-OE2 2.83Å; R172-E243 IonicContact NE-OE1 2.74Å; R172-E243 PolarHBondContact NE-OE1 2.9Å; R172-E243 IonicContact NE-OE2 3.37Å; R172-E243 VanDerWaalsContact NH2-CD 3.27Å; R172-E243 IonicContact NH2-OE1 3.01Å; R172-E243 PolarHBondContact NH2-OE1 3.11Å; R172-E243 VanDerWaalsContact NH2-OE1 3.16Å; R172-E243 IonicContact NH2-OE2 2.64Å; R172-E243 PolarHBondContact NH2-OE2 2.9Å; F216-E243 HydrophobicContact CE2-CG 4.25Å; F216-E243 HydrophobicContact CZ-CG 3.8Å; F216-E243 WeakPolarHBondContact CZ-OE1 3.37Å; R239-E243 WeakPolarHBondContact O-CG 3.36Å; R239-E243 PolarHBondContact O-N 3.41Å; I240-E243 PolarHBondContact O-N 3.08Å; N241-E243 VanDerWaalsContact C-N 3.34Å; N241-E243 PolarHBondContact O-N 3.12Å; E243-R246 PolarHBondContact O-N 3.46Å; E243-R246 IonicContact OE1-CZ 3.81Å; E243-R246 IonicContact OE1-NH1 3.35Å; E243-R246 PolarHBondContact OE1-NH1 3.06Å; E243-R246 IonicContact OE1-NH2 3.96Å; E243-R246 IonicContact OE2-CZ 3.53Å; E243-R246 IonicContact OE2-NH1 2.69Å; E243-R246 PolarHBondContact OE2-NH1 2.99Å; E243-V247 WeakPolarHBondContact O-CG2 3.31Å; E243-V247 PolarHBondContact O-N 2.96Å; E243-I259 HydrophobicContact CB-CG1 4.16Å; E243-I259 HydrophobicContact CB-CG2 4.43Å; E243-I259 HydrophobicContact CG-CG1 4.15Å; E243-I259 WeakPolarHBondContact OE2-CG1 3.48Å; E243-V263 HydrophobicContact CG-CG2 3.83Å
244	I	95.8	Very high	94.9	Very high	39 Å²	39	55 Å²	55	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-46.5	175.1	-68	166.5	0	0	0	110.1	I240 N241 R246 V247 M248 E256 V260	I240-I244 HydrophobicContact CG2-CD1 3.79Å; I240-I244 VanDerWaalsContact O-CG1 3.3Å; I240-I244 WeakPolarHBondContact O-CG1 3.47Å; I240-I244 PolarHBondContact O-N 3.36Å; N241-I244 PolarHBondContact O-N 2.83Å; I244-R246 VanDerWaalsContact C-N 3.33Å; I244-R246 PolarHBondContact O-N 3.23Å; I244-V247 PolarHBondContact O-N 2.92Å; I244-M248 HydrophobicContact CG2-CE 4.33Å; I244-M248 WeakPolarHBondContact O-CG 3.37Å; I244-M248 PolarHBondContact O-N 3.43Å; I244-E256 HydrophobicContact CG1-CG 4.3Å; I244-V260 HydrophobicContact CD1-CG2 4.17Å; I244-V260 HydrophobicContact CG1-CG2 3.75Å
245	E	94.9	Very high	95.1	Very high	100 Å²	100	49.2 Å²	49.2	47%	0.467	24%	0.243	S	C	.	.	H	α-helix	trans	-60.1	-41.8	175.3	-75.7	-176.5	-177.8	0	0	112	N241 V247 M248 H249	N241-E245 WeakPolarHBondContact O-CB 3.36Å; N241-E245 WeakPolarHBondContact O-CG 3.48Å; N241-E245 PolarHBondContact O-N 3.2Å; E245-V247 VanDerWaalsContact C-N 3.32Å; E245-V247 PolarHBondContact O-N 2.87Å; E245-M248 HydrophobicContact CB-CE 4.38Å; E245-M248 HydrophobicContact CG-CE 3.92Å; E245-M248 PolarHBondContact O-N 3.04Å; E245-H249 PolarHBondContact O-N 3.28Å; E245-H249 PolarHBondContact O-ND1 3.3Å
246	R	94.8	Very high	95.2	Very high	11 Å²	11	49.1 Å²	49.1	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-44.4	176.6	-176.6	178.9	-59.6	92.4	5.2	111.9	E171 E242 E243 I244 H249 C250	E171-R246 IonicContact OE2-CZ 2.66Å; E171-R246 IonicContact OE2-NE 2.78Å; E171-R246 PolarHBondContact OE2-NE 3.5Å; E171-R246 IonicContact OE2-NH2 2.83Å; E242-R246 WeakPolarHBondContact O-CB 3.27Å; E242-R246 PolarHBondContact O-N 3.03Å; E243-R246 PolarHBondContact O-N 3.46Å; E243-R246 IonicContact OE1-CZ 3.81Å; E243-R246 IonicContact OE1-NH1 3.35Å; E243-R246 PolarHBondContact OE1-NH1 3.06Å; E243-R246 IonicContact OE1-NH2 3.96Å; E243-R246 IonicContact OE2-CZ 3.53Å; E243-R246 IonicContact OE2-NH1 2.69Å; E243-R246 PolarHBondContact OE2-NH1 2.99Å; I244-R246 VanDerWaalsContact C-N 3.33Å; I244-R246 PolarHBondContact O-N 3.23Å; R246-H249 PolarHBondContact O-N 3.03Å; R246-C250 PolarHBondContact O-N 3.07Å
247	V	96.5	Very high	95.3	Very high	2 Å²	2	55 Å²	55	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-59.8	-49.9	177	173.2	0	0	0	0	110.1	E243 I244 E245 H249 C250 L251 D252 E256 I259	E243-V247 WeakPolarHBondContact O-CG2 3.31Å; E243-V247 PolarHBondContact O-N 2.96Å; I244-V247 PolarHBondContact O-N 2.92Å; E245-V247 VanDerWaalsContact C-N 3.32Å; E245-V247 PolarHBondContact O-N 2.87Å; V247-H249 PolarHBondContact O-N 3.24Å; V247-C250 PolarHBondContact O-N 2.85Å; V247-L251 HydrophobicContact CB-CB 4.48Å; V247-L251 HydrophobicContact CG1-CB 4.37Å; V247-L251 HydrophobicContact CG2-CB 4.43Å; V247-L251 HydrophobicContact CG2-CD1 4.02Å; V247-L251 CarbonylContact O-C 3.53Å; V247-L251 PolarHBondContact O-N 3.18Å; V247-D252 WeakPolarHBondContact CG1-O 3.39Å; V247-E256 HydrophobicContact CG1-CB 3.96Å; V247-I259 HydrophobicContact CG2-CG2 3.84Å
248	M	94.4	Very high	95.5	Very high	124 Å²	124	53 Å²	53	61%	0.611	27%	0.266	S	S	*	.	H	α-helix	trans	-56.4	-36	179.3	-70.7	-167.1	-64.1	0	0	113.8	I244 E245	I244-M248 HydrophobicContact CG2-CE 4.33Å; I244-M248 WeakPolarHBondContact O-CG 3.37Å; I244-M248 PolarHBondContact O-N 3.43Å; E245-M248 HydrophobicContact CB-CE 4.38Å; E245-M248 HydrophobicContact CG-CE 3.92Å; E245-M248 PolarHBondContact O-N 3.04Å
249	H	92.5	Very high	95.6	Very high	92 Å²	92	51.1 Å²	51.1	43%	0.426	25%	0.25	S	C	.	.	H	α-helix	trans	-89.2	-33.7	-175.6	-69.2	90.8	0	0	0	113.9	E245 R246 V247	E245-H249 PolarHBondContact O-N 3.28Å; E245-H249 PolarHBondContact O-ND1 3.3Å; R246-H249 PolarHBondContact O-N 3.03Å; V247-H249 PolarHBondContact O-N 3.24Å
250	C	93	Very high	95.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-130.4	-21.6	-163.1	-46.7	0	0	0	0	115.2	R179 I182 R183 R246 V247	R179-C250 WeakPolarHBondContact CB-SG 3.34Å; R179-C250 WeakPolarHBondContact CG-SG 3.21Å; I182-C250 HydrophobicContact CB-CB 4.25Å; I182-C250 HydrophobicContact CG2-CB 3.94Å; R183-C250 VanDerWaalsContact CA-O 3.26Å; R183-C250 WeakPolarHBondContact CA-O 3.36Å; R246-C250 PolarHBondContact O-N 3.07Å; V247-C250 PolarHBondContact O-N 2.85Å
251	L	95.3	Very high	95.8	Very high	19 Å²	19	55.5 Å²	55.5	10%	0.099	27%	0.271	C	S	.	.	S	Bend	trans	-118.4	171.6	-171.9	-49.8	-179.9	0	0	0	111	I168 I182 F204 F208 V247 T255	I168-L251 HydrophobicContact CD1-CD2 4.44Å; I182-L251 HydrophobicContact CG2-CD2 3.99Å; F204-L251 HydrophobicContact CE1-CD2 3.77Å; F204-L251 HydrophobicContact CZ-CD2 3.75Å; F208-L251 HydrophobicContact CE1-CD1 3.93Å; F208-L251 HydrophobicContact CZ-CD1 3.96Å; V247-L251 HydrophobicContact CB-CB 4.48Å; V247-L251 HydrophobicContact CG1-CB 4.37Å; V247-L251 HydrophobicContact CG2-CB 4.43Å; V247-L251 HydrophobicContact CG2-CD1 4.02Å; V247-L251 CarbonylContact O-C 3.53Å; V247-L251 PolarHBondContact O-N 3.18Å; L251-T255 HydrophobicContact CD1-CG2 4.25Å
252	D	95.1	Very high	95.9	Very high	53 Å²	53	52.4 Å²	52.4	28%	0.283	26%	0.255	S	S	.	.			trans	-73.1	139.8	172.1	-170.9	-90.9	0	0	0	110.7	M190 Y200 V247 S254 T255	M190-D252 HydrophobicContact CE-CB 4.48Å; M190-D252 HydrophobicContact CG-CB 4.27Å; M190-D252 HydrophobicContact SD-CB 4.24Å; Y200-D252 HydrophobicContact CE1-CB 4.22Å; V247-D252 WeakPolarHBondContact CG1-O 3.39Å; D252-S254 PolarHBondContact O-N 2.83Å; D252-S254 WeakPolarHBondContact OD1-CB 3.23Å; D252-S254 PolarHBondContact OD1-N 3.47Å; D252-S254 PolarHBondContact OD1-OG 3.05Å; D252-T255 VanDerWaalsContact O-CB 3.23Å; D252-T255 WeakPolarHBondContact O-CB 3.44Å; D252-T255 PolarHBondContact O-N 3.38Å; D252-T255 PolarHBondContact O-OG1 3.48Å
253	K	94.9	Very high	96	Very high	166 Å²	166	48.8 Å²	48.8	72%	0.722	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-52.8	-32.2	-179.4	-178.7	177.2	179.7	179.5	0	112.8	T255 E256	K253-T255 PolarHBondContact O-N 3.33Å; K253-T255 VanDerWaalsContact O-N 3.11Å; K253-E256 WeakPolarHBondContact O-CB 3.3Å; K253-E256 PolarHBondContact O-N 3.4Å; K253-E256 VanDerWaalsContact O-N 3.12Å
254	S	95.3	Very high	96	Very high	45 Å²	45	50.1 Å²	50.1	32%	0.315	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-66.1	-9.2	178.7	65.8	0	0	0	0	114.3	R197 D252 P258	R197-S254 PolarHBondContact NH1-O 2.93Å; R197-S254 PolarHBondContact NH1-OG 3.23Å; R197-S254 PolarHBondContact NH2-OG 2.97Å; D252-S254 PolarHBondContact O-N 2.83Å; D252-S254 WeakPolarHBondContact OD1-CB 3.23Å; D252-S254 PolarHBondContact OD1-N 3.47Å; D252-S254 PolarHBondContact OD1-OG 3.05Å; S254-P258 WeakPolarHBondContact O-CD 3.21Å
255	T	97	Very high	96.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-84.6	-18.7	175	-43.9	0	0	0	0	112.8	Y200 E205 F208 L251 D252 K253 E257 P258 I259	Y200-T255 WeakPolarHBondContact CE1-OG1 3.48Å; Y200-T255 PolarHBondContact OH-OG1 3.04Å; E205-T255 HydrophobicContact CG-CG2 3.98Å; E205-T255 WeakPolarHBondContact OE1-CA 3.28Å; E205-T255 PolarHBondContact OE1-OG1 3.47Å; F208-T255 HydrophobicContact CD1-CG2 4.16Å; F208-T255 HydrophobicContact CE1-CG2 3.88Å; L251-T255 HydrophobicContact CD1-CG2 4.25Å; D252-T255 VanDerWaalsContact O-CB 3.23Å; D252-T255 WeakPolarHBondContact O-CB 3.44Å; D252-T255 PolarHBondContact O-N 3.38Å; D252-T255 PolarHBondContact O-OG1 3.48Å; K253-T255 PolarHBondContact O-N 3.33Å; K253-T255 VanDerWaalsContact O-N 3.11Å; T255-E257 PolarHBondContact O-N 3.42Å; T255-P258 VanDerWaalsContact O-CD 3.31Å; T255-P258 WeakPolarHBondContact O-CD 3.31Å; T255-I259 VanDerWaalsContact O-CG2 3.3Å; T255-I259 WeakPolarHBondContact O-CG2 3.44Å; T255-I259 PolarHBondContact O-N 2.86Å
256	E	97.3	Very high	96.2	Very high	68 Å²	68	49.1 Å²	49.1	32%	0.318	23%	0.234	S	C	.	.	H	α-helix	trans	-57.8	-51.6	-174.2	-168.8	-177.3	129.1	0	0	112.3	I244 V247 K253 I259 V260	I244-E256 HydrophobicContact CG1-CG 4.3Å; V247-E256 HydrophobicContact CG1-CB 3.96Å; K253-E256 WeakPolarHBondContact O-CB 3.3Å; K253-E256 PolarHBondContact O-N 3.4Å; K253-E256 VanDerWaalsContact O-N 3.12Å; E256-I259 WeakPolarHBondContact O-CG2 3.3Å; E256-V260 WeakPolarHBondContact O-CB 3.28Å; E256-V260 WeakPolarHBondContact O-CG2 3.41Å; E256-V260 PolarHBondContact O-N 3.01Å
257	E	96.9	Very high	96.3	Very high	125 Å²	125	48.6 Å²	48.6	58%	0.584	23%	0.232	S	C	*	.	H	α-helix	trans	-65	-47.5	-179.5	178.1	-175.5	176.1	0	0	112.3	T255 I259 K261	T255-E257 PolarHBondContact O-N 3.42Å; E257-I259 PolarHBondContact O-N 3.29Å; E257-K261 HydrophobicContact CG-CD 4.31Å; E257-K261 WeakPolarHBondContact O-CG 3.29Å; E257-K261 PolarHBondContact O-N 3Å; E257-K261 VanDerWaalsContact OE1-CE 3.23Å; E257-K261 WeakPolarHBondContact OE1-CE 3.31Å; E257-K261 IonicContact OE1-NZ 3.24Å; E257-K261 PolarHBondContact OE1-NZ 2.92Å
258	P	97.8	Very high	96.3	Very high	37 Å²	37	48.5 Å²	48.5	24%	0.24	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-47.3	174.3	-27.9	32.9	0	0	0	114.7	L209 S254 T255 K261 V262	L209-P258 HydrophobicContact CD1-CB 3.68Å; L209-P258 HydrophobicContact CD2-CB 3.94Å; L209-P258 HydrophobicContact CG-CB 4.48Å; S254-P258 WeakPolarHBondContact O-CD 3.21Å; T255-P258 VanDerWaalsContact O-CD 3.31Å; T255-P258 WeakPolarHBondContact O-CD 3.31Å; P258-K261 PolarHBondContact O-N 3.27Å; P258-V262 WeakPolarHBondContact O-CG2 3.31Å; P258-V262 PolarHBondContact O-N 3.3Å; P258-V262 VanDerWaalsContact O-N 3.1Å
259	I	97.8	Very high	96.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69.4	-40.3	-177.6	-171.2	58.7	0	0	0	111.6	F208 L209 E243 V247 T255 E256 E257 K261 V262 V263	F208-I259 HydrophobicContact CE1-CB 4.2Å; F208-I259 HydrophobicContact CE1-CD1 3.81Å; F208-I259 HydrophobicContact CE1-CG1 4.02Å; F208-I259 HydrophobicContact CZ-CD1 3.72Å; F208-I259 HydrophobicContact CZ-CG1 3.96Å; L209-I259 HydrophobicContact CD2-CB 3.99Å; L209-I259 HydrophobicContact CD2-CD1 4.02Å; E243-I259 HydrophobicContact CB-CG1 4.16Å; E243-I259 HydrophobicContact CB-CG2 4.43Å; E243-I259 HydrophobicContact CG-CG1 4.15Å; E243-I259 WeakPolarHBondContact OE2-CG1 3.48Å; V247-I259 HydrophobicContact CG2-CG2 3.84Å; T255-I259 VanDerWaalsContact O-CG2 3.3Å; T255-I259 WeakPolarHBondContact O-CG2 3.44Å; T255-I259 PolarHBondContact O-N 2.86Å; E256-I259 WeakPolarHBondContact O-CG2 3.3Å; E257-I259 PolarHBondContact O-N 3.29Å; I259-K261 VanDerWaalsContact C-N 3.3Å; I259-K261 PolarHBondContact O-N 3.44Å; I259-V262 HydrophobicContact CD1-CB 4.48Å; I259-V262 WeakPolarHBondContact O-CB 3.43Å; I259-V262 PolarHBondContact O-N 3.05Å; I259-V262 VanDerWaalsContact O-N 3.08Å; I259-V263 WeakPolarHBondContact O-CG2 3.42Å; I259-V263 PolarHBondContact O-N 3.43Å
260	V	97.5	Very high	96.6	Very high	17 Å²	17	45.1 Å²	45.1	10%	0.103	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-41.7	175.6	171.2	0	0	0	0	110.4	I244 E256 V262 V263 E264	I244-V260 HydrophobicContact CD1-CG2 4.17Å; I244-V260 HydrophobicContact CG1-CG2 3.75Å; E256-V260 WeakPolarHBondContact O-CB 3.28Å; E256-V260 WeakPolarHBondContact O-CG2 3.41Å; E256-V260 PolarHBondContact O-N 3.01Å; V260-V262 VanDerWaalsContact C-N 3.29Å; V260-V262 PolarHBondContact O-N 3.27Å; V260-V263 PolarHBondContact O-N 3.25Å; V260-E264 HydrophobicContact CG1-CG 4.14Å; V260-E264 WeakPolarHBondContact O-CB 3.47Å; V260-E264 VanDerWaalsContact O-CG 3.31Å; V260-E264 WeakPolarHBondContact O-CG 3.35Å; V260-E264 PolarHBondContact O-N 2.91Å
261	K	97.4	Very high	96.7	Very high	113 Å²	113	46.5 Å²	46.5	49%	0.491	22%	0.223	S	C	.	.	H	α-helix	trans	-60.9	-36.1	174.2	-77.2	178	-176.1	169	0	112.9	E257 P258 I259 R265	E257-K261 HydrophobicContact CG-CD 4.31Å; E257-K261 WeakPolarHBondContact O-CG 3.29Å; E257-K261 PolarHBondContact O-N 3Å; E257-K261 VanDerWaalsContact OE1-CE 3.23Å; E257-K261 WeakPolarHBondContact OE1-CE 3.31Å; E257-K261 IonicContact OE1-NZ 3.24Å; E257-K261 PolarHBondContact OE1-NZ 2.92Å; P258-K261 PolarHBondContact O-N 3.27Å; I259-K261 VanDerWaalsContact C-N 3.3Å; I259-K261 PolarHBondContact O-N 3.44Å; K261-R265 WeakPolarHBondContact O-CB 3.38Å; K261-R265 PolarHBondContact O-N 3.43Å
262	V	98.1	Very high	96.6	Very high	11 Å²	11	46.9 Å²	46.9	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-48	174.2	171.9	0	0	0	0	110.4	L209 A213 F216 P258 I259 V260 E264 R265 E266	L209-V262 HydrophobicContact CB-CG2 4.4Å; L209-V262 HydrophobicContact CD2-CG2 4.12Å; A213-V262 HydrophobicContact CB-CG1 3.75Å; F216-V262 HydrophobicContact CD2-CG1 4.37Å; P258-V262 WeakPolarHBondContact O-CG2 3.31Å; P258-V262 PolarHBondContact O-N 3.3Å; P258-V262 VanDerWaalsContact O-N 3.1Å; I259-V262 HydrophobicContact CD1-CB 4.48Å; I259-V262 WeakPolarHBondContact O-CB 3.43Å; I259-V262 PolarHBondContact O-N 3.05Å; I259-V262 VanDerWaalsContact O-N 3.08Å; V260-V262 VanDerWaalsContact C-N 3.29Å; V260-V262 PolarHBondContact O-N 3.27Å; V262-E264 PolarHBondContact O-N 3Å; V262-R265 PolarHBondContact O-N 2.72Å; V262-E266 HydrophobicContact CG1-CG 4.29Å; V262-E266 WeakPolarHBondContact O-CB 3.38Å; V262-E266 WeakPolarHBondContact O-CG 3.4Å; V262-E266 PolarHBondContact O-N 3.47Å
263	V	97.5	Very high	96.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59	-48.4	177	-177.4	0	0	0	0	111	F216 I240 E243 I259 V260 R265 E266 L267	F216-V263 HydrophobicContact CD2-CG2 3.96Å; F216-V263 HydrophobicContact CE1-CG2 4.46Å; F216-V263 HydrophobicContact CE2-CG2 3.46Å; F216-V263 VanDerWaalsContact CE2-CG2 3.46Å; F216-V263 HydrophobicContact CZ-CG2 3.74Å; I240-V263 HydrophobicContact CG1-CB 4.38Å; I240-V263 HydrophobicContact CG1-CG1 3.64Å; E243-V263 HydrophobicContact CG-CG2 3.83Å; I259-V263 WeakPolarHBondContact O-CG2 3.42Å; I259-V263 PolarHBondContact O-N 3.43Å; V260-V263 PolarHBondContact O-N 3.25Å; V263-R265 VanDerWaalsContact C-N 3.32Å; V263-R265 PolarHBondContact O-N 3.44Å; V263-E266 PolarHBondContact O-N 3.42Å; V263-L267 HydrophobicContact CG1-CD1 3.71Å; V263-L267 HydrophobicContact CG1-CG 4.19Å; V263-L267 VanDerWaalsContact O-CB 3.31Å; V263-L267 WeakPolarHBondContact O-CB 3.41Å; V263-L267 PolarHBondContact O-N 2.81Å
264	E	97.2	Very high	96.5	Very high	28 Å²	28	46.3 Å²	46.3	13%	0.131	23%	0.226	C	C	.	.	I	π-helix	trans	-64.1	-35.4	179.8	-71.7	178.1	163.9	0	0	112.5	V260 V262 I268 S269 R304 V305	V260-E264 HydrophobicContact CG1-CG 4.14Å; V260-E264 WeakPolarHBondContact O-CB 3.47Å; V260-E264 VanDerWaalsContact O-CG 3.31Å; V260-E264 WeakPolarHBondContact O-CG 3.35Å; V260-E264 PolarHBondContact O-N 2.91Å; V262-E264 PolarHBondContact O-N 3Å; E264-I268 HydrophobicContact CB-CD1 4.33Å; E264-I268 HydrophobicContact CG-CD1 4.11Å; E264-I268 VanDerWaalsContact O-CB 3.29Å; E264-I268 WeakPolarHBondContact O-CB 3.39Å; E264-I268 PolarHBondContact O-N 3.22Å; E264-S269 PolarHBondContact O-N 3.24Å; E264-S269 PolarHBondContact O-OG 2.94Å; E264-S269 VanDerWaalsContact O-OG 3.12Å; E264-R304 WeakPolarHBondContact OE1-CB 3.2Å; E264-R304 IonicContact OE1-NH1 2.59Å; E264-V305 HydrophobicContact CB-CG1 3.96Å
265	R	97.4	Very high	96.5	Very high	114 Å²	114	44.1 Å²	44.1	43%	0.43	21%	0.211	S	C	.	.	I	π-helix	trans	-68.7	-51.9	175.5	-173.9	-174.9	71.7	-156.3	-1.1	111.4	K261 V262 V263 S269 K270	K261-R265 WeakPolarHBondContact O-CB 3.38Å; K261-R265 PolarHBondContact O-N 3.43Å; V262-R265 PolarHBondContact O-N 2.72Å; V263-R265 VanDerWaalsContact C-N 3.32Å; V263-R265 PolarHBondContact O-N 3.44Å; R265-S269 PolarHBondContact O-N 2.85Å; R265-K270 WeakPolarHBondContact O-CG 3.44Å; R265-K270 PolarHBondContact O-N 3.35Å; R265-K270 VanDerWaalsContact O-N 3.14Å
266	E	97.4	Very high	96.4	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.019	21%	0.211	C	C	.	.	I	π-helix	trans	-76.1	-40.8	-172	-63.4	-53.9	139.5	0	0	112.9	A213 F216 V262 V263 K270 H271	A213-E266 HydrophobicContact CB-CG 4.31Å; F216-E266 HydrophobicContact CB-CB 3.73Å; F216-E266 HydrophobicContact CB-CG 4.26Å; V262-E266 HydrophobicContact CG1-CG 4.29Å; V262-E266 WeakPolarHBondContact O-CB 3.38Å; V262-E266 WeakPolarHBondContact O-CG 3.4Å; V262-E266 PolarHBondContact O-N 3.47Å; V263-E266 PolarHBondContact O-N 3.42Å; E266-K270 WeakPolarHBondContact OE1-CE 3.46Å; E266-K270 IonicContact OE1-NZ 3.74Å; E266-K270 PolarHBondContact OE1-NZ 3.47Å; E266-K270 WeakPolarHBondContact OE2-CD 3.36Å; E266-K270 WeakPolarHBondContact OE2-CE 3.45Å; E266-K270 IonicContact OE2-NZ 3.88Å; E266-K270 PolarHBondContact OE2-NZ 3.01Å; E266-H271 PolarHBondContact O-CD2 2.93Å; E266-H271 PolarHBondContact O-NE2 3.38Å
267	L	96.8	Very high	96.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-93.3	-22.5	-176	-58.2	-171.5	0	0	0	113.9	F216 Y232 V236 R239 V263	F216-L267 HydrophobicContact CB-CD2 3.99Å; F216-L267 HydrophobicContact CB-CG 4.25Å; F216-L267 HydrophobicContact CD1-CD1 3.94Å; F216-L267 HydrophobicContact CD1-CD2 4.26Å; F216-L267 HydrophobicContact CD1-CG 4.24Å; F216-L267 HydrophobicContact CE1-CD1 4.43Å; F216-L267 HydrophobicContact CG-CG 4.45Å; F216-L267 WeakPolarHBondContact O-CD2 3.37Å; Y232-L267 WeakPolarHBondContact CE1-O 3.4Å; Y232-L267 PolarHBondContact OH-O 2.84Å; V236-L267 HydrophobicContact CB-CD1 4.46Å; V236-L267 HydrophobicContact CG1-CB 3.92Å; V236-L267 HydrophobicContact CG1-CD1 4.15Å; V236-L267 HydrophobicContact CG2-CB 3.86Å; V236-L267 HydrophobicContact CG2-CD1 4.09Å; R239-L267 HydrophobicContact CB-CD1 4.2Å; R239-L267 HydrophobicContact CG-CD1 4.4Å; V263-L267 HydrophobicContact CG1-CD1 3.71Å; V263-L267 HydrophobicContact CG1-CG 4.19Å; V263-L267 VanDerWaalsContact O-CB 3.31Å; V263-L267 WeakPolarHBondContact O-CB 3.41Å; V263-L267 PolarHBondContact O-N 2.81Å
268	I	96.3	Very high	96	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	I	π-helix	trans	-115.9	-64.5	-176.4	-47.1	169.3	0	0	0	110.5	V236 I240 E264 K270 H271 M272 L301 V305	V236-I268 HydrophobicContact CG1-CD1 4.1Å; V236-I268 HydrophobicContact CG1-CG1 3.81Å; I240-I268 HydrophobicContact CD1-CD1 4.45Å; E264-I268 HydrophobicContact CB-CD1 4.33Å; E264-I268 HydrophobicContact CG-CD1 4.11Å; E264-I268 VanDerWaalsContact O-CB 3.29Å; E264-I268 WeakPolarHBondContact O-CB 3.39Å; E264-I268 PolarHBondContact O-N 3.22Å; I268-K270 PolarHBondContact O-N 3.11Å; I268-H271 CarbonylContact O-C 3.47Å; I268-H271 PolarHBondContact O-N 3.49Å; I268-M272 HydrophobicContact CG2-CG 4.4Å; I268-M272 WeakPolarHBondContact O-CG 3.43Å; I268-M272 PolarHBondContact O-N 2.97Å; I268-L301 HydrophobicContact CD1-CD1 3.46Å; I268-L301 VanDerWaalsContact CD1-CD1 3.46Å; I268-L301 HydrophobicContact CD1-CD2 4.46Å; I268-L301 HydrophobicContact CD1-CG 3.78Å; I268-L301 HydrophobicContact CG1-CD1 4.07Å; I268-L301 HydrophobicContact CG1-CD2 4.27Å; I268-L301 HydrophobicContact CG1-CG 4.12Å; I268-L301 HydrophobicContact CG2-CG 4.4Å; I268-V305 HydrophobicContact CB-CG1 4.07Å; I268-V305 HydrophobicContact CD1-CG1 4.3Å; I268-V305 HydrophobicContact CG2-CG1 4.04Å; I268-V305 HydrophobicContact CG2-CG2 3.76Å
269	S	96.3	Very high	95.6	Very high	39 Å²	39	48.6 Å²	48.6	27%	0.273	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-60	-43.2	-166.7	-58.2	0	0	0	0	113.1	E264 R265 H271 M272 V305	E264-S269 PolarHBondContact O-N 3.24Å; E264-S269 PolarHBondContact O-OG 2.94Å; E264-S269 VanDerWaalsContact O-OG 3.12Å; R265-S269 PolarHBondContact O-N 2.85Å; S269-H271 PolarHBondContact O-N 3.44Å; S269-M272 WeakPolarHBondContact O-CE 3.47Å; S269-V305 WeakPolarHBondContact OG-CG1 3.3Å
270	K	95.8	Very high	95.1	Very high	106 Å²	106	54.3 Å²	54.3	46%	0.461	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-67.7	-23.5	178.8	-72.8	-178	-176.8	177.8	0	113.6	R265 E266 I268	R265-K270 WeakPolarHBondContact O-CG 3.44Å; R265-K270 PolarHBondContact O-N 3.35Å; R265-K270 VanDerWaalsContact O-N 3.14Å; E266-K270 WeakPolarHBondContact OE1-CE 3.46Å; E266-K270 IonicContact OE1-NZ 3.74Å; E266-K270 PolarHBondContact OE1-NZ 3.47Å; E266-K270 WeakPolarHBondContact OE2-CD 3.36Å; E266-K270 WeakPolarHBondContact OE2-CE 3.45Å; E266-K270 IonicContact OE2-NZ 3.88Å; E266-K270 PolarHBondContact OE2-NZ 3.01Å; I268-K270 PolarHBondContact O-N 3.11Å
271	H	95.3	Very high	94.9	Very high	31 Å²	31	54.1 Å²	54.1	14%	0.144	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-118.3	8.3	-169.3	-57	-56.9	0	0	0	114	S220 L224 E266 I268 S269 K273 T274 I275	S220-H271 VanDerWaalsContact CB-NE2 3.32Å; S220-H271 WeakPolarHBondContact CB-NE2 3.21Å; S220-H271 PolarHBondContact OG-NE2 2.86Å; L224-H271 HydrophobicContact CD1-CB 4.16Å; E266-H271 PolarHBondContact O-CD2 2.93Å; E266-H271 PolarHBondContact O-NE2 3.38Å; I268-H271 CarbonylContact O-C 3.47Å; I268-H271 PolarHBondContact O-N 3.49Å; S269-H271 PolarHBondContact O-N 3.44Å; H271-K273 VanDerWaalsContact C-N 3.33Å; H271-K273 PolarHBondContact O-N 3.28Å; H271-T274 WeakPolarHBondContact O-CB 3.46Å; H271-T274 PolarHBondContact O-N 3.31Å; H271-T274 VanDerWaalsContact O-N 3.1Å; H271-I275 HydrophobicContact CB-CD1 3.94Å; H271-I275 HydrophobicContact CB-CG1 4.25Å; H271-I275 VanDerWaalsContact O-CG1 3.31Å; H271-I275 WeakPolarHBondContact O-CG1 3.36Å; H271-I275 PolarHBondContact O-N 3.33Å
272	M	94.3	Very high	94.7	Very high	27 Å²	27	48.9 Å²	48.9	13%	0.133	24%	0.237	C	C	.	.	H	α-helix	trans	-49.8	-49.8	-175.2	-70.5	-171.8	-73.8	0	0	113.1	I268 S269 I275 V276 F302 V305 G308 T311	I268-M272 HydrophobicContact CG2-CG 4.4Å; I268-M272 WeakPolarHBondContact O-CG 3.43Å; I268-M272 PolarHBondContact O-N 2.97Å; S269-M272 WeakPolarHBondContact O-CE 3.47Å; M272-I275 PolarHBondContact O-N 3.42Å; M272-V276 WeakPolarHBondContact O-CB 3.49Å; M272-V276 VanDerWaalsContact O-CG2 3.28Å; M272-V276 WeakPolarHBondContact O-CG2 3.31Å; M272-V276 PolarHBondContact O-N 3Å; M272-V276 VanDerWaalsContact O-N 3.07Å; M272-F302 HydrophobicContact CB-CE1 3.75Å; M272-F302 HydrophobicContact CB-CZ 4.34Å; M272-F302 HydrophobicContact CG-CD1 4.4Å; M272-F302 HydrophobicContact CG-CE1 3.91Å; M272-F302 HydrophobicContact CG-CZ 4.49Å; M272-V305 HydrophobicContact SD-CG2 3.7Å; M272-G308 VanDerWaalsContact SD-CA 3.53Å; M272-T311 HydrophobicContact CB-CG2 4.3Å
273	K	94.1	Very high	94.6	Very high	132 Å²	132	48.3 Å²	48.3	57%	0.574	23%	0.233	S	C	*	.	H	α-helix	trans	-63.7	-48.9	178.9	-70.6	-170	176.1	-172.1	0	111.4	H271 I275 V276 E277 T311	H271-K273 VanDerWaalsContact C-N 3.33Å; H271-K273 PolarHBondContact O-N 3.28Å; K273-I275 VanDerWaalsContact C-N 3.3Å; K273-I275 PolarHBondContact O-N 2.97Å; K273-V276 PolarHBondContact O-N 2.88Å; K273-E277 VanDerWaalsContact O-CB 3.3Å; K273-E277 WeakPolarHBondContact O-CB 3.46Å; K273-E277 WeakPolarHBondContact O-CG 3.08Å; K273-E277 PolarHBondContact O-N 3.5Å; K273-T311 HydrophobicContact CG-CG2 3.99Å
274	T	94.1	Very high	94.5	Very high	75 Å²	75	50.4 Å²	50.4	46%	0.46	25%	0.246	S	C	.	.	H	α-helix	trans	-56.4	-42.3	179	-46.7	0	0	0	0	112.3	L224 H271 M278	L224-T274 HydrophobicContact CD1-CG2 4.44Å; L224-T274 HydrophobicContact CD2-CG2 4.34Å; H271-T274 WeakPolarHBondContact O-CB 3.46Å; H271-T274 PolarHBondContact O-N 3.31Å; H271-T274 VanDerWaalsContact O-N 3.1Å; T274-M278 WeakPolarHBondContact O-CA 3.23Å; T274-M278 WeakPolarHBondContact O-CB 3.4Å; T274-M278 PolarHBondContact O-N 3.21Å
275	I	94	Very high	94.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.9	-45.2	179.2	-63.4	160	0	0	0	110.9	L224 A229 Y232 H271 M272 K273 M278 M298 F302	L224-I275 HydrophobicContact CD2-CG1 4.03Å; A229-I275 HydrophobicContact CB-CG2 4.42Å; Y232-I275 HydrophobicContact CD1-CD1 3.9Å; Y232-I275 HydrophobicContact CD1-CG1 4.08Å; Y232-I275 HydrophobicContact CE1-CD1 3.37Å; Y232-I275 HydrophobicContact CE1-CG1 3.91Å; H271-I275 HydrophobicContact CB-CD1 3.94Å; H271-I275 HydrophobicContact CB-CG1 4.25Å; H271-I275 VanDerWaalsContact O-CG1 3.31Å; H271-I275 WeakPolarHBondContact O-CG1 3.36Å; H271-I275 PolarHBondContact O-N 3.33Å; M272-I275 PolarHBondContact O-N 3.42Å; K273-I275 VanDerWaalsContact C-N 3.3Å; K273-I275 PolarHBondContact O-N 2.97Å; I275-M278 WeakPolarHBondContact O-CB 3.49Å; I275-M298 HydrophobicContact CG2-CE 4.3Å; I275-F302 HydrophobicContact CB-CZ 4.14Å; I275-F302 HydrophobicContact CG2-CE2 4.1Å; I275-F302 HydrophobicContact CG2-CZ 4.07Å
276	V	94.7	Very high	94.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-39.3	-178.4	166.8	0	0	0	0	111.7	M272 K273 G282 L283 M298 F302 C315	M272-V276 WeakPolarHBondContact O-CB 3.49Å; M272-V276 VanDerWaalsContact O-CG2 3.28Å; M272-V276 WeakPolarHBondContact O-CG2 3.31Å; M272-V276 PolarHBondContact O-N 3Å; M272-V276 VanDerWaalsContact O-N 3.07Å; K273-V276 PolarHBondContact O-N 2.88Å; V276-G282 CarbonylContact O-C 3.33Å; V276-L283 HydrophobicContact CG1-CB 3.88Å; V276-L283 HydrophobicContact CG1-CD2 4.01Å; V276-L283 PolarHBondContact O-N 3.32Å; V276-M298 HydrophobicContact CG2-SD 4.35Å; V276-F302 HydrophobicContact CG2-CD1 4.32Å; V276-F302 HydrophobicContact CG2-CE1 3.42Å; V276-F302 VanDerWaalsContact CG2-CE1 3.42Å; V276-F302 HydrophobicContact CG2-CZ 3.56Å; V276-C315 HydrophobicContact CG1-CB 3.31Å; V276-C315 VanDerWaalsContact CG1-SG 3.51Å
277	E	94.1	Very high	94.2	Very high	129 Å²	129	46 Å²	46	60%	0.603	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	5	-176.6	-62.2	174.1	172.7	0	0	112.8	K273 E279	K273-E277 VanDerWaalsContact O-CB 3.3Å; K273-E277 WeakPolarHBondContact O-CB 3.46Å; K273-E277 WeakPolarHBondContact O-CG 3.08Å; K273-E277 PolarHBondContact O-N 3.5Å; E277-E279 PolarHBondContact O-N 3.31Å
278	M	93	Very high	94.1	Very high	33 Å²	33	51.3 Å²	51.3	16%	0.163	25%	0.253	C	S	.	.			trans	-54.9	128.1	-176.9	-167	174.6	-75.6	0	0	111.5	L224 A229 T274 I275 N280 S281 G282	L224-M278 HydrophobicContact CD2-CE 3.66Å; A229-M278 HydrophobicContact CB-CB 4.44Å; A229-M278 HydrophobicContact CB-SD 3.98Å; A229-M278 PolarHBondContact N-SD 3.4Å; A229-M278 VanDerWaalsContact N-SD 3.36Å; T274-M278 WeakPolarHBondContact O-CA 3.23Å; T274-M278 WeakPolarHBondContact O-CB 3.4Å; T274-M278 PolarHBondContact O-N 3.21Å; I275-M278 WeakPolarHBondContact O-CB 3.49Å; M278-N280 PolarHBondContact O-N 2.86Å; M278-S281 WeakPolarHBondContact CG-OG 3.34Å; M278-S281 PolarHBondContact O-N 3.07Å; M278-S281 PolarHBondContact SD-OG 3.13Å; M278-G282 WeakPolarHBondContact O-CA 3.44Å; M278-G282 PolarHBondContact O-N 3Å
279	E	88.4	Confident	94.1	Very high	160 Å²	160	56 Å²	56	75%	0.748	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	137.3	-176.9	-154.8	-175.5	160.6	0	0	110.8	E277 S281	E277-E279 PolarHBondContact O-N 3.31Å; E279-S281 PolarHBondContact O-N 3.34Å; E279-S281 PolarHBondContact O-OG 2.63Å
280	N	88.4	Confident	93.9	Very high	120 Å²	120	55.1 Å²	55.1	64%	0.642	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	8	177.2	-57.5	-48.3	0	0	0	116.7	M278 H285	M278-N280 PolarHBondContact O-N 2.86Å; N280-H285 VanDerWaalsContact C-CG 3.45Å; N280-H285 PolarHBondContact O-CD2 3.1Å; N280-H285 PolarHBondContact O-CE1 3.12Å; N280-H285 VanDerWaalsContact O-CG 3.23Å; N280-H285 PolarHBondContact O-ND1 3.01Å; N280-H285 PolarHBondContact O-NE2 3.19Å
281	S	92.4	Very high	93.9	Very high	14 Å²	14	54.2 Å²	54.2	10%	0.098	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	-17.5	178.2	63.9	0	0	0	0	115.2	A229 M278 E279 M286	A229-S281 WeakPolarHBondContact CB-O 3.37Å; A229-S281 PolarHBondContact N-OG 3.41Å; M278-S281 WeakPolarHBondContact CG-OG 3.34Å; M278-S281 PolarHBondContact O-N 3.07Å; M278-S281 PolarHBondContact SD-OG 3.13Å; E279-S281 PolarHBondContact O-N 3.34Å; E279-S281 PolarHBondContact O-OG 2.63Å; S281-M286 WeakPolarHBondContact O-CE 3.41Å
282	G	93.1	Very high	93.8	Very high	2 Å²	2	54 Å²	54	2%	0.021	27%	0.272	C	S	.	.	S	Bend	trans	-69.2	-170.8	178.5	0	0	0	0	0	114.2	V276 M278 V284 H285 M286	V276-G282 CarbonylContact O-C 3.33Å; M278-G282 WeakPolarHBondContact O-CA 3.44Å; M278-G282 PolarHBondContact O-N 3Å; G282-V284 VanDerWaalsContact C-N 3.33Å; G282-V284 PolarHBondContact O-N 3.41Å; G282-H285 WeakPolarHBondContact O-CB 3.46Å; G282-H285 PolarHBondContact O-N 3.48Å; G282-M286 WeakPolarHBondContact O-CG 3.24Å; G282-M286 PolarHBondContact O-N 2.99Å
283	L	95.8	Very high	93.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-54.6	-46.2	-170.3	-178	71	0	0	0	112.7	V276 H285 M286 L287 L295 M298 M312 C315 M316	V276-L283 HydrophobicContact CG1-CB 3.88Å; V276-L283 HydrophobicContact CG1-CD2 4.01Å; V276-L283 PolarHBondContact O-N 3.32Å; L283-H285 VanDerWaalsContact C-N 3.31Å; L283-H285 PolarHBondContact O-N 3.23Å; L283-M286 PolarHBondContact O-N 3.46Å; L283-L287 HydrophobicContact CD1-CD1 4.5Å; L283-L287 HydrophobicContact CD2-CD1 4.47Å; L283-L287 HydrophobicContact CG-CD1 3.99Å; L283-L287 HydrophobicContact CG-CG 4.41Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.45Å; L283-L287 PolarHBondContact O-N 3.5Å; L283-L295 HydrophobicContact CD1-CD2 3.45Å; L283-L295 VanDerWaalsContact CD1-CD2 3.45Å; L283-M298 HydrophobicContact CB-SD 4.12Å; L283-M298 HydrophobicContact CD1-SD 3.86Å; L283-M312 HydrophobicContact CD1-CG 3.78Å; L283-M312 HydrophobicContact CD1-SD 4.09Å; L283-M312 HydrophobicContact CD2-CG 3.65Å; L283-M312 WeakPolarHBondContact CD2-O 3.2Å; L283-M312 HydrophobicContact CG-CG 4.33Å; L283-C315 HydrophobicContact CD2-CB 3.86Å; L283-M316 HydrophobicContact CD2-CB 4.1Å
284	V	95.7	Very high	93.7	Very high	44 Å²	44	53.7 Å²	53.7	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-61.5	-41.2	-179.6	176.4	0	0	0	0	111.3	G282 L287 K288 Y319	G282-V284 VanDerWaalsContact C-N 3.33Å; G282-V284 PolarHBondContact O-N 3.41Å; V284-L287 PolarHBondContact O-N 3.35Å; V284-K288 HydrophobicContact CG1-CD 4.04Å; V284-K288 HydrophobicContact CG1-CG 4.37Å; V284-K288 WeakPolarHBondContact O-CB 3.35Å; V284-K288 VanDerWaalsContact O-CG 3.31Å; V284-K288 WeakPolarHBondContact O-CG 3.45Å; V284-K288 PolarHBondContact O-N 3.13Å; V284-Y319 HydrophobicContact CG1-CD2 3.67Å; V284-Y319 HydrophobicContact CG1-CE2 4.02Å; V284-Y319 HydrophobicContact CG1-CG 4.11Å; V284-Y319 HydrophobicContact CG2-CG 4.42Å
285	H	95.3	Very high	93.8	Very high	53 Å²	53	50.1 Å²	50.1	25%	0.245	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-41.9	176.9	175.6	-88.5	0	0	0	111.4	N280 G282 L283 K288 N289	N280-H285 VanDerWaalsContact C-CG 3.45Å; N280-H285 PolarHBondContact O-CD2 3.1Å; N280-H285 PolarHBondContact O-CE1 3.12Å; N280-H285 VanDerWaalsContact O-CG 3.23Å; N280-H285 PolarHBondContact O-ND1 3.01Å; N280-H285 PolarHBondContact O-NE2 3.19Å; G282-H285 WeakPolarHBondContact O-CB 3.46Å; G282-H285 PolarHBondContact O-N 3.48Å; L283-H285 VanDerWaalsContact C-N 3.31Å; L283-H285 PolarHBondContact O-N 3.23Å; H285-K288 PolarHBondContact O-N 3.34Å; H285-N289 PolarHBondContact CD2-ND2 3.19Å; H285-N289 VanDerWaalsContact CD2-ND2 3.25Å; H285-N289 PolarHBondContact CE1-ND2 3.2Å; H285-N289 VanDerWaalsContact CE1-ND2 3.29Å; H285-N289 PolarHBondContact NE2-ND2 3.04Å; H285-N289 PolarHBondContact O-N 3.33Å; H285-N289 VanDerWaalsContact O-N 3.07Å; H285-N289 PolarHBondContact O-ND2 3.1Å
286	M	95.4	Very high	93.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-43.1	175.7	-62	180	-174.4	0	0	111.7	A229 S230 S281 G282 L283 N289 G290 K291 D294 L295 M298	A229-M286 HydrophobicContact CB-CE 3.97Å; S230-M286 WeakPolarHBondContact OG-CE 3.41Å; S281-M286 WeakPolarHBondContact O-CE 3.41Å; G282-M286 WeakPolarHBondContact O-CG 3.24Å; G282-M286 PolarHBondContact O-N 2.99Å; L283-M286 PolarHBondContact O-N 3.46Å; M286-N289 PolarHBondContact O-N 3.24Å; M286-G290 PolarHBondContact O-N 3.39Å; M286-K291 HydrophobicContact CB-CB 4.28Å; M286-K291 PolarHBondContact O-N 3.1Å; M286-D294 HydrophobicContact CE-CB 4.12Å; M286-D294 HydrophobicContact CG-CB 4.35Å; M286-D294 HydrophobicContact SD-CB 3.8Å; M286-L295 HydrophobicContact CB-CD2 3.65Å; M286-L295 HydrophobicContact CB-CG 3.86Å; M286-L295 HydrophobicContact SD-CD2 4.2Å; M286-M298 HydrophobicContact CE-CE 3.51Å; M286-M298 HydrophobicContact SD-CE 3.77Å
287	L	95.9	Very high	93.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-47.7	175.4	-70.5	170.5	0	0	0	111.3	L283 V284 N289 G290 L295 M316 Y319 R350 F354 F359	L283-L287 HydrophobicContact CD1-CD1 4.5Å; L283-L287 HydrophobicContact CD2-CD1 4.47Å; L283-L287 HydrophobicContact CG-CD1 3.99Å; L283-L287 HydrophobicContact CG-CG 4.41Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.45Å; L283-L287 PolarHBondContact O-N 3.5Å; V284-L287 PolarHBondContact O-N 3.35Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-N289 PolarHBondContact O-N 3.48Å; L287-G290 PolarHBondContact O-N 3.45Å; L287-L295 HydrophobicContact CD2-CD1 3.95Å; L287-L295 HydrophobicContact CD2-CD2 4.23Å; L287-L295 HydrophobicContact CG-CD2 4.3Å; L287-M316 HydrophobicContact CD1-CB 4.36Å; L287-M316 HydrophobicContact CD1-CG 4.07Å; L287-Y319 HydrophobicContact CB-CD1 4.19Å; L287-Y319 HydrophobicContact CB-CE1 3.86Å; L287-Y319 HydrophobicContact CD1-CD1 3.8Å; L287-Y319 HydrophobicContact CD1-CE1 4.31Å; L287-R350 PolarHBondContact O-NH2 3.39Å; L287-F354 HydrophobicContact CB-CE2 4.42Å; L287-F354 HydrophobicContact CD2-CD2 3.49Å; L287-F354 VanDerWaalsContact CD2-CD2 3.49Å; L287-F354 HydrophobicContact CD2-CE2 3.62Å; L287-F354 HydrophobicContact CD2-CG 4.15Å; L287-F354 HydrophobicContact CD2-CZ 4.38Å; L287-F354 WeakPolarHBondContact O-CZ 3.45Å; L287-F359 HydrophobicContact CD2-CZ 4.4Å
288	K	94.5	Very high	93.9	Very high	112 Å²	112	46.6 Å²	46.6	49%	0.487	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-37.4	179.5	-81	178.1	179.2	-179.6	0	113.2	V284 H285 Y319 R350	V284-K288 HydrophobicContact CG1-CD 4.04Å; V284-K288 HydrophobicContact CG1-CG 4.37Å; V284-K288 WeakPolarHBondContact O-CB 3.35Å; V284-K288 VanDerWaalsContact O-CG 3.31Å; V284-K288 WeakPolarHBondContact O-CG 3.45Å; V284-K288 PolarHBondContact O-N 3.13Å; H285-K288 PolarHBondContact O-N 3.34Å; K288-Y319 HydrophobicContact CD-CE2 4.31Å; K288-Y319 VanDerWaalsContact CE-CE2 3.48Å; K288-Y319 HydrophobicContact CG-CE2 3.86Å; K288-Y319 VanDerWaalsContact CG-OH 3.24Å; K288-Y319 WeakPolarHBondContact CG-OH 3.33Å; K288-R350 PolarHBondContact O-NH2 2.95Å
289	N	94.9	Very high	94.1	Very high	98 Å²	98	46.4 Å²	46.4	52%	0.524	24%	0.244	S	C	.	.	H	α-helix	trans	-98.5	0.6	-178.2	-64.3	-63	0	0	0	114	H285 M286 L287 K291	H285-N289 PolarHBondContact CD2-ND2 3.19Å; H285-N289 VanDerWaalsContact CD2-ND2 3.25Å; H285-N289 PolarHBondContact CE1-ND2 3.2Å; H285-N289 VanDerWaalsContact CE1-ND2 3.29Å; H285-N289 PolarHBondContact NE2-ND2 3.04Å; H285-N289 PolarHBondContact O-N 3.33Å; H285-N289 VanDerWaalsContact O-N 3.07Å; H285-N289 PolarHBondContact O-ND2 3.1Å; M286-N289 PolarHBondContact O-N 3.24Å; L287-N289 VanDerWaalsContact C-N 3.32Å; L287-N289 PolarHBondContact O-N 3.48Å; N289-K291 HydrophobicContact CB-CG 4.24Å; N289-K291 PolarHBondContact O-N 3.39Å
290	G	93.9	Very high	94.4	Very high	21 Å²	21	44.9 Å²	44.9	22%	0.216	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	33.2	176.7	0	0	0	0	0	114.3	M286 L287 T292	M286-G290 PolarHBondContact O-N 3.39Å; L287-G290 PolarHBondContact O-N 3.45Å; G290-T292 PolarHBondContact O-N 3.4Å
291	K	94.1	Very high	94.8	Very high	86 Å²	86	39.5 Å²	39.5	37%	0.374	21%	0.206	S	C	.	.			trans	-78.9	78.3	-180	-62.3	-165	176.9	-170	0	111.8	M286 N289 D293 D294 L295	M286-K291 HydrophobicContact CB-CB 4.28Å; M286-K291 PolarHBondContact O-N 3.1Å; N289-K291 HydrophobicContact CB-CG 4.24Å; N289-K291 PolarHBondContact O-N 3.39Å; K291-D293 PolarHBondContact O-N 3.04Å; K291-D294 HydrophobicContact CB-CB 4.1Å; K291-D294 VanDerWaalsContact CD-OD2 3.32Å; K291-D294 WeakPolarHBondContact CD-OD2 3.31Å; K291-D294 IonicContact NZ-OD2 3.97Å; K291-D294 PolarHBondContact O-N 2.88Å; K291-L295 VanDerWaalsContact O-CG 3.28Å; K291-L295 WeakPolarHBondContact O-CG 3.18Å; K291-L295 PolarHBondContact O-N 3.29Å; K291-L295 VanDerWaalsContact O-N 3.11Å
292	T	94.3	Very high	94.9	Very high	26 Å²	26	38.8 Å²	38.8	16%	0.16	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-36.7	-172.5	44.7	0	0	0	0	114.4	G290 L295 A296 F354 E357 S358	G290-T292 PolarHBondContact O-N 3.4Å; T292-L295 PolarHBondContact O-N 3.34Å; T292-A296 WeakPolarHBondContact O-CB 3.36Å; T292-A296 PolarHBondContact O-N 3.29Å; T292-F354 HydrophobicContact CG2-CD1 4Å; T292-F354 HydrophobicContact CG2-CE1 4.13Å; T292-E357 HydrophobicContact CG2-CB 4.44Å; T292-E357 WeakPolarHBondContact CG2-OE2 3.31Å; T292-S358 VanDerWaalsContact CA-OG 3.3Å; T292-S358 WeakPolarHBondContact CA-OG 3.23Å; T292-S358 PolarHBondContact O-OG 3.03Å
293	D	93.3	Very high	95.1	Very high	126 Å²	126	41.8 Å²	41.8	67%	0.674	22%	0.222	S	C	*	.	H	α-helix	trans	-69	-44	179.5	-59.6	-29.6	0	0	0	111.5	K291 L295 A296 C297	K291-D293 PolarHBondContact O-N 3.04Å; D293-L295 VanDerWaalsContact C-N 3.32Å; D293-L295 PolarHBondContact O-N 3.28Å; D293-A296 WeakPolarHBondContact O-CB 3.36Å; D293-A296 PolarHBondContact O-N 3.25Å; D293-A296 VanDerWaalsContact O-N 3.13Å; D293-C297 PolarHBondContact O-N 3.07Å; D293-C297 PolarHBondContact O-SG 3.24Å
294	D	92.9	Very high	95	Very high	28 Å²	28	46.9 Å²	46.9	15%	0.15	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-39.9	176.5	-73.3	-12.5	0	0	0	111.2	S230 M286 K291 A296 C297 M298	S230-D294 PolarHBondContact OG-OD2 2.87Å; M286-D294 HydrophobicContact CE-CB 4.12Å; M286-D294 HydrophobicContact CG-CB 4.35Å; M286-D294 HydrophobicContact SD-CB 3.8Å; K291-D294 HydrophobicContact CB-CB 4.1Å; K291-D294 VanDerWaalsContact CD-OD2 3.32Å; K291-D294 WeakPolarHBondContact CD-OD2 3.31Å; K291-D294 IonicContact NZ-OD2 3.97Å; K291-D294 PolarHBondContact O-N 2.88Å; D294-A296 VanDerWaalsContact C-N 3.33Å; D294-A296 PolarHBondContact O-N 2.94Å; D294-C297 PolarHBondContact O-N 2.76Å; D294-M298 PolarHBondContact O-N 3.14Å
295	L	95.6	Very high	95	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-39.2	173.2	-72.5	170.3	0	0	0	112	L283 M286 L287 K291 T292 D293 M298 Y299 F354 F359	L283-L295 HydrophobicContact CD1-CD2 3.45Å; L283-L295 VanDerWaalsContact CD1-CD2 3.45Å; M286-L295 HydrophobicContact CB-CD2 3.65Å; M286-L295 HydrophobicContact CB-CG 3.86Å; M286-L295 HydrophobicContact SD-CD2 4.2Å; L287-L295 HydrophobicContact CD2-CD1 3.95Å; L287-L295 HydrophobicContact CD2-CD2 4.23Å; L287-L295 HydrophobicContact CG-CD2 4.3Å; K291-L295 VanDerWaalsContact O-CG 3.28Å; K291-L295 WeakPolarHBondContact O-CG 3.18Å; K291-L295 PolarHBondContact O-N 3.29Å; K291-L295 VanDerWaalsContact O-N 3.11Å; T292-L295 PolarHBondContact O-N 3.34Å; D293-L295 VanDerWaalsContact C-N 3.32Å; D293-L295 PolarHBondContact O-N 3.28Å; L295-M298 PolarHBondContact O-N 2.99Å; L295-Y299 WeakPolarHBondContact O-CB 3.46Å; L295-Y299 PolarHBondContact O-N 2.72Å; L295-F354 HydrophobicContact CD1-CD1 3.95Å; L295-F354 HydrophobicContact CD1-CE1 4.17Å; L295-F354 HydrophobicContact CD1-CG 4.32Å; L295-F359 HydrophobicContact CB-CE1 4.13Å; L295-F359 HydrophobicContact CD2-CE1 4.3Å; L295-F359 HydrophobicContact CD2-CZ 4.27Å
296	A	95.8	Very high	94.9	Very high	20 Å²	20	47.6 Å²	47.6	17%	0.165	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-40.7	177.2	0	0	0	0	0	111.8	T292 D293 D294 Y299 K300 S358	T292-A296 WeakPolarHBondContact O-CB 3.36Å; T292-A296 PolarHBondContact O-N 3.29Å; D293-A296 WeakPolarHBondContact O-CB 3.36Å; D293-A296 PolarHBondContact O-N 3.25Å; D293-A296 VanDerWaalsContact O-N 3.13Å; D294-A296 VanDerWaalsContact C-N 3.33Å; D294-A296 PolarHBondContact O-N 2.94Å; A296-Y299 PolarHBondContact O-N 3.16Å; A296-K300 WeakPolarHBondContact O-CG 3.44Å; A296-K300 PolarHBondContact O-N 3.19Å; A296-S358 WeakPolarHBondContact CA-O 3.37Å
297	C	94.5	Very high	94.8	Very high	36 Å²	36	52.7 Å²	52.7	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-45.9	173	-71.5	0	0	0	0	111.4	I233 D293 D294 Y299 K300 L301	I233-C297 HydrophobicContact CG2-CB 3.96Å; D293-C297 PolarHBondContact O-N 3.07Å; D293-C297 PolarHBondContact O-SG 3.24Å; D294-C297 PolarHBondContact O-N 2.76Å; C297-Y299 PolarHBondContact O-N 3.44Å; C297-K300 PolarHBondContact O-N 2.85Å; C297-L301 PolarHBondContact O-N 3.44Å
298	M	95.7	Very high	94.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-44.9	176.4	-171.2	177.3	-76.5	0	0	111.4	A229 I233 I275 V276 L283 M286 D294 L295 K300 L301 F302 M312	A229-M298 HydrophobicContact CB-CE 4.36Å; I233-M298 HydrophobicContact CD1-CB 3.71Å; I233-M298 HydrophobicContact CD1-CE 3.75Å; I233-M298 HydrophobicContact CD1-CG 3.97Å; I275-M298 HydrophobicContact CG2-CE 4.3Å; V276-M298 HydrophobicContact CG2-SD 4.35Å; L283-M298 HydrophobicContact CB-SD 4.12Å; L283-M298 HydrophobicContact CD1-SD 3.86Å; M286-M298 HydrophobicContact CE-CE 3.51Å; M286-M298 HydrophobicContact SD-CE 3.77Å; D294-M298 PolarHBondContact O-N 3.14Å; L295-M298 PolarHBondContact O-N 2.99Å; M298-K300 PolarHBondContact O-N 3.45Å; M298-L301 PolarHBondContact O-N 2.9Å; M298-F302 HydrophobicContact CG-CD2 3.91Å; M298-F302 HydrophobicContact CG-CE2 3.93Å; M298-F302 WeakPolarHBondContact O-CB 3.46Å; M298-F302 VanDerWaalsContact O-CD2 3.24Å; M298-F302 WeakPolarHBondContact O-CD2 3.49Å; M298-F302 PolarHBondContact O-N 3.04Å; M298-M312 HydrophobicContact CB-SD 4.42Å; M298-M312 HydrophobicContact CG-SD 3.86Å; M298-M312 HydrophobicContact SD-SD 4.06Å
299	Y	96.7	Very high	94.9	Very high	28 Å²	28	49 Å²	49	11%	0.11	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-50	176.4	174.5	-96.1	0	0	0	112.1	L295 A296 C297 L301 F302 S303 L309 M312 F359 N360 D362 F365	L295-Y299 WeakPolarHBondContact O-CB 3.46Å; L295-Y299 PolarHBondContact O-N 2.72Å; A296-Y299 PolarHBondContact O-N 3.16Å; C297-Y299 PolarHBondContact O-N 3.44Å; Y299-L301 VanDerWaalsContact C-N 3.35Å; Y299-L301 PolarHBondContact O-N 2.91Å; Y299-F302 PolarHBondContact O-N 2.65Å; Y299-S303 WeakPolarHBondContact O-CB 3.46Å; Y299-S303 PolarHBondContact O-N 3.42Å; Y299-L309 HydrophobicContact CD2-CD2 3.62Å; Y299-L309 HydrophobicContact CE2-CD1 4.11Å; Y299-L309 HydrophobicContact CE2-CD2 3.61Å; Y299-L309 HydrophobicContact CG-CD2 4.44Å; Y299-M312 HydrophobicContact CD2-CE 3.93Å; Y299-M312 HydrophobicContact CG-CE 4.47Å; Y299-F359 HydrophobicContact CD2-CB 4.19Å; Y299-F359 HydrophobicContact CD2-CD1 4.13Å; Y299-F359 HydrophobicContact CE2-CB 4.38Å; Y299-F359 HydrophobicContact CG-CD1 4.38Å; Y299-N360 HydrophobicContact CE1-CB 3.97Å; Y299-D362 HydrophobicContact CE2-CB 4.02Å; Y299-F365 HydrophobicContact CD2-CE2 4.41Å; Y299-F365 HydrophobicContact CE2-CE2 4.34Å
300	K	95.1	Very high	94.9	Very high	129 Å²	129	49.5 Å²	49.5	56%	0.561	26%	0.261	S	S	*	.	H	α-helix	trans	-59.2	-45.4	178.3	-73.1	174.4	-177.2	178.9	0	111.4	A296 C297 M298 S303	A296-K300 WeakPolarHBondContact O-CG 3.44Å; A296-K300 PolarHBondContact O-N 3.19Å; C297-K300 PolarHBondContact O-N 2.85Å; M298-K300 PolarHBondContact O-N 3.45Å; K300-S303 PolarHBondContact O-N 2.83Å; K300-S303 PolarHBondContact O-OG 3.4Å
301	L	94.9	Very high	95	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-46.9	179.4	-172	72.4	0	0	0	111.5	I233 V236 I240 I268 C297 M298 Y299 S303 R304	I233-L301 HydrophobicContact CB-CD2 4.18Å; I233-L301 HydrophobicContact CG1-CD2 3.8Å; I233-L301 HydrophobicContact CG2-CB 4.26Å; I233-L301 HydrophobicContact CG2-CD2 4.02Å; V236-L301 HydrophobicContact CB-CD1 4.32Å; V236-L301 HydrophobicContact CG1-CD1 3.82Å; I240-L301 HydrophobicContact CD1-CD1 4.48Å; I268-L301 HydrophobicContact CD1-CD1 3.46Å; I268-L301 VanDerWaalsContact CD1-CD1 3.46Å; I268-L301 HydrophobicContact CD1-CD2 4.46Å; I268-L301 HydrophobicContact CD1-CG 3.78Å; I268-L301 HydrophobicContact CG1-CD1 4.07Å; I268-L301 HydrophobicContact CG1-CD2 4.27Å; I268-L301 HydrophobicContact CG1-CG 4.12Å; I268-L301 HydrophobicContact CG2-CG 4.4Å; C297-L301 PolarHBondContact O-N 3.44Å; M298-L301 PolarHBondContact O-N 2.9Å; Y299-L301 VanDerWaalsContact C-N 3.35Å; Y299-L301 PolarHBondContact O-N 2.91Å; L301-S303 VanDerWaalsContact C-N 3.29Å; L301-S303 PolarHBondContact O-N 3.45Å; L301-R304 WeakPolarHBondContact O-CB 3.32Å; L301-R304 PolarHBondContact O-N 2.86Å
302	F	95.9	Very high	95.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-74.1	-18.9	-177.3	-81.5	-118.3	0	0	0	113.1	M272 I275 V276 M298 Y299 R304 G308 L309	M272-F302 HydrophobicContact CB-CE1 3.75Å; M272-F302 HydrophobicContact CB-CZ 4.34Å; M272-F302 HydrophobicContact CG-CD1 4.4Å; M272-F302 HydrophobicContact CG-CE1 3.91Å; M272-F302 HydrophobicContact CG-CZ 4.49Å; I275-F302 HydrophobicContact CB-CZ 4.14Å; I275-F302 HydrophobicContact CG2-CE2 4.1Å; I275-F302 HydrophobicContact CG2-CZ 4.07Å; V276-F302 HydrophobicContact CG2-CD1 4.32Å; V276-F302 HydrophobicContact CG2-CE1 3.42Å; V276-F302 VanDerWaalsContact CG2-CE1 3.42Å; V276-F302 HydrophobicContact CG2-CZ 3.56Å; M298-F302 HydrophobicContact CG-CD2 3.91Å; M298-F302 HydrophobicContact CG-CE2 3.93Å; M298-F302 WeakPolarHBondContact O-CB 3.46Å; M298-F302 VanDerWaalsContact O-CD2 3.24Å; M298-F302 WeakPolarHBondContact O-CD2 3.49Å; M298-F302 PolarHBondContact O-N 3.04Å; Y299-F302 PolarHBondContact O-N 2.65Å; F302-R304 PolarHBondContact O-N 3.33Å; F302-G308 WeakPolarHBondContact CD1-O 3.28Å; F302-G308 WeakPolarHBondContact O-CA 3.27Å; F302-L309 HydrophobicContact CB-CD2 4.32Å
303	S	96.3	Very high	95.3	Very high	65 Å²	65	44.3 Å²	44.3	46%	0.455	23%	0.233	S	C	.	.	H	α-helix	trans	-68.9	-17.8	171.7	71.5	0	0	0	0	114	Y299 K300 L301	Y299-S303 WeakPolarHBondContact O-CB 3.46Å; Y299-S303 PolarHBondContact O-N 3.42Å; K300-S303 PolarHBondContact O-N 2.83Å; K300-S303 PolarHBondContact O-OG 3.4Å; L301-S303 VanDerWaalsContact C-N 3.29Å; L301-S303 PolarHBondContact O-N 3.45Å
304	R	94.6	Very high	95.4	Very high	106 Å²	106	43.3 Å²	43.3	40%	0.4	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-27.9	179.1	-66.3	175.9	170.8	-88.6	1.4	113.1	E264 L301 F302	E264-R304 WeakPolarHBondContact OE1-CB 3.2Å; E264-R304 IonicContact OE1-NH1 2.59Å; L301-R304 WeakPolarHBondContact O-CB 3.32Å; L301-R304 PolarHBondContact O-N 2.86Å; F302-R304 PolarHBondContact O-N 3.33Å
305	V	95.1	Very high	95.6	Very high	10 Å²	10	42.7 Å²	42.7	6%	0.061	22%	0.222	C	C	.	.	S	Bend	trans	-111.7	144.7	-172.2	-63.1	0	0	0	0	112.5	E264 I268 S269 M272 N307 G308	E264-V305 HydrophobicContact CB-CG1 3.96Å; I268-V305 HydrophobicContact CB-CG1 4.07Å; I268-V305 HydrophobicContact CD1-CG1 4.3Å; I268-V305 HydrophobicContact CG2-CG1 4.04Å; I268-V305 HydrophobicContact CG2-CG2 3.76Å; S269-V305 WeakPolarHBondContact OG-CG1 3.3Å; M272-V305 HydrophobicContact SD-CG2 3.7Å; V305-N307 PolarHBondContact O-N 3Å; V305-G308 PolarHBondContact O-N 2.66Å
306	P	93.1	Very high	95.7	Very high	102 Å²	102	42.7 Å²	42.7	66%	0.662	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	141.1	174.6	27.4	-34.5	0	0	0	110.4	G308	P306-G308 PolarHBondContact O-N 3.39Å; P306-G308 VanDerWaalsContact O-N 3.12Å
307	N	94	Very high	95.8	Very high	108 Å²	108	42.5 Å²	42.5	58%	0.578	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	2.9	-175.6	-53.8	-59.2	0	0	0	116.1	V305 K310 T311	V305-N307 PolarHBondContact O-N 3Å; N307-K310 PolarHBondContact O-N 2.91Å; N307-T311 PolarHBondContact O-N 3.46Å; N307-T311 PolarHBondContact O-OG1 2.99Å
308	G	95.4	Very high	95.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-58.9	177	0	0	0	0	0	112	M272 F302 V305 P306 K310 T311 M312	M272-G308 VanDerWaalsContact SD-CA 3.53Å; F302-G308 WeakPolarHBondContact CD1-O 3.28Å; F302-G308 WeakPolarHBondContact O-CA 3.27Å; V305-G308 PolarHBondContact O-N 2.66Å; P306-G308 PolarHBondContact O-N 3.39Å; P306-G308 VanDerWaalsContact O-N 3.12Å; G308-K310 PolarHBondContact O-N 2.94Å; G308-T311 WeakPolarHBondContact O-CB 3.29Å; G308-T311 PolarHBondContact O-N 3.36Å; G308-T311 VanDerWaalsContact O-N 3.1Å; G308-M312 PolarHBondContact O-N 3.47Å; G308-M312 VanDerWaalsContact O-N 3.1Å
309	L	96.3	Very high	95.9	Very high	35 Å²	35	44.8 Å²	44.8	18%	0.183	24%	0.235	C	C	.	.	H	α-helix	trans	-57.4	-35.4	177.9	-63.1	-174.6	0	0	0	112.8	Y299 F302 M312 C313 F365	Y299-L309 HydrophobicContact CD2-CD2 3.62Å; Y299-L309 HydrophobicContact CE2-CD1 4.11Å; Y299-L309 HydrophobicContact CE2-CD2 3.61Å; Y299-L309 HydrophobicContact CG-CD2 4.44Å; F302-L309 HydrophobicContact CB-CD2 4.32Å; L309-M312 PolarHBondContact O-N 3.33Å; L309-C313 VanDerWaalsContact O-CB 3.25Å; L309-C313 WeakPolarHBondContact O-CB 3.46Å; L309-C313 PolarHBondContact O-N 3.25Å; L309-F365 HydrophobicContact CB-CE2 4.29Å; L309-F365 HydrophobicContact CD2-CE2 4.42Å
310	K	96.1	Very high	96	Very high	107 Å²	107	43.5 Å²	43.5	47%	0.465	23%	0.23	S	C	.	.	H	α-helix	trans	-62.9	-47.3	176.1	-175.2	-179	174.5	-173.5	0	111.8	N307 G308 M312 C313 E314	N307-K310 PolarHBondContact O-N 2.91Å; G308-K310 PolarHBondContact O-N 2.94Å; K310-M312 VanDerWaalsContact C-N 3.33Å; K310-M312 PolarHBondContact O-N 3.43Å; K310-C313 WeakPolarHBondContact O-CB 3.35Å; K310-C313 PolarHBondContact O-N 3.34Å; K310-C313 VanDerWaalsContact O-N 3.16Å; K310-E314 WeakPolarHBondContact CE-OE1 3.23Å; K310-E314 WeakPolarHBondContact O-CG 3.25Å; K310-E314 PolarHBondContact O-N 2.9Å
311	T	96.3	Very high	96.1	Very high	19 Å²	19	41.7 Å²	41.7	12%	0.117	22%	0.219	C	C	.	.	H	α-helix	trans	-59.9	-44.3	178	-54.4	0	0	0	0	111.2	M272 K273 N307 G308 C313 E314 C315	M272-T311 HydrophobicContact CB-CG2 4.3Å; K273-T311 HydrophobicContact CG-CG2 3.99Å; N307-T311 PolarHBondContact O-N 3.46Å; N307-T311 PolarHBondContact O-OG1 2.99Å; G308-T311 WeakPolarHBondContact O-CB 3.29Å; G308-T311 PolarHBondContact O-N 3.36Å; G308-T311 VanDerWaalsContact O-N 3.1Å; T311-C313 VanDerWaalsContact C-N 3.34Å; T311-C313 PolarHBondContact O-N 2.97Å; T311-E314 PolarHBondContact O-N 3.47Å; T311-C315 PolarHBondContact O-N 2.88Å
312	M	96.4	Very high	96.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-40.9	176.3	-167.2	172.9	95.8	0	0	111.5	L283 M298 Y299 G308 L309 K310 C315 M316 F359 F365	L283-M312 HydrophobicContact CD1-CG 3.78Å; L283-M312 HydrophobicContact CD1-SD 4.09Å; L283-M312 HydrophobicContact CD2-CG 3.65Å; L283-M312 WeakPolarHBondContact CD2-O 3.2Å; L283-M312 HydrophobicContact CG-CG 4.33Å; M298-M312 HydrophobicContact CB-SD 4.42Å; M298-M312 HydrophobicContact CG-SD 3.86Å; M298-M312 HydrophobicContact SD-SD 4.06Å; Y299-M312 HydrophobicContact CD2-CE 3.93Å; Y299-M312 HydrophobicContact CG-CE 4.47Å; G308-M312 PolarHBondContact O-N 3.47Å; G308-M312 VanDerWaalsContact O-N 3.1Å; L309-M312 PolarHBondContact O-N 3.33Å; K310-M312 VanDerWaalsContact C-N 3.33Å; K310-M312 PolarHBondContact O-N 3.43Å; M312-C315 PolarHBondContact O-N 3.48Å; M312-M316 WeakPolarHBondContact O-CB 3.16Å; M312-M316 PolarHBondContact O-N 3.41Å; M312-F359 HydrophobicContact CE-CD1 3.53Å; M312-F359 HydrophobicContact CE-CE1 3.32Å; M312-F359 HydrophobicContact CE-CG 4.45Å; M312-F359 HydrophobicContact CE-CZ 4.11Å; M312-F365 HydrophobicContact CB-CZ 4.12Å; M312-F365 HydrophobicContact CE-CE1 3.56Å; M312-F365 HydrophobicContact CE-CE2 4.12Å; M312-F365 HydrophobicContact CE-CZ 3.24Å; M312-F365 HydrophobicContact CG-CE1 4.42Å; M312-F365 HydrophobicContact CG-CZ 4.15Å; M312-F365 HydrophobicContact SD-CZ 4.45Å
313	C	96.6	Very high	96	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.034	26%	0.26	C	S	.	.	H	α-helix	trans	-66.1	-40.4	179	-153.9	0	0	0	0	112.7	L309 K310 T311 M316 S317 L364 F365 T368	L309-C313 VanDerWaalsContact O-CB 3.25Å; L309-C313 WeakPolarHBondContact O-CB 3.46Å; L309-C313 PolarHBondContact O-N 3.25Å; K310-C313 WeakPolarHBondContact O-CB 3.35Å; K310-C313 PolarHBondContact O-N 3.34Å; K310-C313 VanDerWaalsContact O-N 3.16Å; T311-C313 VanDerWaalsContact C-N 3.34Å; T311-C313 PolarHBondContact O-N 2.97Å; C313-M316 PolarHBondContact O-N 3.01Å; C313-S317 VanDerWaalsContact O-CB 3.29Å; C313-S317 WeakPolarHBondContact O-CB 3.33Å; C313-S317 PolarHBondContact O-N 3.38Å; C313-L364 HydrophobicContact CB-CD2 4.23Å; C313-L364 HydrophobicContact CB-CG 4.37Å; C313-F365 HydrophobicContact CB-CE1 4.22Å; C313-F365 HydrophobicContact CB-CE2 4.37Å; C313-F365 HydrophobicContact CB-CZ 4.01Å; C313-T368 WeakPolarHBondContact SG-CB 3.32Å; C313-T368 PolarHBondContact SG-OG1 3.46Å
314	E	96.7	Very high	95.9	Very high	105 Å²	105	47.2 Å²	47.2	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-61.9	-44.8	176.2	-74.2	172.1	178.5	0	0	111.8	K310 T311 S317 S318	K310-E314 WeakPolarHBondContact CE-OE1 3.23Å; K310-E314 WeakPolarHBondContact O-CG 3.25Å; K310-E314 PolarHBondContact O-N 2.9Å; T311-E314 PolarHBondContact O-N 3.47Å; E314-S317 PolarHBondContact O-N 2.82Å; E314-S318 PolarHBondContact O-N 3.34Å
315	C	96.8	Very high	95.9	Very high	16 Å²	16	46.2 Å²	46.2	11%	0.108	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-44.6	176	179.8	0	0	0	0	112	V276 L283 T311 M312 S317 S318 Y319	V276-C315 HydrophobicContact CG1-CB 3.31Å; V276-C315 VanDerWaalsContact CG1-SG 3.51Å; L283-C315 HydrophobicContact CD2-CB 3.86Å; T311-C315 PolarHBondContact O-N 2.88Å; M312-C315 PolarHBondContact O-N 3.48Å; C315-S317 VanDerWaalsContact C-N 3.3Å; C315-S317 PolarHBondContact O-N 3.43Å; C315-S318 PolarHBondContact O-N 3.33Å; C315-Y319 PolarHBondContact O-N 3.49Å; C315-Y319 VanDerWaalsContact O-N 3.13Å
316	M	97.4	Very high	95.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-44.4	173.9	-179.1	-167.4	66.7	0	0	111.3	L283 L287 M312 C313 Y319 L320 F351 F359 F365 T368 I369	L283-M316 HydrophobicContact CD2-CB 4.1Å; L287-M316 HydrophobicContact CD1-CB 4.36Å; L287-M316 HydrophobicContact CD1-CG 4.07Å; M312-M316 WeakPolarHBondContact O-CB 3.16Å; M312-M316 PolarHBondContact O-N 3.41Å; C313-M316 PolarHBondContact O-N 3.01Å; M316-Y319 PolarHBondContact O-N 2.66Å; M316-L320 WeakPolarHBondContact O-CB 3.47Å; M316-L320 PolarHBondContact O-N 2.92Å; M316-F351 HydrophobicContact CG-CD1 4.43Å; M316-F351 HydrophobicContact CG-CE1 3.74Å; M316-F351 HydrophobicContact SD-CD1 4.19Å; M316-F351 HydrophobicContact SD-CE1 4.09Å; M316-F359 HydrophobicContact SD-CE2 3.85Å; M316-F365 HydrophobicContact CE-CD1 3.56Å; M316-F365 HydrophobicContact CE-CE1 4.12Å; M316-F365 HydrophobicContact CE-CG 4.43Å; M316-F365 HydrophobicContact SD-CD1 3.63Å; M316-F365 HydrophobicContact SD-CE1 4.02Å; M316-T368 HydrophobicContact CE-CG2 4.28Å; M316-I369 HydrophobicContact CE-CD1 4.26Å; M316-I369 HydrophobicContact CE-CG1 3.75Å; M316-I369 HydrophobicContact SD-CD1 4.33Å; M316-I369 HydrophobicContact SD-CG1 4.26Å
317	S	97.6	Very high	95.5	Very high	15 Å²	15	46.6 Å²	46.6	11%	0.105	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-45	-179.6	-177.1	0	0	0	0	111.6	C313 E314 C315 Y319 L320 R321 D372	C313-S317 VanDerWaalsContact O-CB 3.29Å; C313-S317 WeakPolarHBondContact O-CB 3.33Å; C313-S317 PolarHBondContact O-N 3.38Å; E314-S317 PolarHBondContact O-N 2.82Å; C315-S317 VanDerWaalsContact C-N 3.3Å; C315-S317 PolarHBondContact O-N 3.43Å; S317-Y319 VanDerWaalsContact C-N 3.34Å; S317-Y319 PolarHBondContact O-N 2.99Å; S317-L320 PolarHBondContact O-N 3.41Å; S317-R321 WeakPolarHBondContact O-CB 3.24Å; S317-R321 VanDerWaalsContact O-CG 3.27Å; S317-R321 WeakPolarHBondContact O-CG 3.28Å; S317-R321 PolarHBondContact O-N 3.35Å; S317-D372 WeakPolarHBondContact CA-OD2 3.38Å; S317-D372 VanDerWaalsContact CB-OD2 3.23Å; S317-D372 WeakPolarHBondContact CB-OD2 3.33Å; S317-D372 PolarHBondContact OG-OD1 2.89Å; S317-D372 PolarHBondContact OG-OD2 3.3Å
318	S	97.1	Very high	95.2	Very high	79 Å²	79	41.6 Å²	41.6	55%	0.552	22%	0.215	S	C	*	.	H	α-helix	trans	-55.9	-49.7	175.4	-171.9	0	0	0	0	111.4	E314 C315 R321 E322	E314-S318 PolarHBondContact O-N 3.34Å; C315-S318 PolarHBondContact O-N 3.33Å; S318-R321 PolarHBondContact O-N 2.94Å; S318-E322 PolarHBondContact O-N 3.38Å
319	Y	96.6	Very high	94.6	Very high	6 Å²	6	44.1 Å²	44.1	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-44.9	178.1	171.9	-110.7	0	0	0	112.9	V284 L287 K288 C315 M316 S317 R321 E322 Q323 F351	V284-Y319 HydrophobicContact CG1-CD2 3.67Å; V284-Y319 HydrophobicContact CG1-CE2 4.02Å; V284-Y319 HydrophobicContact CG1-CG 4.11Å; V284-Y319 HydrophobicContact CG2-CG 4.42Å; L287-Y319 HydrophobicContact CB-CD1 4.19Å; L287-Y319 HydrophobicContact CB-CE1 3.86Å; L287-Y319 HydrophobicContact CD1-CD1 3.8Å; L287-Y319 HydrophobicContact CD1-CE1 4.31Å; K288-Y319 HydrophobicContact CD-CE2 4.31Å; K288-Y319 VanDerWaalsContact CE-CE2 3.48Å; K288-Y319 HydrophobicContact CG-CE2 3.86Å; K288-Y319 VanDerWaalsContact CG-OH 3.24Å; K288-Y319 WeakPolarHBondContact CG-OH 3.33Å; C315-Y319 PolarHBondContact O-N 3.49Å; C315-Y319 VanDerWaalsContact O-N 3.13Å; M316-Y319 PolarHBondContact O-N 2.66Å; S317-Y319 VanDerWaalsContact C-N 3.34Å; S317-Y319 PolarHBondContact O-N 2.99Å; Y319-R321 VanDerWaalsContact C-N 3.33Å; Y319-R321 PolarHBondContact O-N 3.49Å; Y319-E322 PolarHBondContact O-N 3.45Å; Y319-Q323 HydrophobicContact CD2-CG 4.04Å; Y319-Q323 HydrophobicContact CE1-CG 4.13Å; Y319-Q323 HydrophobicContact CE2-CG 3.52Å; Y319-Q323 WeakPolarHBondContact O-CG 3.36Å; Y319-Q323 PolarHBondContact O-N 2.69Å; Y319-F351 AromaticContact CD1-CZ 4Å; Y319-F351 HydrophobicContact CD1-CZ 4Å; Y319-F351 HydrophobicContact CE1-CE2 4.5Å; Y319-F351 HydrophobicContact CE1-CZ 4Å
320	L	97.7	Very high	93	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-40.8	178.8	175.4	56.7	0	0	0	111.4	M316 S317 Q323 G324 L347 F351 I369 D372 F373 F376	M316-L320 WeakPolarHBondContact O-CB 3.47Å; M316-L320 PolarHBondContact O-N 2.92Å; S317-L320 PolarHBondContact O-N 3.41Å; L320-Q323 PolarHBondContact O-N 2.96Å; L320-G324 PolarHBondContact O-N 3.48Å; L320-L347 HydrophobicContact CD1-CD1 4.35Å; L320-L347 HydrophobicContact CD1-CD2 3.99Å; L320-L347 HydrophobicContact CD1-CG 4.14Å; L320-F351 HydrophobicContact CB-CE1 3.9Å; L320-F351 HydrophobicContact CB-CZ 3.83Å; L320-F351 HydrophobicContact CD1-CD1 4.3Å; L320-F351 HydrophobicContact CD1-CD2 3.83Å; L320-F351 HydrophobicContact CD1-CE1 4.09Å; L320-F351 HydrophobicContact CD1-CE2 3.61Å; L320-F351 HydrophobicContact CD1-CG 4.17Å; L320-F351 HydrophobicContact CD1-CZ 3.73Å; L320-F351 HydrophobicContact CD2-CD1 4.05Å; L320-F351 HydrophobicContact CD2-CE1 4.08Å; L320-F351 HydrophobicContact CD2-CG 4.45Å; L320-F351 HydrophobicContact CG-CE1 4.23Å; L320-F351 HydrophobicContact CG-CZ 4.22Å; L320-I369 HydrophobicContact CD2-CB 4.32Å; L320-I369 HydrophobicContact CD2-CG1 4.19Å; L320-I369 HydrophobicContact CD2-CG2 4.19Å; L320-D372 HydrophobicContact CD2-CB 3.78Å; L320-D372 HydrophobicContact CG-CB 4.08Å; L320-F373 HydrophobicContact CD1-CE2 3.96Å; L320-F373 HydrophobicContact CD1-CZ 4.47Å; L320-F373 HydrophobicContact CD2-CD2 4.35Å; L320-F373 HydrophobicContact CD2-CE2 4.22Å; L320-F376 HydrophobicContact CD1-CE1 4.23Å; L320-F376 HydrophobicContact CG-CE1 4.2Å
321	R	96.8	Very high	90.8	Very high	91 Å²	91	52 Å²	52	34%	0.343	27%	0.269	S	S	.	.	H	α-helix	trans	-64.6	-40.2	175.3	-74.3	179.5	-176.9	-152.4	-3.4	112.2	S317 S318 Y319 K325 D372 Y375	S317-R321 WeakPolarHBondContact O-CB 3.24Å; S317-R321 VanDerWaalsContact O-CG 3.27Å; S317-R321 WeakPolarHBondContact O-CG 3.28Å; S317-R321 PolarHBondContact O-N 3.35Å; S318-R321 PolarHBondContact O-N 2.94Å; Y319-R321 VanDerWaalsContact C-N 3.33Å; Y319-R321 PolarHBondContact O-N 3.49Å; R321-K325 VanDerWaalsContact O-CB 3.28Å; R321-K325 WeakPolarHBondContact O-CB 3.37Å; R321-K325 WeakPolarHBondContact O-CG 3.45Å; R321-K325 PolarHBondContact O-N 3.13Å; R321-D372 HydrophobicContact CG-CB 4.16Å; R321-D372 IonicContact CZ-OD1 3.7Å; R321-D372 VanDerWaalsContact CZ-OD1 3.26Å; R321-D372 IonicContact NE-OD1 3.71Å; R321-D372 PolarHBondContact NE-OD1 2.98Å; R321-D372 IonicContact NH2-OD1 3.5Å; R321-D372 PolarHBondContact NH2-OD1 3.44Å; R321-Y375 HydrophobicContact CG-CD1 4.15Å; R321-Y375 HydrophobicContact CG-CE1 4.47Å
322	E	95.3	Very high	88.5	Confident	123 Å²	123	53 Å²	53	58%	0.575	28%	0.284	S	S	*	.	H	α-helix	trans	-61.7	-49.7	176.1	-172.3	-176.8	179.4	0	0	111	S318 Y319 G324 K325 A326	S318-E322 PolarHBondContact O-N 3.38Å; Y319-E322 PolarHBondContact O-N 3.45Å; E322-G324 PolarHBondContact O-N 3.11Å; E322-K325 PolarHBondContact O-N 3.48Å; E322-A326 PolarHBondContact O-N 3.5Å
323	Q	95.2	Very high	85.8	Confident	65 Å²	65	62.9 Å²	62.9	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-43.8	177.3	-66.2	-66.3	94.2	0	0	112	Y319 L320 A326 L327 L347	Y319-Q323 HydrophobicContact CD2-CG 4.04Å; Y319-Q323 HydrophobicContact CE1-CG 4.13Å; Y319-Q323 HydrophobicContact CE2-CG 3.52Å; Y319-Q323 WeakPolarHBondContact O-CG 3.36Å; Y319-Q323 PolarHBondContact O-N 2.69Å; L320-Q323 PolarHBondContact O-N 2.96Å; Q323-A326 PolarHBondContact O-N 2.99Å; Q323-L327 PolarHBondContact O-N 3.49Å; Q323-L347 HydrophobicContact CB-CD1 4.43Å; Q323-L347 HydrophobicContact CB-CD2 4.36Å
324	G	94.2	Very high	83.8	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.3	-46.8	176.3	0	0	0	0	0	111.8	L320 E322 A326 L327 V328	L320-G324 PolarHBondContact O-N 3.48Å; E322-G324 PolarHBondContact O-N 3.11Å; G324-A326 PolarHBondContact O-N 3.47Å; G324-L327 WeakPolarHBondContact O-CB 3.42Å; G324-L327 PolarHBondContact O-N 3.1Å; G324-V328 WeakPolarHBondContact O-CG1 3.38Å; G324-V328 WeakPolarHBondContact O-CG2 3.5Å; G324-V328 PolarHBondContact O-N 3.02Å
325	K	93.1	Very high	82.2	Confident	84 Å²	84	64.9 Å²	64.9	37%	0.365	36%	0.358	S	S	.	.	H	α-helix	trans	-56.6	-47.8	174.3	-78.7	177.4	-173.1	-174.8	0	111.7	R321 E322 L327 V328 S329 Y375 L379	R321-K325 VanDerWaalsContact O-CB 3.28Å; R321-K325 WeakPolarHBondContact O-CB 3.37Å; R321-K325 WeakPolarHBondContact O-CG 3.45Å; R321-K325 PolarHBondContact O-N 3.13Å; E322-K325 PolarHBondContact O-N 3.48Å; K325-L327 PolarHBondContact O-N 2.88Å; K325-V328 PolarHBondContact O-N 2.86Å; K325-S329 WeakPolarHBondContact O-CB 3.34Å; K325-S329 PolarHBondContact O-N 3.27Å; K325-S329 PolarHBondContact O-OG 3.43Å; K325-Y375 WeakPolarHBondContact CE-OH 3.43Å; K325-Y375 PolarHBondContact NZ-OH 3.35Å; K325-L379 HydrophobicContact CD-CD1 4.44Å; K325-L379 HydrophobicContact CG-CD1 3.77Å
326	A	91	Very high	81.3	Confident	62 Å²	62	66 Å²	66	51%	0.512	36%	0.363	S	S	.	.	H	α-helix	trans	-57.7	-38.2	179.1	0	0	0	0	0	112.6	E322 Q323 G324 K335	E322-A326 PolarHBondContact O-N 3.5Å; Q323-A326 PolarHBondContact O-N 2.99Å; G324-A326 PolarHBondContact O-N 3.47Å; A326-K335 PolarHBondContact O-NZ 3.48Å
327	L	89.4	Confident	80.6	Confident	59 Å²	59	66.5 Å²	66.5	31%	0.309	37%	0.366	S	S	.	.	H	α-helix	trans	-66.6	-46.8	173.9	-68.7	173.4	0	0	0	111.6	Q323 G324 K325 K335 L344 L347	Q323-L327 PolarHBondContact O-N 3.49Å; G324-L327 WeakPolarHBondContact O-CB 3.42Å; G324-L327 PolarHBondContact O-N 3.1Å; K325-L327 PolarHBondContact O-N 2.88Å; L327-K335 PolarHBondContact O-NZ 3.49Å; L327-L344 HydrophobicContact CB-CD2 4.35Å; L327-L344 HydrophobicContact CD1-CD2 4.13Å; L327-L347 HydrophobicContact CD1-CB 4.17Å; L327-L347 HydrophobicContact CD1-CD2 3.71Å
328	V	88.6	Confident	79.9	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.018	37%	0.367	C	S	.	.	H	α-helix	trans	-83.7	-17.7	-172.3	-55.4	0	0	0	0	115.5	G324 K325 Y340 L344 F376 L379 N380	G324-V328 WeakPolarHBondContact O-CG1 3.38Å; G324-V328 WeakPolarHBondContact O-CG2 3.5Å; G324-V328 PolarHBondContact O-N 3.02Å; K325-V328 PolarHBondContact O-N 2.86Å; V328-Y340 HydrophobicContact CB-CE2 4.26Å; V328-Y340 WeakPolarHBondContact CB-OH 3.43Å; V328-Y340 HydrophobicContact CG1-CE2 4.31Å; V328-Y340 VanDerWaalsContact CG1-OH 3.28Å; V328-Y340 WeakPolarHBondContact CG1-OH 3.45Å; V328-L344 HydrophobicContact CG1-CD2 4.13Å; V328-F376 HydrophobicContact CG1-CD2 4.09Å; V328-F376 HydrophobicContact CG2-CB 4.23Å; V328-F376 WeakPolarHBondContact CG2-O 3.46Å; V328-L379 HydrophobicContact CG2-CB 4.31Å; V328-L379 HydrophobicContact CG2-CD1 4.49Å; V328-N380 HydrophobicContact CB-CB 4.26Å; V328-N380 PolarHBondContact O-ND2 3.48Å
329	S	82.2	Confident	79.3	Confident	52 Å²	52	67.7 Å²	67.7	36%	0.364	37%	0.366	S	S	.	.			trans	-58	140.6	-176.6	-75.4	0	0	0	0	112.6	K325 E331 K335	K325-S329 WeakPolarHBondContact O-CB 3.34Å; K325-S329 PolarHBondContact O-N 3.27Å; K325-S329 PolarHBondContact O-OG 3.43Å; S329-E331 PolarHBondContact O-N 2.78Å; S329-K335 PolarHBondContact O-NZ 3.25Å
330	E	62.8	Low	79	Confident	126 Å²	126	68 Å²	68	59%	0.589	37%	0.367	S	S	*	.			trans	-75.4	-4.2	-178.5	-62.9	-169.3	159.7	0	0	114	G332	E330-G332 VanDerWaalsContact C-N 3.29Å; E330-G332 PolarHBondContact O-N 3.2Å
331	E	48.4	Very low	78.7	Confident	182 Å²	182	68 Å²	68	85%	0.85	37%	0.367	S	S	*	.			trans	-70.7	84.6	177.5	-67.1	-174.9	168.9	0	0	110.5	S329	S329-E331 PolarHBondContact O-N 2.78Å
332	G	48	Very low	78.4	Confident	41 Å²	41	66.9 Å²	66.9	42%	0.423	37%	0.366	S	S	.	.	S	Bend	trans	155.5	90.1	175.8	0	0	0	0	0	110.9	E330 G334 K335	E330-G332 VanDerWaalsContact C-N 3.29Å; E330-G332 PolarHBondContact O-N 3.2Å; G332-G334 PolarHBondContact O-N 3.27Å; G332-K335 PolarHBondContact O-N 2.98Å
333	E	41.4	Very low	78.3	Confident	206 Å²	206	61.9 Å²	61.9	96%	0.963	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	112.5	163.1	-73.4	-173	159	0	0	108.5
334	G	54.4	Low	78.3	Confident	76 Å²	76	58.8 Å²	58.8	78%	0.784	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.3	14.6	174.2	0	0	0	0	0	117.8	G332 N336	G332-G334 PolarHBondContact O-N 3.27Å; G334-N336 PolarHBondContact O-N 3.45Å; G334-N336 VanDerWaalsContact O-N 3.13Å
335	K	63.4	Low	78.3	Confident	77 Å²	77	59.2 Å²	59.2	34%	0.335	34%	0.335	S	S	.	.			trans	-58.6	119.8	168.6	-76.7	-174.9	177.8	174.9	0	110.4	A326 L327 S329 G332	A326-K335 PolarHBondContact O-NZ 3.48Å; L327-K335 PolarHBondContact O-NZ 3.49Å; S329-K335 PolarHBondContact O-NZ 3.25Å; G332-K335 PolarHBondContact O-N 2.98Å
336	N	77.9	Confident	78.4	Confident	38 Å²	38	59.4 Å²	59.4	20%	0.203	34%	0.34	C	S	.	.			trans	-64.8	125	176.3	172.9	3.6	0	0	0	109.4	G334 V338 D339 Y340	G334-N336 PolarHBondContact O-N 3.45Å; G334-N336 VanDerWaalsContact O-N 3.13Å; N336-V338 PolarHBondContact O-N 3.01Å; N336-V338 VanDerWaalsContact O-N 3.1Å; N336-V338 WeakPolarHBondContact OD1-CB 3.21Å; N336-V338 PolarHBondContact OD1-N 2.89Å; N336-D339 HydrophobicContact CB-CB 4.22Å; N336-D339 VanDerWaalsContact CB-OD2 3.23Å; N336-D339 WeakPolarHBondContact CB-OD2 3.46Å; N336-D339 VanDerWaalsContact ND2-CG 3.32Å; N336-D339 PolarHBondContact ND2-OD1 3.41Å; N336-D339 PolarHBondContact ND2-OD2 2.93Å; N336-D339 PolarHBondContact O-N 2.8Å; N336-D339 VanDerWaalsContact O-N 3.09Å; N336-Y340 PolarHBondContact O-N 3.09Å
337	P	81.6	Confident	78.6	Confident	11 Å²	11	57.1 Å²	57.1	7%	0.071	32%	0.319	C	S	.	.	H	α-helix	trans	-53.2	-32.9	179	-28.4	35.3	0	0	0	113.8	I341 Y386 L389	P337-I341 WeakPolarHBondContact O-CG1 3.38Å; P337-I341 PolarHBondContact O-N 3.31Å; P337-Y386 HydrophobicContact CB-CD1 3.76Å; P337-Y386 HydrophobicContact CB-CE1 4.37Å; P337-Y386 HydrophobicContact CB-CG 3.91Å; P337-Y386 HydrophobicContact CG-CD1 3.74Å; P337-Y386 HydrophobicContact CG-CE1 3.88Å; P337-Y386 HydrophobicContact CG-CG 4.32Å; P337-L389 HydrophobicContact CB-CB 4.09Å; P337-L389 HydrophobicContact CB-CD1 4.08Å; P337-L389 HydrophobicContact CG-CD1 3.8Å
338	V	82.9	Confident	79	Confident	21 Å²	21	55.6 Å²	55.6	13%	0.127	31%	0.31	C	S	.	.	H	α-helix	trans	-69.1	-46.2	179.8	179.2	0	0	0	0	111.2	N336 Y340 I341 Q342 F390 D393	N336-V338 PolarHBondContact O-N 3.01Å; N336-V338 VanDerWaalsContact O-N 3.1Å; N336-V338 WeakPolarHBondContact OD1-CB 3.21Å; N336-V338 PolarHBondContact OD1-N 2.89Å; V338-Y340 VanDerWaalsContact C-N 3.32Å; V338-Y340 PolarHBondContact O-N 2.82Å; V338-I341 PolarHBondContact O-N 2.78Å; V338-Q342 VanDerWaalsContact O-CB 3.28Å; V338-Q342 WeakPolarHBondContact O-CB 3.42Å; V338-Q342 PolarHBondContact O-N 3.02Å; V338-F390 HydrophobicContact CB-CD2 4.45Å; V338-F390 HydrophobicContact CG1-CD2 4.02Å; V338-F390 HydrophobicContact CG1-CE2 4.21Å; V338-D393 HydrophobicContact CG2-CB 4.26Å
339	D	84.4	Confident	79.3	Confident	99 Å²	99	57.8 Å²	57.8	53%	0.529	33%	0.325	S	S	.	.	H	α-helix	trans	-70.4	-33.9	-178	-57.5	-27.5	0	0	0	110.9	N336 G343	N336-D339 HydrophobicContact CB-CB 4.22Å; N336-D339 VanDerWaalsContact CB-OD2 3.23Å; N336-D339 WeakPolarHBondContact CB-OD2 3.46Å; N336-D339 VanDerWaalsContact ND2-CG 3.32Å; N336-D339 PolarHBondContact ND2-OD1 3.41Å; N336-D339 PolarHBondContact ND2-OD2 2.93Å; N336-D339 PolarHBondContact O-N 2.8Å; N336-D339 VanDerWaalsContact O-N 3.09Å; D339-G343 PolarHBondContact O-N 3.06Å
340	Y	89.5	Confident	80	Confident	12 Å²	12	59 Å²	59	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-57.5	-54.2	172.4	178.2	-83.5	0	0	0	112	V328 N336 V338 G343 L344 S383 Y386	V328-Y340 HydrophobicContact CB-CE2 4.26Å; V328-Y340 WeakPolarHBondContact CB-OH 3.43Å; V328-Y340 HydrophobicContact CG1-CE2 4.31Å; V328-Y340 VanDerWaalsContact CG1-OH 3.28Å; V328-Y340 WeakPolarHBondContact CG1-OH 3.45Å; N336-Y340 PolarHBondContact O-N 3.09Å; V338-Y340 VanDerWaalsContact C-N 3.32Å; V338-Y340 PolarHBondContact O-N 2.82Å; Y340-G343 PolarHBondContact O-N 2.98Å; Y340-L344 HydrophobicContact CD1-CD1 3.92Å; Y340-L344 HydrophobicContact CE1-CD1 3.47Å; Y340-L344 VanDerWaalsContact CE1-CD1 3.47Å; Y340-L344 WeakPolarHBondContact O-CG 3.45Å; Y340-L344 PolarHBondContact O-N 2.93Å; Y340-S383 PolarHBondContact OH-OG 3.28Å; Y340-Y386 AromaticContact CD1-CD2 3.8Å; Y340-Y386 HydrophobicContact CD1-CD2 3.8Å; Y340-Y386 HydrophobicContact CD2-CD2 4Å; Y340-Y386 HydrophobicContact CD2-CE2 4.24Å; Y340-Y386 HydrophobicContact CE1-CD2 4.12Å; Y340-Y386 HydrophobicContact CE2-CD2 4.26Å; Y340-Y386 AromaticContact CG-CD2 3.75Å; Y340-Y386 HydrophobicContact CG-CD2 3.75Å; Y340-Y386 HydrophobicContact CG-CE2 4.37Å
341	I	92.4	Very high	81.6	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-69.2	-39.1	-178.9	-63.5	-65.4	0	0	0	110.5	P337 V338 G343 L344 L345 L387 F390 L417	P337-I341 WeakPolarHBondContact O-CG1 3.38Å; P337-I341 PolarHBondContact O-N 3.31Å; V338-I341 PolarHBondContact O-N 2.78Å; I341-G343 PolarHBondContact O-N 3.26Å; I341-L344 HydrophobicContact CD1-CD1 4.44Å; I341-L344 WeakPolarHBondContact O-CB 3.17Å; I341-L344 PolarHBondContact O-N 3.17Å; I341-L345 HydrophobicContact CG2-CD1 4.23Å; I341-L345 HydrophobicContact CG2-CG 4.33Å; I341-L345 WeakPolarHBondContact O-CG 3.35Å; I341-L345 PolarHBondContact O-N 2.82Å; I341-L387 HydrophobicContact CD1-CB 3.93Å; I341-L387 HydrophobicContact CD1-CD1 4.13Å; I341-L387 HydrophobicContact CG2-CD1 4.1Å; I341-F390 HydrophobicContact CB-CB 3.98Å; I341-F390 HydrophobicContact CB-CD2 3.79Å; I341-F390 HydrophobicContact CB-CE2 4.39Å; I341-F390 HydrophobicContact CB-CG 3.85Å; I341-F390 HydrophobicContact CG1-CB 3.93Å; I341-F390 HydrophobicContact CG1-CG 4.35Å; I341-F390 HydrophobicContact CG2-CB 4.03Å; I341-F390 HydrophobicContact CG2-CD1 3.73Å; I341-F390 HydrophobicContact CG2-CD2 3.79Å; I341-F390 HydrophobicContact CG2-CE1 4.08Å; I341-F390 HydrophobicContact CG2-CE2 4.13Å; I341-F390 HydrophobicContact CG2-CG 3.58Å; I341-F390 HydrophobicContact CG2-CZ 4.27Å; I341-L417 HydrophobicContact CG2-CD1 4.06Å
342	Q	90.8	Very high	83.9	Confident	67 Å²	67	47.1 Å²	47.1	31%	0.313	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-45.1	176.9	-170.3	60.9	52.9	0	0	111.7	V338 L344 L345 D346	V338-Q342 VanDerWaalsContact O-CB 3.28Å; V338-Q342 WeakPolarHBondContact O-CB 3.42Å; V338-Q342 PolarHBondContact O-N 3.02Å; Q342-L344 VanDerWaalsContact C-N 3.27Å; Q342-L344 PolarHBondContact O-N 2.84Å; Q342-L345 WeakPolarHBondContact O-CB 3.25Å; Q342-L345 PolarHBondContact O-N 2.94Å; Q342-L345 VanDerWaalsContact O-N 3.1Å; Q342-D346 PolarHBondContact NE2-OD1 3.5Å; Q342-D346 PolarHBondContact O-N 3.07Å
343	G	92.8	Very high	86.2	Confident	18 Å²	18	49.8 Å²	49.8	19%	0.186	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-36.5	176.3	0	0	0	0	0	113.2	D339 Y340 I341 L347	D339-G343 PolarHBondContact O-N 3.06Å; Y340-G343 PolarHBondContact O-N 2.98Å; I341-G343 PolarHBondContact O-N 3.26Å; G343-L347 WeakPolarHBondContact O-CB 3.23Å; G343-L347 PolarHBondContact O-N 3.2Å
344	L	94.9	Very high	88.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.5	-40.1	174	-69.5	171.2	0	0	0	112.5	L327 V328 Y340 I341 Q342 K348 F376 L377 L417	L327-L344 HydrophobicContact CB-CD2 4.35Å; L327-L344 HydrophobicContact CD1-CD2 4.13Å; V328-L344 HydrophobicContact CG1-CD2 4.13Å; Y340-L344 HydrophobicContact CD1-CD1 3.92Å; Y340-L344 HydrophobicContact CE1-CD1 3.47Å; Y340-L344 VanDerWaalsContact CE1-CD1 3.47Å; Y340-L344 WeakPolarHBondContact O-CG 3.45Å; Y340-L344 PolarHBondContact O-N 2.93Å; I341-L344 HydrophobicContact CD1-CD1 4.44Å; I341-L344 WeakPolarHBondContact O-CB 3.17Å; I341-L344 PolarHBondContact O-N 3.17Å; Q342-L344 VanDerWaalsContact C-N 3.27Å; Q342-L344 PolarHBondContact O-N 2.84Å; L344-K348 WeakPolarHBondContact O-CB 2.84Å; L344-K348 PolarHBondContact O-N 3.46Å; L344-F376 HydrophobicContact CD2-CD2 4.2Å; L344-F376 HydrophobicContact CD2-CE2 3.69Å; L344-L377 HydrophobicContact CD1-CD1 3.8Å; L344-L417 HydrophobicContact CB-CD1 3.92Å; L344-L417 HydrophobicContact CB-CD2 4.37Å
345	L	94.6	Very high	90.9	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-40.1	175.5	-68.8	-179.7	0	0	0	112	I341 Q342 K348 S349 F390 K413 L417	I341-L345 HydrophobicContact CG2-CD1 4.23Å; I341-L345 HydrophobicContact CG2-CG 4.33Å; I341-L345 WeakPolarHBondContact O-CG 3.35Å; I341-L345 PolarHBondContact O-N 2.82Å; Q342-L345 WeakPolarHBondContact O-CB 3.25Å; Q342-L345 PolarHBondContact O-N 2.94Å; Q342-L345 VanDerWaalsContact O-N 3.1Å; L345-K348 PolarHBondContact O-N 3.34Å; L345-S349 WeakPolarHBondContact O-CB 3.47Å; L345-S349 PolarHBondContact O-N 3.47Å; L345-S349 PolarHBondContact O-OG 3.28Å; L345-F390 HydrophobicContact CD1-CE1 4.07Å; L345-F390 HydrophobicContact CD1-CZ 3.81Å; L345-K413 HydrophobicContact CD2-CB 3.94Å; L345-K413 WeakPolarHBondContact CD2-O 3.48Å; L345-L417 HydrophobicContact CD2-CD1 3.46Å; L345-L417 VanDerWaalsContact CD2-CD1 3.46Å; L345-L417 HydrophobicContact CD2-CG 3.75Å; L345-L417 HydrophobicContact CG-CD1 3.87Å
346	D	94.8	Very high	92.4	Very high	87 Å²	87	39.5 Å²	39.5	47%	0.465	20%	0.199	S	C	.	.	H	α-helix	trans	-68.5	-43.4	178.4	-64.5	-17.9	0	0	0	110.7	Q342 K348 S349 R350	Q342-D346 PolarHBondContact NE2-OD1 3.5Å; Q342-D346 PolarHBondContact O-N 3.07Å; D346-K348 VanDerWaalsContact C-N 3.31Å; D346-K348 PolarHBondContact O-N 2.74Å; D346-S349 PolarHBondContact O-N 3.38Å; D346-R350 WeakPolarHBondContact O-CB 3.48Å; D346-R350 PolarHBondContact O-N 2.86Å
347	L	96.3	Very high	93.3	Very high	15 Å²	15	42.6 Å²	42.6	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-43.1	173.3	-175.1	63	0	0	0	111.1	L320 Q323 L327 G343 R350 F351 F373 F376	L320-L347 HydrophobicContact CD1-CD1 4.35Å; L320-L347 HydrophobicContact CD1-CD2 3.99Å; L320-L347 HydrophobicContact CD1-CG 4.14Å; Q323-L347 HydrophobicContact CB-CD1 4.43Å; Q323-L347 HydrophobicContact CB-CD2 4.36Å; L327-L347 HydrophobicContact CD1-CB 4.17Å; L327-L347 HydrophobicContact CD1-CD2 3.71Å; G343-L347 WeakPolarHBondContact O-CB 3.23Å; G343-L347 PolarHBondContact O-N 3.2Å; L347-R350 PolarHBondContact O-N 3.43Å; L347-F351 HydrophobicContact CD1-CD2 3.88Å; L347-F351 HydrophobicContact CD1-CE2 3.68Å; L347-F351 HydrophobicContact CG-CD2 4.37Å; L347-F351 WeakPolarHBondContact O-CD2 3.33Å; L347-F351 PolarHBondContact O-N 3.01Å; L347-F351 VanDerWaalsContact O-N 3.12Å; L347-F373 HydrophobicContact CB-CZ 4.28Å; L347-F373 HydrophobicContact CD2-CZ 4.27Å; L347-F373 HydrophobicContact CG-CZ 3.99Å; L347-F376 HydrophobicContact CD2-CZ 4.35Å
348	K	96.3	Very high	94	Very high	26 Å²	26	42.2 Å²	42.2	11%	0.113	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-47.5	178	-177.1	57.7	167.7	66.4	0	111.5	L344 L345 D346 R350 F351 D352 F373	L344-K348 WeakPolarHBondContact O-CB 2.84Å; L344-K348 PolarHBondContact O-N 3.46Å; L345-K348 PolarHBondContact O-N 3.34Å; D346-K348 VanDerWaalsContact C-N 3.31Å; D346-K348 PolarHBondContact O-N 2.74Å; K348-R350 VanDerWaalsContact C-N 3.27Å; K348-R350 PolarHBondContact O-N 3.27Å; K348-F351 PolarHBondContact O-N 3.08Å; K348-D352 IonicContact NZ-OD1 3.26Å; K348-D352 PolarHBondContact NZ-OD1 3.32Å; K348-D352 IonicContact NZ-OD2 3.95Å; K348-D352 PolarHBondContact NZ-OD2 3.44Å; K348-D352 WeakPolarHBondContact O-CB 3.48Å; K348-D352 VanDerWaalsContact O-CG 3.3Å; K348-D352 PolarHBondContact O-N 3.04Å; K348-F373 HydrophobicContact CB-CE1 3.67Å; K348-F373 HydrophobicContact CB-CE2 4.38Å; K348-F373 HydrophobicContact CB-CZ 3.59Å; K348-F373 HydrophobicContact CD-CD1 4.34Å; K348-F373 HydrophobicContact CD-CD2 4Å; K348-F373 HydrophobicContact CD-CE1 4.09Å; K348-F373 HydrophobicContact CD-CE2 3.72Å; K348-F373 HydrophobicContact CD-CG 4.32Å; K348-F373 HydrophobicContact CD-CZ 3.79Å; K348-F373 HydrophobicContact CG-CE1 4.36Å; K348-F373 HydrophobicContact CG-CZ 4.28Å
349	S	95.8	Very high	94.6	Very high	49 Å²	49	41.2 Å²	41.2	34%	0.343	20%	0.204	S	C	.	.	H	α-helix	trans	-59.6	-39.7	178.5	-55.8	0	0	0	0	111.3	L345 D346 R353	L345-S349 WeakPolarHBondContact O-CB 3.47Å; L345-S349 PolarHBondContact O-N 3.47Å; L345-S349 PolarHBondContact O-OG 3.28Å; D346-S349 PolarHBondContact O-N 3.38Å; S349-R353 WeakPolarHBondContact O-CB 3.45Å; S349-R353 PolarHBondContact O-N 2.74Å
350	R	96.2	Very high	95.1	Very high	79 Å²	79	42.4 Å²	42.4	30%	0.298	21%	0.21	S	C	.	.	H	α-helix	trans	-63.1	-46.2	176.7	-176.9	-177.5	-178.4	160.3	9.4	112.7	L287 K288 D346 L347 K348 R353 F354	L287-R350 PolarHBondContact O-NH2 3.39Å; K288-R350 PolarHBondContact O-NH2 2.95Å; D346-R350 WeakPolarHBondContact O-CB 3.48Å; D346-R350 PolarHBondContact O-N 2.86Å; L347-R350 PolarHBondContact O-N 3.43Å; K348-R350 VanDerWaalsContact C-N 3.27Å; K348-R350 PolarHBondContact O-N 3.27Å; R350-R353 WeakPolarHBondContact O-CB 3.43Å; R350-R353 PolarHBondContact O-N 3.11Å; R350-F354 HydrophobicContact CG-CD2 4.41Å; R350-F354 HydrophobicContact CG-CE2 3.7Å; R350-F354 HydrophobicContact CG-CZ 3.86Å; R350-F354 WeakPolarHBondContact O-CD2 3.44Å; R350-F354 WeakPolarHBondContact O-CG 3.33Å; R350-F354 PolarHBondContact O-N 3.47Å; R350-F354 VanDerWaalsContact O-N 3.15Å
351	F	97.3	Very high	95.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-74.3	-31.1	179.7	-87.3	-98.8	0	0	0	113	M316 Y319 L320 L347 K348 R353 F354 L355 I369	M316-F351 HydrophobicContact CG-CD1 4.43Å; M316-F351 HydrophobicContact CG-CE1 3.74Å; M316-F351 HydrophobicContact SD-CD1 4.19Å; M316-F351 HydrophobicContact SD-CE1 4.09Å; Y319-F351 AromaticContact CD1-CZ 4Å; Y319-F351 HydrophobicContact CD1-CZ 4Å; Y319-F351 HydrophobicContact CE1-CE2 4.5Å; Y319-F351 HydrophobicContact CE1-CZ 4Å; L320-F351 HydrophobicContact CB-CE1 3.9Å; L320-F351 HydrophobicContact CB-CZ 3.83Å; L320-F351 HydrophobicContact CD1-CD1 4.3Å; L320-F351 HydrophobicContact CD1-CD2 3.83Å; L320-F351 HydrophobicContact CD1-CE1 4.09Å; L320-F351 HydrophobicContact CD1-CE2 3.61Å; L320-F351 HydrophobicContact CD1-CG 4.17Å; L320-F351 HydrophobicContact CD1-CZ 3.73Å; L320-F351 HydrophobicContact CD2-CD1 4.05Å; L320-F351 HydrophobicContact CD2-CE1 4.08Å; L320-F351 HydrophobicContact CD2-CG 4.45Å; L320-F351 HydrophobicContact CG-CE1 4.23Å; L320-F351 HydrophobicContact CG-CZ 4.22Å; L347-F351 HydrophobicContact CD1-CD2 3.88Å; L347-F351 HydrophobicContact CD1-CE2 3.68Å; L347-F351 HydrophobicContact CG-CD2 4.37Å; L347-F351 WeakPolarHBondContact O-CD2 3.33Å; L347-F351 PolarHBondContact O-N 3.01Å; L347-F351 VanDerWaalsContact O-N 3.12Å; K348-F351 PolarHBondContact O-N 3.08Å; F351-R353 VanDerWaalsContact C-N 3.3Å; F351-F354 HydrophobicContact CD1-CD2 4.43Å; F351-F354 HydrophobicContact CG-CD2 4.41Å; F351-F354 PolarHBondContact O-N 3.39Å; F351-L355 WeakPolarHBondContact O-CB 3.47Å; F351-L355 PolarHBondContact O-N 3.21Å; F351-I369 HydrophobicContact CB-CD1 4.32Å; F351-I369 HydrophobicContact CB-CG2 4.26Å; F351-I369 HydrophobicContact CD1-CD1 4.29Å; F351-I369 HydrophobicContact CD1-CG1 4.23Å
352	D	95.6	Very high	95.7	Very high	58 Å²	58	48.2 Å²	48.2	31%	0.31	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-39.9	170	-73.6	-21.2	0	0	0	111.3	K348 L355 Q356	K348-D352 IonicContact NZ-OD1 3.26Å; K348-D352 PolarHBondContact NZ-OD1 3.32Å; K348-D352 IonicContact NZ-OD2 3.95Å; K348-D352 PolarHBondContact NZ-OD2 3.44Å; K348-D352 WeakPolarHBondContact O-CB 3.48Å; K348-D352 VanDerWaalsContact O-CG 3.3Å; K348-D352 PolarHBondContact O-N 3.04Å; D352-L355 WeakPolarHBondContact O-CB 3.47Å; D352-L355 PolarHBondContact O-N 2.77Å; D352-Q356 WeakPolarHBondContact O-CB 3.43Å; D352-Q356 PolarHBondContact O-N 3.44Å
353	R	96.5	Very high	95.9	Very high	96 Å²	96	53.9 Å²	53.9	36%	0.362	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-46.1	174.4	-170.8	173.2	69.4	95.2	-6	111.8	S349 R350 F351 L355 Q356 E357	S349-R353 WeakPolarHBondContact O-CB 3.45Å; S349-R353 PolarHBondContact O-N 2.74Å; R350-R353 WeakPolarHBondContact O-CB 3.43Å; R350-R353 PolarHBondContact O-N 3.11Å; F351-R353 VanDerWaalsContact C-N 3.3Å; R353-L355 VanDerWaalsContact C-N 3.31Å; R353-L355 PolarHBondContact O-N 2.91Å; R353-Q356 PolarHBondContact O-N 2.98Å; R353-E357 WeakPolarHBondContact CD-OE1 3.46Å; R353-E357 HydrophobicContact CG-CG 4.07Å; R353-E357 VanDerWaalsContact CG-OE1 3.25Å; R353-E357 WeakPolarHBondContact CG-OE1 3.3Å; R353-E357 VanDerWaalsContact CG-OE2 3.26Å; R353-E357 WeakPolarHBondContact CG-OE2 3.5Å; R353-E357 IonicContact CZ-OE2 2.86Å; R353-E357 IonicContact NH1-OE2 3.98Å; R353-E357 PolarHBondContact NH1-OE2 3.47Å; R353-E357 WeakPolarHBondContact O-CB 3.46Å; R353-E357 PolarHBondContact O-N 2.81Å
354	F	97.3	Very high	96.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-40.3	174.8	-61.8	-34.3	0	0	0	112.6	L287 T292 L295 R350 F351 Q356 S358 F359	L287-F354 HydrophobicContact CB-CE2 4.42Å; L287-F354 HydrophobicContact CD2-CD2 3.49Å; L287-F354 VanDerWaalsContact CD2-CD2 3.49Å; L287-F354 HydrophobicContact CD2-CE2 3.62Å; L287-F354 HydrophobicContact CD2-CG 4.15Å; L287-F354 HydrophobicContact CD2-CZ 4.38Å; L287-F354 WeakPolarHBondContact O-CZ 3.45Å; T292-F354 HydrophobicContact CG2-CD1 4Å; T292-F354 HydrophobicContact CG2-CE1 4.13Å; L295-F354 HydrophobicContact CD1-CD1 3.95Å; L295-F354 HydrophobicContact CD1-CE1 4.17Å; L295-F354 HydrophobicContact CD1-CG 4.32Å; R350-F354 HydrophobicContact CG-CD2 4.41Å; R350-F354 HydrophobicContact CG-CE2 3.7Å; R350-F354 HydrophobicContact CG-CZ 3.86Å; R350-F354 WeakPolarHBondContact O-CD2 3.44Å; R350-F354 WeakPolarHBondContact O-CG 3.33Å; R350-F354 PolarHBondContact O-N 3.47Å; R350-F354 VanDerWaalsContact O-N 3.15Å; F351-F354 HydrophobicContact CD1-CD2 4.43Å; F351-F354 HydrophobicContact CG-CD2 4.41Å; F351-F354 PolarHBondContact O-N 3.39Å; F354-Q356 VanDerWaalsContact C-N 3.33Å; F354-Q356 PolarHBondContact O-N 3.33Å; F354-S358 WeakPolarHBondContact O-CA 3.43Å; F354-S358 WeakPolarHBondContact O-CB 3.28Å; F354-S358 PolarHBondContact O-N 2.76Å; F354-F359 HydrophobicContact CB-CD2 4.4Å; F354-F359 HydrophobicContact CB-CE2 3.93Å; F354-F359 HydrophobicContact CB-CZ 4.46Å; F354-F359 PolarHBondContact O-N 2.72Å; F354-F359 VanDerWaalsContact O-N 3.07Å
355	L	96.8	Very high	96.3	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-43.1	176.7	179.9	63.6	0	0	0	111.9	F351 D352 R353 F359 N360 N361 F365 K366 I369	F351-L355 WeakPolarHBondContact O-CB 3.47Å; F351-L355 PolarHBondContact O-N 3.21Å; D352-L355 WeakPolarHBondContact O-CB 3.47Å; D352-L355 PolarHBondContact O-N 2.77Å; R353-L355 VanDerWaalsContact C-N 3.31Å; R353-L355 PolarHBondContact O-N 2.91Å; L355-F359 HydrophobicContact CD1-CB 4.31Å; L355-F359 CarbonylContact O-C 3.57Å; L355-N360 PolarHBondContact O-N 3.35Å; L355-N361 PolarHBondContact O-N 3.04Å; L355-F365 HydrophobicContact CD1-CB 3.74Å; L355-K366 HydrophobicContact CD1-CB 4.33Å; L355-K366 HydrophobicContact CD2-CB 3.81Å; L355-K366 HydrophobicContact CD2-CD 4.43Å; L355-K366 HydrophobicContact CD2-CG 3.92Å; L355-I369 HydrophobicContact CB-CD1 4.32Å
356	Q	96.3	Very high	96.4	Very high	134 Å²	134	62.1 Å²	62.1	63%	0.626	29%	0.294	S	S	*	.	H	α-helix	trans	-75.8	-48.5	-178.7	-175.7	177.1	0.3	0	0	112.8	D352 R353 F354	D352-Q356 WeakPolarHBondContact O-CB 3.43Å; D352-Q356 PolarHBondContact O-N 3.44Å; R353-Q356 PolarHBondContact O-N 2.98Å; F354-Q356 VanDerWaalsContact C-N 3.33Å; F354-Q356 PolarHBondContact O-N 3.33Å
357	E	95.7	Very high	96.5	Very high	103 Å²	103	63.3 Å²	63.3	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-84	-33.5	-171.4	-66	176.2	-178.2	0	0	112.7	T292 R353	T292-E357 HydrophobicContact CG2-CB 4.44Å; T292-E357 WeakPolarHBondContact CG2-OE2 3.31Å; R353-E357 WeakPolarHBondContact CD-OE1 3.46Å; R353-E357 HydrophobicContact CG-CG 4.07Å; R353-E357 VanDerWaalsContact CG-OE1 3.25Å; R353-E357 WeakPolarHBondContact CG-OE1 3.3Å; R353-E357 VanDerWaalsContact CG-OE2 3.26Å; R353-E357 WeakPolarHBondContact CG-OE2 3.5Å; R353-E357 IonicContact CZ-OE2 2.86Å; R353-E357 IonicContact NH1-OE2 3.98Å; R353-E357 PolarHBondContact NH1-OE2 3.47Å; R353-E357 WeakPolarHBondContact O-CB 3.46Å; R353-E357 PolarHBondContact O-N 2.81Å
358	S	96.7	Very high	96.6	Very high	4 Å²	4	64 Å²	64	3%	0.028	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-34.3	-170.7	-56	0	0	0	0	114.4	T292 A296 F354	T292-S358 VanDerWaalsContact CA-OG 3.3Å; T292-S358 WeakPolarHBondContact CA-OG 3.23Å; T292-S358 PolarHBondContact O-OG 3.03Å; A296-S358 WeakPolarHBondContact CA-O 3.37Å; F354-S358 WeakPolarHBondContact O-CA 3.43Å; F354-S358 WeakPolarHBondContact O-CB 3.28Å; F354-S358 PolarHBondContact O-N 2.76Å
359	F	96.6	Very high	96.6	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-105.3	14.5	-173.2	-50	-36.5	0	0	0	113.9	L287 L295 Y299 M312 M316 F354 L355 N361 D362 F365	L287-F359 HydrophobicContact CD2-CZ 4.4Å; L295-F359 HydrophobicContact CB-CE1 4.13Å; L295-F359 HydrophobicContact CD2-CE1 4.3Å; L295-F359 HydrophobicContact CD2-CZ 4.27Å; Y299-F359 HydrophobicContact CD2-CB 4.19Å; Y299-F359 HydrophobicContact CD2-CD1 4.13Å; Y299-F359 HydrophobicContact CE2-CB 4.38Å; Y299-F359 HydrophobicContact CG-CD1 4.38Å; M312-F359 HydrophobicContact CE-CD1 3.53Å; M312-F359 HydrophobicContact CE-CE1 3.32Å; M312-F359 HydrophobicContact CE-CG 4.45Å; M312-F359 HydrophobicContact CE-CZ 4.11Å; M316-F359 HydrophobicContact SD-CE2 3.85Å; F354-F359 HydrophobicContact CB-CD2 4.4Å; F354-F359 HydrophobicContact CB-CE2 3.93Å; F354-F359 HydrophobicContact CB-CZ 4.46Å; F354-F359 PolarHBondContact O-N 2.72Å; F354-F359 VanDerWaalsContact O-N 3.07Å; L355-F359 HydrophobicContact CD1-CB 4.31Å; L355-F359 CarbonylContact O-C 3.57Å; F359-N361 PolarHBondContact O-N 3.31Å; F359-N361 VanDerWaalsContact O-N 3.09Å; F359-D362 VanDerWaalsContact O-CB 3.23Å; F359-D362 WeakPolarHBondContact O-CB 3.39Å; F359-D362 PolarHBondContact O-N 3.02Å; F359-F365 HydrophobicContact CB-CD1 4.47Å; F359-F365 HydrophobicContact CB-CG 4.27Å; F359-F365 HydrophobicContact CD1-CE1 4.48Å; F359-F365 HydrophobicContact CD2-CB 4.39Å; F359-F365 AromaticContact CD2-CD1 3.54Å; F359-F365 HydrophobicContact CD2-CD1 3.54Å; F359-F365 HydrophobicContact CD2-CE1 4.11Å; F359-F365 HydrophobicContact CD2-CG 4.07Å; F359-F365 HydrophobicContact CE1-CE1 4.49Å; F359-F365 AromaticContact CE2-CD1 3.81Å; F359-F365 HydrophobicContact CE2-CD1 3.81Å; F359-F365 HydrophobicContact CE2-CE1 4.11Å; F359-F365 AromaticContact CG-CD1 3.97Å; F359-F365 HydrophobicContact CG-CD1 3.97Å; F359-F365 HydrophobicContact CG-CE1 4.31Å; F359-F365 HydrophobicContact CG-CG 4.26Å; F359-F365 HydrophobicContact CZ-CD1 4.45Å; F359-F365 HydrophobicContact CZ-CE1 4.3Å
360	N	94.9	Very high	96.6	Very high	124 Å²	124	62.2 Å²	62.2	66%	0.663	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	35.4	175.7	-165.6	37.2	0	0	0	114.3	Y299 L355 D362	Y299-N360 HydrophobicContact CE1-CB 3.97Å; L355-N360 PolarHBondContact O-N 3.35Å; N360-D362 PolarHBondContact O-N 3.11Å
361	N	96	Very high	96.7	Very high	98 Å²	98	59.9 Å²	59.9	52%	0.524	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	32.1	-174.5	-67.7	-60.7	0	0	0	114.7	L355 F359 R363	L355-N361 PolarHBondContact O-N 3.04Å; F359-N361 PolarHBondContact O-N 3.31Å; F359-N361 VanDerWaalsContact O-N 3.09Å; N361-R363 PolarHBondContact O-N 2.86Å
362	D	97.1	Very high	96.7	Very high	36 Å²	36	60 Å²	60	19%	0.193	30%	0.295	C	S	.	.			trans	-56.3	136.4	-178.3	-178	-85.9	0	0	0	112.7	Y299 F359 N360 L364 F365 K366	Y299-D362 HydrophobicContact CE2-CB 4.02Å; F359-D362 VanDerWaalsContact O-CB 3.23Å; F359-D362 WeakPolarHBondContact O-CB 3.39Å; F359-D362 PolarHBondContact O-N 3.02Å; N360-D362 PolarHBondContact O-N 3.11Å; D362-L364 PolarHBondContact O-N 2.68Å; D362-L364 WeakPolarHBondContact OD1-CA 3.41Å; D362-L364 WeakPolarHBondContact OD1-CB 3.24Å; D362-L364 PolarHBondContact OD1-N 3.21Å; D362-F365 HydrophobicContact CB-CB 4.48Å; D362-F365 HydrophobicContact CB-CD2 3.93Å; D362-F365 PolarHBondContact O-N 3.12Å; D362-F365 WeakPolarHBondContact OD1-CD2 3.29Å; D362-F365 PolarHBondContact OD1-N 3.13Å; D362-K366 WeakPolarHBondContact O-CB 3.41Å; D362-K366 PolarHBondContact O-N 2.98Å
363	R	96.4	Very high	96.8	Very high	186 Å²	186	57.3 Å²	57.3	70%	0.702	28%	0.281	S	S	*	.	H	α-helix	trans	-66.1	-37.9	-173.8	-167.1	-179.9	82.1	172.2	2.2	112.4	N361 K366 Q367	N361-R363 PolarHBondContact O-N 2.86Å; R363-K366 PolarHBondContact O-N 2.85Å; R363-Q367 HydrophobicContact CG-CG 4.42Å; R363-Q367 WeakPolarHBondContact O-CB 3.34Å; R363-Q367 VanDerWaalsContact O-CG 3.29Å; R363-Q367 WeakPolarHBondContact O-CG 3.1Å; R363-Q367 PolarHBondContact O-N 3.43Å
364	L	96.6	Very high	96.8	Very high	68 Å²	68	55.9 Å²	55.9	36%	0.356	28%	0.278	S	S	.	.	H	α-helix	trans	-65.2	-44.9	179.9	177.8	64.9	0	0	0	110.2	C313 D362 Q367 T368	C313-L364 HydrophobicContact CB-CD2 4.23Å; C313-L364 HydrophobicContact CB-CG 4.37Å; D362-L364 PolarHBondContact O-N 2.68Å; D362-L364 WeakPolarHBondContact OD1-CA 3.41Å; D362-L364 WeakPolarHBondContact OD1-CB 3.24Å; D362-L364 PolarHBondContact OD1-N 3.21Å; L364-Q367 PolarHBondContact O-N 3.5Å; L364-T368 WeakPolarHBondContact O-CB 3.45Å; L364-T368 PolarHBondContact O-N 3.42Å; L364-T368 PolarHBondContact O-OG1 2.82Å
365	F	97.6	Very high	96.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-46.6	176	-76.6	-96.6	0	0	0	111.6	Y299 L309 M312 C313 M316 L355 F359 D362 Q367 T368 I369	Y299-F365 HydrophobicContact CD2-CE2 4.41Å; Y299-F365 HydrophobicContact CE2-CE2 4.34Å; L309-F365 HydrophobicContact CB-CE2 4.29Å; L309-F365 HydrophobicContact CD2-CE2 4.42Å; M312-F365 HydrophobicContact CB-CZ 4.12Å; M312-F365 HydrophobicContact CE-CE1 3.56Å; M312-F365 HydrophobicContact CE-CE2 4.12Å; M312-F365 HydrophobicContact CE-CZ 3.24Å; M312-F365 HydrophobicContact CG-CE1 4.42Å; M312-F365 HydrophobicContact CG-CZ 4.15Å; M312-F365 HydrophobicContact SD-CZ 4.45Å; C313-F365 HydrophobicContact CB-CE1 4.22Å; C313-F365 HydrophobicContact CB-CE2 4.37Å; C313-F365 HydrophobicContact CB-CZ 4.01Å; M316-F365 HydrophobicContact CE-CD1 3.56Å; M316-F365 HydrophobicContact CE-CE1 4.12Å; M316-F365 HydrophobicContact CE-CG 4.43Å; M316-F365 HydrophobicContact SD-CD1 3.63Å; M316-F365 HydrophobicContact SD-CE1 4.02Å; L355-F365 HydrophobicContact CD1-CB 3.74Å; F359-F365 HydrophobicContact CB-CD1 4.47Å; F359-F365 HydrophobicContact CB-CG 4.27Å; F359-F365 HydrophobicContact CD1-CE1 4.48Å; F359-F365 HydrophobicContact CD2-CB 4.39Å; F359-F365 AromaticContact CD2-CD1 3.54Å; F359-F365 HydrophobicContact CD2-CD1 3.54Å; F359-F365 HydrophobicContact CD2-CE1 4.11Å; F359-F365 HydrophobicContact CD2-CG 4.07Å; F359-F365 HydrophobicContact CE1-CE1 4.49Å; F359-F365 AromaticContact CE2-CD1 3.81Å; F359-F365 HydrophobicContact CE2-CD1 3.81Å; F359-F365 HydrophobicContact CE2-CE1 4.11Å; F359-F365 AromaticContact CG-CD1 3.97Å; F359-F365 HydrophobicContact CG-CD1 3.97Å; F359-F365 HydrophobicContact CG-CE1 4.31Å; F359-F365 HydrophobicContact CG-CG 4.26Å; F359-F365 HydrophobicContact CZ-CD1 4.45Å; F359-F365 HydrophobicContact CZ-CE1 4.3Å; D362-F365 HydrophobicContact CB-CB 4.48Å; D362-F365 HydrophobicContact CB-CD2 3.93Å; D362-F365 PolarHBondContact O-N 3.12Å; D362-F365 WeakPolarHBondContact OD1-CD2 3.29Å; D362-F365 PolarHBondContact OD1-N 3.13Å; F365-Q367 PolarHBondContact O-N 2.88Å; F365-T368 PolarHBondContact O-N 3.41Å; F365-I369 WeakPolarHBondContact O-CB 3.47Å; F365-I369 VanDerWaalsContact O-CG1 3.25Å; F365-I369 WeakPolarHBondContact O-CG1 3.28Å; F365-I369 PolarHBondContact O-N 3.15Å
366	K	96.9	Very high	96.6	Very high	132 Å²	132	59.7 Å²	59.7	57%	0.574	29%	0.293	S	S	*	.	H	α-helix	trans	-58.1	-45.7	177.9	-172.3	175	-176.7	173.9	0	112.7	L355 D362 R363 A370	L355-K366 HydrophobicContact CD1-CB 4.33Å; L355-K366 HydrophobicContact CD2-CB 3.81Å; L355-K366 HydrophobicContact CD2-CD 4.43Å; L355-K366 HydrophobicContact CD2-CG 3.92Å; D362-K366 WeakPolarHBondContact O-CB 3.41Å; D362-K366 PolarHBondContact O-N 2.98Å; R363-K366 PolarHBondContact O-N 2.85Å; K366-A370 WeakPolarHBondContact O-CB 3.48Å; K366-A370 PolarHBondContact O-N 3.18Å; K366-A370 VanDerWaalsContact O-N 3.08Å
367	Q	97.2	Very high	96.5	Very high	112 Å²	112	53.4 Å²	53.4	52%	0.523	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-41	178.6	-74.8	176.9	-12.5	0	0	111.9	R363 L364 F365 A370 G371	R363-Q367 HydrophobicContact CG-CG 4.42Å; R363-Q367 WeakPolarHBondContact O-CB 3.34Å; R363-Q367 VanDerWaalsContact O-CG 3.29Å; R363-Q367 WeakPolarHBondContact O-CG 3.1Å; R363-Q367 PolarHBondContact O-N 3.43Å; L364-Q367 PolarHBondContact O-N 3.5Å; F365-Q367 PolarHBondContact O-N 2.88Å; Q367-A370 PolarHBondContact O-N 3.42Å; Q367-G371 PolarHBondContact O-N 2.73Å
368	T	97.8	Very high	96.4	Very high	30 Å²	30	50.8 Å²	50.8	18%	0.184	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-46.2	179.4	-58.1	0	0	0	0	111.4	C313 M316 L364 F365 A370 G371 D372	C313-T368 WeakPolarHBondContact SG-CB 3.32Å; C313-T368 PolarHBondContact SG-OG1 3.46Å; M316-T368 HydrophobicContact CE-CG2 4.28Å; L364-T368 WeakPolarHBondContact O-CB 3.45Å; L364-T368 PolarHBondContact O-N 3.42Å; L364-T368 PolarHBondContact O-OG1 2.82Å; F365-T368 PolarHBondContact O-N 3.41Å; T368-A370 PolarHBondContact O-N 2.98Å; T368-G371 PolarHBondContact O-N 3.47Å; T368-D372 WeakPolarHBondContact O-CB 3.31Å; T368-D372 PolarHBondContact O-N 3.08Å
369	I	97.6	Very high	96.2	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-49.5	174.6	-66.9	163.6	0	0	0	110	M316 L320 F351 L355 F365 G371 D372 F373	M316-I369 HydrophobicContact CE-CD1 4.26Å; M316-I369 HydrophobicContact CE-CG1 3.75Å; M316-I369 HydrophobicContact SD-CD1 4.33Å; M316-I369 HydrophobicContact SD-CG1 4.26Å; L320-I369 HydrophobicContact CD2-CB 4.32Å; L320-I369 HydrophobicContact CD2-CG1 4.19Å; L320-I369 HydrophobicContact CD2-CG2 4.19Å; F351-I369 HydrophobicContact CB-CD1 4.32Å; F351-I369 HydrophobicContact CB-CG2 4.26Å; F351-I369 HydrophobicContact CD1-CD1 4.29Å; F351-I369 HydrophobicContact CD1-CG1 4.23Å; L355-I369 HydrophobicContact CB-CD1 4.32Å; F365-I369 WeakPolarHBondContact O-CB 3.47Å; F365-I369 VanDerWaalsContact O-CG1 3.25Å; F365-I369 WeakPolarHBondContact O-CG1 3.28Å; F365-I369 PolarHBondContact O-N 3.15Å; I369-G371 PolarHBondContact O-N 3.16Å; I369-D372 PolarHBondContact O-N 2.99Å; I369-F373 HydrophobicContact CG2-CD2 3.87Å; I369-F373 HydrophobicContact CG2-CE2 3.97Å; I369-F373 WeakPolarHBondContact O-CD2 3.35Å; I369-F373 PolarHBondContact O-N 2.94Å
370	A	96.5	Very high	95.8	Very high	33 Å²	33	55.1 Å²	55.1	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-45.3	178.4	0	0	0	0	0	112.6	K366 Q367 T368 D372 F373 E374 F420	K366-A370 WeakPolarHBondContact O-CB 3.48Å; K366-A370 PolarHBondContact O-N 3.18Å; K366-A370 VanDerWaalsContact O-N 3.08Å; Q367-A370 PolarHBondContact O-N 3.42Å; T368-A370 PolarHBondContact O-N 2.98Å; A370-D372 VanDerWaalsContact C-N 3.34Å; A370-D372 PolarHBondContact O-N 3.2Å; A370-F373 PolarHBondContact O-N 2.78Å; A370-E374 PolarHBondContact O-N 3.35Å; A370-F420 HydrophobicContact CB-CE1 3.82Å; A370-F420 HydrophobicContact CB-CZ 4.17Å
371	G	97.3	Very high	95.5	Very high	31 Å²	31	52.5 Å²	52.5	32%	0.32	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-34.9	178.2	0	0	0	0	0	113.3	Q367 T368 I369 E374 Y375	Q367-G371 PolarHBondContact O-N 2.73Å; T368-G371 PolarHBondContact O-N 3.47Å; I369-G371 PolarHBondContact O-N 3.16Å; G371-E374 PolarHBondContact O-N 3.12Å; G371-Y375 WeakPolarHBondContact O-CB 3.48Å; G371-Y375 PolarHBondContact O-N 3.01Å
372	D	98.1	Very high	95.1	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.011	26%	0.256	C	S	.	.	H	α-helix	trans	-71.1	-41.8	176.9	-69.5	-20.3	0	0	0	111.6	S317 L320 R321 T368 I369 A370 Y375 F376	S317-D372 WeakPolarHBondContact CA-OD2 3.38Å; S317-D372 VanDerWaalsContact CB-OD2 3.23Å; S317-D372 WeakPolarHBondContact CB-OD2 3.33Å; S317-D372 PolarHBondContact OG-OD1 2.89Å; S317-D372 PolarHBondContact OG-OD2 3.3Å; L320-D372 HydrophobicContact CD2-CB 3.78Å; L320-D372 HydrophobicContact CG-CB 4.08Å; R321-D372 HydrophobicContact CG-CB 4.16Å; R321-D372 IonicContact CZ-OD1 3.7Å; R321-D372 VanDerWaalsContact CZ-OD1 3.26Å; R321-D372 IonicContact NE-OD1 3.71Å; R321-D372 PolarHBondContact NE-OD1 2.98Å; R321-D372 IonicContact NH2-OD1 3.5Å; R321-D372 PolarHBondContact NH2-OD1 3.44Å; T368-D372 WeakPolarHBondContact O-CB 3.31Å; T368-D372 PolarHBondContact O-N 3.08Å; I369-D372 PolarHBondContact O-N 2.99Å; A370-D372 VanDerWaalsContact C-N 3.34Å; A370-D372 PolarHBondContact O-N 3.2Å; D372-Y375 WeakPolarHBondContact O-CB 3.47Å; D372-Y375 PolarHBondContact O-N 3.24Å; D372-Y375 VanDerWaalsContact O-N 3.12Å; D372-F376 VanDerWaalsContact C-CE1 3.46Å; D372-F376 HydrophobicContact CB-CE1 4.34Å; D372-F376 WeakPolarHBondContact O-CD1 3.34Å; D372-F376 WeakPolarHBondContact O-CE1 3.39Å; D372-F376 WeakPolarHBondContact O-CG 3.48Å; D372-F376 PolarHBondContact O-N 2.94Å
373	F	97.3	Very high	94.9	Very high	1 Å²	1	50 Å²	50	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-43	171.8	-89.9	-91.6	0	0	0	112.4	L320 L347 K348 I369 A370 Y375 F376 L377 L417 F420	L320-F373 HydrophobicContact CD1-CE2 3.96Å; L320-F373 HydrophobicContact CD1-CZ 4.47Å; L320-F373 HydrophobicContact CD2-CD2 4.35Å; L320-F373 HydrophobicContact CD2-CE2 4.22Å; L347-F373 HydrophobicContact CB-CZ 4.28Å; L347-F373 HydrophobicContact CD2-CZ 4.27Å; L347-F373 HydrophobicContact CG-CZ 3.99Å; K348-F373 HydrophobicContact CB-CE1 3.67Å; K348-F373 HydrophobicContact CB-CE2 4.38Å; K348-F373 HydrophobicContact CB-CZ 3.59Å; K348-F373 HydrophobicContact CD-CD1 4.34Å; K348-F373 HydrophobicContact CD-CD2 4Å; K348-F373 HydrophobicContact CD-CE1 4.09Å; K348-F373 HydrophobicContact CD-CE2 3.72Å; K348-F373 HydrophobicContact CD-CG 4.32Å; K348-F373 HydrophobicContact CD-CZ 3.79Å; K348-F373 HydrophobicContact CG-CE1 4.36Å; K348-F373 HydrophobicContact CG-CZ 4.28Å; I369-F373 HydrophobicContact CG2-CD2 3.87Å; I369-F373 HydrophobicContact CG2-CE2 3.97Å; I369-F373 WeakPolarHBondContact O-CD2 3.35Å; I369-F373 PolarHBondContact O-N 2.94Å; A370-F373 PolarHBondContact O-N 2.78Å; F373-Y375 VanDerWaalsContact C-N 3.32Å; F373-Y375 PolarHBondContact O-N 2.89Å; F373-F376 VanDerWaalsContact CA-CZ 3.48Å; F373-F376 HydrophobicContact CB-CE2 4.49Å; F373-F376 HydrophobicContact CB-CZ 4.07Å; F373-F376 AromaticContact CD1-CE2 3.69Å; F373-F376 HydrophobicContact CD1-CE2 3.69Å; F373-F376 AromaticContact CD1-CZ 3.42Å; F373-F376 HydrophobicContact CD1-CZ 3.42Å; F373-F376 VanDerWaalsContact CD1-CZ 3.42Å; F373-F376 HydrophobicContact CD2-CE1 4.36Å; F373-F376 AromaticContact CD2-CZ 3.86Å; F373-F376 HydrophobicContact CD2-CZ 3.86Å; F373-F376 HydrophobicContact CE1-CE2 4.01Å; F373-F376 AromaticContact CE1-CZ 3.64Å; F373-F376 HydrophobicContact CE1-CZ 3.64Å; F373-F376 HydrophobicContact CE2-CZ 4.07Å; F373-F376 HydrophobicContact CG-CE1 4.27Å; F373-F376 HydrophobicContact CG-CE2 4.13Å; F373-F376 AromaticContact CG-CZ 3.52Å; F373-F376 HydrophobicContact CG-CZ 3.52Å; F373-F376 AromaticContact CZ-CZ 3.94Å; F373-F376 HydrophobicContact CZ-CZ 3.94Å; F373-L377 WeakPolarHBondContact O-CB 3.46Å; F373-L377 PolarHBondContact O-N 2.96Å; F373-L377 VanDerWaalsContact O-N 3.12Å; F373-L417 HydrophobicContact CD1-CD2 4.14Å; F373-L417 HydrophobicContact CE1-CD2 4.41Å; F373-F420 HydrophobicContact CB-CD2 3.59Å; F373-F420 HydrophobicContact CB-CE2 3.69Å; F373-F420 HydrophobicContact CB-CG 4.11Å; F373-F420 HydrophobicContact CB-CZ 4.32Å; F373-F420 HydrophobicContact CD1-CD2 4.44Å; F373-F420 HydrophobicContact CD1-CE2 4.45Å; F373-F420 HydrophobicContact CG-CD2 4.29Å; F373-F420 HydrophobicContact CG-CE2 4.12Å
374	E	95.8	Very high	94.8	Very high	67 Å²	67	41.4 Å²	41.4	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-60.9	-41.1	171.8	-177.9	174.7	178.9	0	0	111.3	A370 G371 N378 F420	A370-E374 PolarHBondContact O-N 3.35Å; G371-E374 PolarHBondContact O-N 3.12Å; E374-N378 PolarHBondContact O-ND2 2.9Å; E374-F420 HydrophobicContact CB-CB 4.31Å; E374-F420 HydrophobicContact CB-CD1 4.47Å
375	Y	95.8	Very high	94.5	Very high	89 Å²	89	38.3 Å²	38.3	35%	0.349	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-57.5	-179.9	170.4	-101.1	0	0	0	112.7	R321 K325 G371 D372 F373 L379	R321-Y375 HydrophobicContact CG-CD1 4.15Å; R321-Y375 HydrophobicContact CG-CE1 4.47Å; K325-Y375 WeakPolarHBondContact CE-OH 3.43Å; K325-Y375 PolarHBondContact NZ-OH 3.35Å; G371-Y375 WeakPolarHBondContact O-CB 3.48Å; G371-Y375 PolarHBondContact O-N 3.01Å; D372-Y375 WeakPolarHBondContact O-CB 3.47Å; D372-Y375 PolarHBondContact O-N 3.24Å; D372-Y375 VanDerWaalsContact O-N 3.12Å; F373-Y375 VanDerWaalsContact C-N 3.32Å; F373-Y375 PolarHBondContact O-N 2.89Å; Y375-L379 HydrophobicContact CE1-CD1 4Å; Y375-L379 HydrophobicContact CE2-CD2 4.35Å
376	F	94.8	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-77.2	-30.5	-172.9	58.2	-111	0	0	0	113.5	L320 V328 L344 L347 D372 F373 N378 L379	L320-F376 HydrophobicContact CD1-CE1 4.23Å; L320-F376 HydrophobicContact CG-CE1 4.2Å; V328-F376 HydrophobicContact CG1-CD2 4.09Å; V328-F376 HydrophobicContact CG2-CB 4.23Å; V328-F376 WeakPolarHBondContact CG2-O 3.46Å; L344-F376 HydrophobicContact CD2-CD2 4.2Å; L344-F376 HydrophobicContact CD2-CE2 3.69Å; L347-F376 HydrophobicContact CD2-CZ 4.35Å; D372-F376 VanDerWaalsContact C-CE1 3.46Å; D372-F376 HydrophobicContact CB-CE1 4.34Å; D372-F376 WeakPolarHBondContact O-CD1 3.34Å; D372-F376 WeakPolarHBondContact O-CE1 3.39Å; D372-F376 WeakPolarHBondContact O-CG 3.48Å; D372-F376 PolarHBondContact O-N 2.94Å; F373-F376 VanDerWaalsContact CA-CZ 3.48Å; F373-F376 HydrophobicContact CB-CE2 4.49Å; F373-F376 HydrophobicContact CB-CZ 4.07Å; F373-F376 AromaticContact CD1-CE2 3.69Å; F373-F376 HydrophobicContact CD1-CE2 3.69Å; F373-F376 AromaticContact CD1-CZ 3.42Å; F373-F376 HydrophobicContact CD1-CZ 3.42Å; F373-F376 VanDerWaalsContact CD1-CZ 3.42Å; F373-F376 HydrophobicContact CD2-CE1 4.36Å; F373-F376 AromaticContact CD2-CZ 3.86Å; F373-F376 HydrophobicContact CD2-CZ 3.86Å; F373-F376 HydrophobicContact CE1-CE2 4.01Å; F373-F376 AromaticContact CE1-CZ 3.64Å; F373-F376 HydrophobicContact CE1-CZ 3.64Å; F373-F376 HydrophobicContact CE2-CZ 4.07Å; F373-F376 HydrophobicContact CG-CE1 4.27Å; F373-F376 HydrophobicContact CG-CE2 4.13Å; F373-F376 AromaticContact CG-CZ 3.52Å; F373-F376 HydrophobicContact CG-CZ 3.52Å; F373-F376 AromaticContact CZ-CZ 3.94Å; F373-F376 HydrophobicContact CZ-CZ 3.94Å; F376-N378 PolarHBondContact O-N 3.27Å; F376-L379 HydrophobicContact CB-CD1 4.18Å; F376-L379 WeakPolarHBondContact O-CB 3.25Å; F376-L379 PolarHBondContact O-N 3.42Å; F376-L379 VanDerWaalsContact O-N 3.1Å
377	L	93.8	Very high	94.2	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-34.5	177.8	-177.7	67.4	0	0	0	111.7	L344 F373 S383 L417 F420 M421	L344-L377 HydrophobicContact CD1-CD1 3.8Å; F373-L377 WeakPolarHBondContact O-CB 3.46Å; F373-L377 PolarHBondContact O-N 2.96Å; F373-L377 VanDerWaalsContact O-N 3.12Å; L377-S383 WeakPolarHBondContact O-CB 3.47Å; L377-S383 PolarHBondContact O-OG 3.3Å; L377-L417 VanDerWaalsContact CD2-O 3.22Å; L377-L417 WeakPolarHBondContact CD2-O 3.26Å; L377-F420 HydrophobicContact CD2-CB 3.89Å; L377-M421 HydrophobicContact CD2-CB 4.28Å
378	N	93.2	Very high	94	Very high	47 Å²	47	27.6 Å²	27.6	25%	0.251	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	1.4	-178.6	-64.4	-64.4	0	0	0	113.9	E374 F376 N380 F420 Q422	E374-N378 PolarHBondContact O-ND2 2.9Å; F376-N378 PolarHBondContact O-N 3.27Å; N378-N380 VanDerWaalsContact C-N 3.33Å; N378-F420 PolarHBondContact ND2-O 3.37Å; N378-Q422 PolarHBondContact OD1-N 3.28Å
379	L	92.1	Very high	93.7	Very high	86 Å²	86	26.9 Å²	26.9	45%	0.45	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-28.9	170.8	-66	175.5	0	0	0	112	K325 V328 Y375 F376	K325-L379 HydrophobicContact CD-CD1 4.44Å; K325-L379 HydrophobicContact CG-CD1 3.77Å; V328-L379 HydrophobicContact CG2-CB 4.31Å; V328-L379 HydrophobicContact CG2-CD1 4.49Å; Y375-L379 HydrophobicContact CE1-CD1 4Å; Y375-L379 HydrophobicContact CE2-CD2 4.35Å; F376-L379 HydrophobicContact CB-CD1 4.18Å; F376-L379 WeakPolarHBondContact O-CB 3.25Å; F376-L379 PolarHBondContact O-N 3.42Å; F376-L379 VanDerWaalsContact O-N 3.1Å
380	N	89.3	Confident	93.4	Very high	10 Å²	10	26.7 Å²	26.7	5%	0.053	14%	0.144	C	C	.	.	S	Bend	trans	-102.2	117.2	179.7	-171.1	-31.4	0	0	0	110.9	V328 N378 R382 S383	V328-N380 HydrophobicContact CB-CB 4.26Å; V328-N380 PolarHBondContact O-ND2 3.48Å; N378-N380 VanDerWaalsContact C-N 3.33Å; N380-R382 PolarHBondContact O-N 3.03Å; N380-R382 VanDerWaalsContact O-N 3.15Å; N380-R382 WeakPolarHBondContact OD1-CA 3.23Å; N380-R382 VanDerWaalsContact OD1-CB 3.24Å; N380-R382 WeakPolarHBondContact OD1-CB 3.35Å; N380-R382 PolarHBondContact OD1-N 3.5Å; N380-S383 WeakPolarHBondContact O-CB 3.34Å; N380-S383 PolarHBondContact O-N 3.13Å; N380-S383 VanDerWaalsContact O-N 3.16Å; N380-S383 PolarHBondContact O-OG 3.21Å
381	S	88.6	Confident	93.3	Very high	68 Å²	68	25.1 Å²	25.1	48%	0.476	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.8	179.8	66.2	0	0	0	0	114.3	P384	S381-P384 WeakPolarHBondContact O-CD 3.48Å
382	R	88.3	Confident	92.9	Very high	82 Å²	82	23.7 Å²	23.7	31%	0.309	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.4	178.2	-53.7	-177.1	-178.2	-176.5	-4.5	113.5	N380 P384 E385 Y386 D718	N380-R382 PolarHBondContact O-N 3.03Å; N380-R382 VanDerWaalsContact O-N 3.15Å; N380-R382 WeakPolarHBondContact OD1-CA 3.23Å; N380-R382 VanDerWaalsContact OD1-CB 3.24Å; N380-R382 WeakPolarHBondContact OD1-CB 3.35Å; N380-R382 PolarHBondContact OD1-N 3.5Å; R382-P384 VanDerWaalsContact C-CD 3.41Å; R382-P384 VanDerWaalsContact C-N 3.32Å; R382-E385 WeakPolarHBondContact O-CB 3.38Å; R382-E385 PolarHBondContact O-N 3.37Å; R382-Y386 HydrophobicContact CB-CD1 4.32Å; R382-Y386 HydrophobicContact CB-CD2 4.3Å; R382-Y386 HydrophobicContact CB-CE1 4Å; R382-Y386 HydrophobicContact CB-CE2 3.97Å; R382-Y386 HydrophobicContact CB-CG 4.48Å; R382-Y386 VanDerWaalsContact CD-OH 3.31Å; R382-Y386 WeakPolarHBondContact CD-OH 3.5Å; R382-Y386 PolarHBondContact O-N 3.48Å; R382-D718 IonicContact NH2-OD1 3.68Å
383	S	92.5	Very high	92.4	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-49.4	-42.9	177.9	-68.7	0	0	0	0	114	Y340 L377 N380 Y386 L387	Y340-S383 PolarHBondContact OH-OG 3.28Å; L377-S383 WeakPolarHBondContact O-CB 3.47Å; L377-S383 PolarHBondContact O-OG 3.3Å; N380-S383 WeakPolarHBondContact O-CB 3.34Å; N380-S383 PolarHBondContact O-N 3.13Å; N380-S383 VanDerWaalsContact O-N 3.16Å; N380-S383 PolarHBondContact O-OG 3.21Å; S383-Y386 PolarHBondContact O-N 2.9Å; S383-L387 WeakPolarHBondContact O-CB 3.43Å; S383-L387 PolarHBondContact O-N 3.47Å
384	P	93.6	Very high	91.9	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.032	13%	0.131	C	C	.	.	H	α-helix	trans	-62.6	-42.1	176.3	-21.7	33.6	0	0	0	113.9	S381 R382 S388 M421 E423 V426 F427	S381-P384 WeakPolarHBondContact O-CD 3.48Å; R382-P384 VanDerWaalsContact C-CD 3.41Å; R382-P384 VanDerWaalsContact C-N 3.32Å; P384-S388 WeakPolarHBondContact O-CB 3.2Å; P384-S388 PolarHBondContact O-N 2.98Å; P384-M421 HydrophobicContact CB-CE 4.29Å; P384-M421 HydrophobicContact CB-SD 3.68Å; P384-M421 HydrophobicContact CG-CE 4.3Å; P384-M421 HydrophobicContact CG-CG 4.38Å; P384-M421 HydrophobicContact CG-SD 3.7Å; P384-E423 HydrophobicContact CG-CB 4.31Å; P384-V426 HydrophobicContact CB-CB 4.1Å; P384-V426 HydrophobicContact CB-CG1 3.91Å; P384-V426 HydrophobicContact CG-CB 4.3Å; P384-V426 HydrophobicContact CG-CG1 4.23Å; P384-F427 HydrophobicContact CB-CB 4Å; P384-F427 WeakPolarHBondContact O-CD2 3.41Å
385	E	91.6	Very high	91.5	Very high	3 Å²	3	23.6 Å²	23.6	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-46.9	176.6	-175.3	-171.3	172.8	0	0	110.3	R382 L387 S388 L389 Y430 G715 E716 R721	R382-E385 WeakPolarHBondContact O-CB 3.38Å; R382-E385 PolarHBondContact O-N 3.37Å; E385-L387 PolarHBondContact O-N 2.89Å; E385-S388 WeakPolarHBondContact O-CB 3.42Å; E385-S388 PolarHBondContact O-N 3.12Å; E385-L389 HydrophobicContact CG-CD1 4Å; E385-L389 WeakPolarHBondContact O-CG 3.47Å; E385-L389 PolarHBondContact O-N 2.83Å; E385-Y430 HydrophobicContact CB-CD2 3.82Å; E385-Y430 HydrophobicContact CB-CE1 4.37Å; E385-Y430 HydrophobicContact CB-CE2 3.65Å; E385-Y430 HydrophobicContact CB-CG 4.26Å; E385-Y430 HydrophobicContact CG-CD1 4.09Å; E385-Y430 HydrophobicContact CG-CD2 4.28Å; E385-Y430 HydrophobicContact CG-CE1 3.95Å; E385-Y430 HydrophobicContact CG-CE2 4.15Å; E385-Y430 HydrophobicContact CG-CG 4.26Å; E385-G715 VanDerWaalsContact OE1-CA 3.27Å; E385-G715 WeakPolarHBondContact OE1-CA 3.47Å; E385-E716 PolarHBondContact OE1-N 2.95Å; E385-R721 IonicContact OE1-CZ 3.67Å; E385-R721 IonicContact OE1-NE 3.67Å; E385-R721 PolarHBondContact OE1-NE 2.91Å; E385-R721 IonicContact OE1-NH2 3.95Å; E385-R721 PolarHBondContact OE1-NH2 3.08Å; E385-R721 IonicContact OE2-CZ 3.12Å; E385-R721 IonicContact OE2-NE 2.63Å; E385-R721 PolarHBondContact OE2-NE 2.83Å; E385-R721 IonicContact OE2-NH2 2.73Å
386	Y	92.3	Very high	91	Very high	17 Å²	17	21.6 Å²	21.6	7%	0.067	11%	0.109	C	C	.	.	H	α-helix	trans	-66	-40.5	-176.1	-69.3	-3.9	0	0	0	112.4	P337 Y340 R382 S383 S388 L389 F390	P337-Y386 HydrophobicContact CB-CD1 3.76Å; P337-Y386 HydrophobicContact CB-CE1 4.37Å; P337-Y386 HydrophobicContact CB-CG 3.91Å; P337-Y386 HydrophobicContact CG-CD1 3.74Å; P337-Y386 HydrophobicContact CG-CE1 3.88Å; P337-Y386 HydrophobicContact CG-CG 4.32Å; Y340-Y386 AromaticContact CD1-CD2 3.8Å; Y340-Y386 HydrophobicContact CD1-CD2 3.8Å; Y340-Y386 HydrophobicContact CD2-CD2 4Å; Y340-Y386 HydrophobicContact CD2-CE2 4.24Å; Y340-Y386 HydrophobicContact CE1-CD2 4.12Å; Y340-Y386 HydrophobicContact CE2-CD2 4.26Å; Y340-Y386 AromaticContact CG-CD2 3.75Å; Y340-Y386 HydrophobicContact CG-CD2 3.75Å; Y340-Y386 HydrophobicContact CG-CE2 4.37Å; R382-Y386 HydrophobicContact CB-CD1 4.32Å; R382-Y386 HydrophobicContact CB-CD2 4.3Å; R382-Y386 HydrophobicContact CB-CE1 4Å; R382-Y386 HydrophobicContact CB-CE2 3.97Å; R382-Y386 HydrophobicContact CB-CG 4.48Å; R382-Y386 VanDerWaalsContact CD-OH 3.31Å; R382-Y386 WeakPolarHBondContact CD-OH 3.5Å; R382-Y386 PolarHBondContact O-N 3.48Å; S383-Y386 PolarHBondContact O-N 2.9Å; Y386-S388 VanDerWaalsContact C-N 3.31Å; Y386-S388 PolarHBondContact O-N 3.38Å; Y386-L389 HydrophobicContact CD1-CD1 4.47Å; Y386-L389 PolarHBondContact O-N 3.38Å; Y386-F390 WeakPolarHBondContact O-CB 3.45Å; Y386-F390 PolarHBondContact O-N 3.36Å
387	L	94.9	Very high	89.8	Confident	1 Å²	1	27 Å²	27	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-41.3	173.7	-175.8	60.6	0	0	0	111.4	I341 S383 E385 F390 I391 A414 F418 M421 F427	I341-L387 HydrophobicContact CD1-CB 3.93Å; I341-L387 HydrophobicContact CD1-CD1 4.13Å; I341-L387 HydrophobicContact CG2-CD1 4.1Å; S383-L387 WeakPolarHBondContact O-CB 3.43Å; S383-L387 PolarHBondContact O-N 3.47Å; E385-L387 PolarHBondContact O-N 2.89Å; L387-F390 PolarHBondContact O-N 3.44Å; L387-I391 HydrophobicContact CD1-CD1 4.29Å; L387-I391 HydrophobicContact CG-CD1 4.13Å; L387-I391 WeakPolarHBondContact O-CG1 3.47Å; L387-I391 PolarHBondContact O-N 3.36Å; L387-A414 HydrophobicContact CD1-CB 4.13Å; L387-F418 HydrophobicContact CD2-CB 3.92Å; L387-F418 HydrophobicContact CD2-CD2 4.29Å; L387-M421 HydrophobicContact CB-CE 4.07Å; L387-M421 HydrophobicContact CD2-CE 3.64Å; L387-F427 HydrophobicContact CB-CD2 4.26Å; L387-F427 HydrophobicContact CB-CE2 4.23Å; L387-F427 HydrophobicContact CD2-CD2 4.24Å; L387-F427 HydrophobicContact CD2-CE2 4.12Å; L387-F427 HydrophobicContact CG-CD2 4.28Å; L387-F427 HydrophobicContact CG-CE2 3.91Å
388	S	94	Very high	88.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-41.8	176.7	-177.1	0	0	0	0	112.4	P384 E385 Y386 I391 D392 Y431 H434	P384-S388 WeakPolarHBondContact O-CB 3.2Å; P384-S388 PolarHBondContact O-N 2.98Å; E385-S388 WeakPolarHBondContact O-CB 3.42Å; E385-S388 PolarHBondContact O-N 3.12Å; Y386-S388 VanDerWaalsContact C-N 3.31Å; Y386-S388 PolarHBondContact O-N 3.38Å; S388-I391 PolarHBondContact O-N 3.02Å; S388-D392 VanDerWaalsContact O-CB 3.31Å; S388-D392 WeakPolarHBondContact O-CB 3.46Å; S388-D392 PolarHBondContact O-N 3.15Å; S388-Y431 WeakPolarHBondContact OG-CA 3.3Å; S388-Y431 PolarHBondContact OG-N 3.42Å; S388-H434 PolarHBondContact OG-ND1 3.37Å
389	L	90.6	Very high	86.4	Confident	16 Å²	16	31 Å²	31	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-38.5	175.3	-74.4	169.5	0	0	0	112.4	P337 E385 Y386 D392 D393 H434	P337-L389 HydrophobicContact CB-CB 4.09Å; P337-L389 HydrophobicContact CB-CD1 4.08Å; P337-L389 HydrophobicContact CG-CD1 3.8Å; E385-L389 HydrophobicContact CG-CD1 4Å; E385-L389 WeakPolarHBondContact O-CG 3.47Å; E385-L389 PolarHBondContact O-N 2.83Å; Y386-L389 HydrophobicContact CD1-CD1 4.47Å; Y386-L389 PolarHBondContact O-N 3.38Å; L389-D392 PolarHBondContact O-N 3.1Å; L389-D393 WeakPolarHBondContact O-CB 3.26Å; L389-D393 PolarHBondContact O-N 2.82Å; L389-H434 WeakPolarHBondContact CD2-CE1 3.49Å
390	F	91.8	Very high	85	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-46.4	174.7	177.4	-92.1	0	0	0	111.2	V338 I341 L345 Y386 L387 D393 K394 I410 A414	V338-F390 HydrophobicContact CB-CD2 4.45Å; V338-F390 HydrophobicContact CG1-CD2 4.02Å; V338-F390 HydrophobicContact CG1-CE2 4.21Å; I341-F390 HydrophobicContact CB-CB 3.98Å; I341-F390 HydrophobicContact CB-CD2 3.79Å; I341-F390 HydrophobicContact CB-CE2 4.39Å; I341-F390 HydrophobicContact CB-CG 3.85Å; I341-F390 HydrophobicContact CG1-CB 3.93Å; I341-F390 HydrophobicContact CG1-CG 4.35Å; I341-F390 HydrophobicContact CG2-CB 4.03Å; I341-F390 HydrophobicContact CG2-CD1 3.73Å; I341-F390 HydrophobicContact CG2-CD2 3.79Å; I341-F390 HydrophobicContact CG2-CE1 4.08Å; I341-F390 HydrophobicContact CG2-CE2 4.13Å; I341-F390 HydrophobicContact CG2-CG 3.58Å; I341-F390 HydrophobicContact CG2-CZ 4.27Å; L345-F390 HydrophobicContact CD1-CE1 4.07Å; L345-F390 HydrophobicContact CD1-CZ 3.81Å; Y386-F390 WeakPolarHBondContact O-CB 3.45Å; Y386-F390 PolarHBondContact O-N 3.36Å; L387-F390 PolarHBondContact O-N 3.44Å; F390-D393 WeakPolarHBondContact O-CB 3.43Å; F390-D393 PolarHBondContact O-N 2.87Å; F390-K394 HydrophobicContact CE1-CG 4.26Å; F390-K394 HydrophobicContact CZ-CG 4.46Å; F390-K394 WeakPolarHBondContact O-CG 3.4Å; F390-K394 PolarHBondContact O-N 3.24Å; F390-K394 VanDerWaalsContact O-N 3.13Å; F390-I410 HydrophobicContact CE1-CG2 3.66Å; F390-I410 HydrophobicContact CZ-CG2 3.77Å; F390-A414 HydrophobicContact CE1-CB 4.38Å
391	I	92.9	Very high	83.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-40.5	176.8	-64.8	161.6	0	0	0	110.9	L387 S388 D393 K394 L395 L411 A414 F427 Y431 M453	L387-I391 HydrophobicContact CD1-CD1 4.29Å; L387-I391 HydrophobicContact CG-CD1 4.13Å; L387-I391 WeakPolarHBondContact O-CG1 3.47Å; L387-I391 PolarHBondContact O-N 3.36Å; S388-I391 PolarHBondContact O-N 3.02Å; I391-D393 VanDerWaalsContact C-N 3.29Å; I391-D393 PolarHBondContact O-N 2.89Å; I391-K394 PolarHBondContact O-N 2.99Å; I391-L395 HydrophobicContact CG2-CD1 3.68Å; I391-L395 HydrophobicContact CG2-CG 4.37Å; I391-L395 WeakPolarHBondContact O-CG 3.33Å; I391-L395 PolarHBondContact O-N 3.45Å; I391-L395 VanDerWaalsContact O-N 3.09Å; I391-L411 HydrophobicContact CG1-CD2 4.35Å; I391-L411 HydrophobicContact CG2-CD2 3.9Å; I391-A414 HydrophobicContact CD1-CB 4.47Å; I391-A414 HydrophobicContact CG1-CB 4.3Å; I391-F427 HydrophobicContact CD1-CE2 3.92Å; I391-F427 HydrophobicContact CD1-CZ 3.82Å; I391-Y431 HydrophobicContact CG2-CE2 3.82Å; I391-M453 HydrophobicContact CD1-CE 3.72Å; I391-M453 HydrophobicContact CG2-CE 4.36Å; I391-M453 HydrophobicContact CG2-CG 4.31Å; I391-M453 HydrophobicContact CG2-SD 4.31Å
392	D	89.8	Confident	83.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.7	-38	174.1	-177	53.3	0	0	0	112	S388 L389 K396 H434 R437 R438	S388-D392 VanDerWaalsContact O-CB 3.31Å; S388-D392 WeakPolarHBondContact O-CB 3.46Å; S388-D392 PolarHBondContact O-N 3.15Å; L389-D392 PolarHBondContact O-N 3.1Å; D392-K396 WeakPolarHBondContact O-CD 3.18Å; D392-K396 VanDerWaalsContact O-CG 3.24Å; D392-K396 WeakPolarHBondContact O-CG 3.32Å; D392-K396 PolarHBondContact O-N 3.49Å; D392-K396 WeakPolarHBondContact OD1-CE 3.33Å; D392-K396 IonicContact OD1-NZ 3.36Å; D392-K396 WeakPolarHBondContact OD2-CE 3.4Å; D392-K396 IonicContact OD2-NZ 3.38Å; D392-K396 PolarHBondContact OD2-NZ 3.47Å; D392-H434 HydrophobicContact CB-CB 4.01Å; D392-R437 IonicContact OD2-NH2 2.76Å; D392-R437 PolarHBondContact OD2-NH2 3.42Å; D392-R438 VanDerWaalsContact OD1-CD 3.26Å; D392-R438 WeakPolarHBondContact OD1-CD 3.39Å; D392-R438 WeakPolarHBondContact OD1-CG 3.38Å; D392-R438 IonicContact OD1-CZ 2.87Å; D392-R438 IonicContact OD1-NE 3.51Å; D392-R438 IonicContact OD1-NH1 2.82Å; D392-R438 PolarHBondContact OD1-NH1 3.21Å
393	D	86.8	Confident	83	Confident	37 Å²	37	39.4 Å²	39.4	20%	0.198	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-47.9	173	-175.9	73.7	0	0	0	110.9	V338 L389 F390 I391 L395 K396 V399	V338-D393 HydrophobicContact CG2-CB 4.26Å; L389-D393 WeakPolarHBondContact O-CB 3.26Å; L389-D393 PolarHBondContact O-N 2.82Å; F390-D393 WeakPolarHBondContact O-CB 3.43Å; F390-D393 PolarHBondContact O-N 2.87Å; I391-D393 VanDerWaalsContact C-N 3.29Å; I391-D393 PolarHBondContact O-N 2.89Å; D393-L395 VanDerWaalsContact C-N 3.28Å; D393-L395 PolarHBondContact O-N 2.96Å; D393-K396 PolarHBondContact O-N 3.3Å; D393-V399 WeakPolarHBondContact O-CG2 3.31Å
394	K	86.8	Confident	82.5	Confident	31 Å²	31	45.5 Å²	45.5	14%	0.135	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-20.2	-178.1	-58.1	-48.2	176	-158.7	0	114.8	F390 I391 I410	F390-K394 HydrophobicContact CE1-CG 4.26Å; F390-K394 HydrophobicContact CZ-CG 4.46Å; F390-K394 WeakPolarHBondContact O-CG 3.4Å; F390-K394 PolarHBondContact O-N 3.24Å; F390-K394 VanDerWaalsContact O-N 3.13Å; I391-K394 PolarHBondContact O-N 2.99Å; K394-I410 HydrophobicContact CG-CG2 4.09Å
395	L	88.4	Confident	82.1	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	3.9	-178.3	-67.8	174.4	0	0	0	114.5	I391 D393 V407 L411 S444 V445 M453	I391-L395 HydrophobicContact CG2-CD1 3.68Å; I391-L395 HydrophobicContact CG2-CG 4.37Å; I391-L395 WeakPolarHBondContact O-CG 3.33Å; I391-L395 PolarHBondContact O-N 3.45Å; I391-L395 VanDerWaalsContact O-N 3.09Å; D393-L395 VanDerWaalsContact C-N 3.28Å; D393-L395 PolarHBondContact O-N 2.96Å; L395-V407 HydrophobicContact CD2-CG1 4.46Å; L395-L411 HydrophobicContact CD2-CD1 4.16Å; L395-S444 WeakPolarHBondContact O-CA 3.36Å; L395-V445 WeakPolarHBondContact O-CG2 3.17Å; L395-V445 PolarHBondContact O-N 2.57Å; L395-M453 HydrophobicContact CD1-CB 4.45Å; L395-M453 HydrophobicContact CD1-CG 4.4Å
396	K	84.4	Confident	81.9	Confident	46 Å²	46	57 Å²	57	20%	0.2	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-89.1	138	178	-83.1	166.8	-173.6	161.1	0	113.7	D392 D393 G398 V399 R438 K443 V445	D392-K396 WeakPolarHBondContact O-CD 3.18Å; D392-K396 VanDerWaalsContact O-CG 3.24Å; D392-K396 WeakPolarHBondContact O-CG 3.32Å; D392-K396 PolarHBondContact O-N 3.49Å; D392-K396 WeakPolarHBondContact OD1-CE 3.33Å; D392-K396 IonicContact OD1-NZ 3.36Å; D392-K396 WeakPolarHBondContact OD2-CE 3.4Å; D392-K396 IonicContact OD2-NZ 3.38Å; D392-K396 PolarHBondContact OD2-NZ 3.47Å; D393-K396 PolarHBondContact O-N 3.3Å; K396-G398 PolarHBondContact O-N 3.41Å; K396-V399 HydrophobicContact CB-CG2 4.18Å; K396-V399 WeakPolarHBondContact O-CG2 3.25Å; K396-V399 PolarHBondContact O-N 3.09Å; K396-R438 HydrophobicContact CG-CG 4.49Å; K396-K443 CarbonylContact C-O 3.55Å; K396-K443 WeakPolarHBondContact CA-O 3.43Å; K396-V445 WeakPolarHBondContact O-CG2 3.38Å
397	K	69.5	Low	81.6	Confident	115 Å²	115	56.9 Å²	56.9	50%	0.5	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	132.7	170.1	-81.8	173.3	172.4	153.2	0	110.9	N442 K443 S444	K397-N442 PolarHBondContact NZ-O 3.33Å; K397-N442 PolarHBondContact NZ-OD1 2.98Å; K397-K443 PolarHBondContact N-O 3.45Å; K397-S444 VanDerWaalsContact CD-O 3.32Å; K397-S444 WeakPolarHBondContact CD-O 3.49Å; K397-S444 WeakPolarHBondContact CE-O 3.4Å; K397-S444 VanDerWaalsContact CG-O 3.24Å; K397-S444 WeakPolarHBondContact CG-O 3.38Å; K397-S444 PolarHBondContact NZ-O 3.41Å
398	G	58.9	Low	81.3	Confident	82 Å²	82	60.6 Å²	60.6	85%	0.845	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	7	177	0	0	0	0	0	115.2	K396	K396-G398 PolarHBondContact O-N 3.41Å
399	V	57.4	Low	81.2	Confident	49 Å²	49	63.3 Å²	63.3	30%	0.297	35%	0.353	S	S	.	.			trans	-71.5	126.9	167.5	179.2	0	0	0	0	108	D393 K396 G401	D393-V399 WeakPolarHBondContact O-CG2 3.31Å; K396-V399 HydrophobicContact CB-CG2 4.18Å; K396-V399 WeakPolarHBondContact O-CG2 3.25Å; K396-V399 PolarHBondContact O-N 3.09Å; V399-G401 PolarHBondContact O-N 2.86Å
400	K	63	Low	81.1	Confident	195 Å²	195	64.1 Å²	64.1	85%	0.848	36%	0.358	S	S	*	.	S	Bend	trans	-52.3	124.5	-169.2	-66.2	179.1	175.9	-177.7	0	112.7	L402	K400-L402 PolarHBondContact O-N 2.99Å
401	G	64	Low	81.1	Confident	83 Å²	83	64.3 Å²	64.3	86%	0.856	36%	0.359	S	S	*	.	S	Bend	trans	60.8	0.1	146.8	0	0	0	0	0	120.4	V399	V399-G401 PolarHBondContact O-N 2.86Å
402	L	75.8	Confident	81.2	Confident	72 Å²	72	67.9 Å²	67.9	38%	0.377	38%	0.378	S	S	.	.			trans	-80.2	137.6	-179.6	-66	172.1	0	0	0	111.3	K400 E406 V407 I410	K400-L402 PolarHBondContact O-N 2.99Å; L402-E406 HydrophobicContact CD2-CB 4.22Å; L402-V407 HydrophobicContact CB-CG2 4.06Å; L402-V407 HydrophobicContact CD1-CG2 4.49Å; L402-I410 HydrophobicContact CD1-CD1 4.19Å
403	T	83.4	Confident	81.4	Confident	73 Å²	73	72.6 Å²	72.6	45%	0.448	40%	0.398	S	S	.	.			trans	-74.5	158.1	170	63	0	0	0	0	111	Q405 E406 V407	T403-Q405 PolarHBondContact O-N 3.37Å; T403-E406 PolarHBondContact N-OE2 3.06Å; T403-E406 PolarHBondContact O-N 3.33Å; T403-E406 VanDerWaalsContact OG1-CD 3.32Å; T403-E406 VanDerWaalsContact OG1-CG 3.25Å; T403-E406 WeakPolarHBondContact OG1-CG 3.45Å; T403-E406 PolarHBondContact OG1-N 3.41Å; T403-E406 PolarHBondContact OG1-OE2 3.25Å; T403-V407 WeakPolarHBondContact O-CG2 3.49Å; T403-V407 PolarHBondContact O-N 3.04Å; T403-V407 VanDerWaalsContact O-N 3.09Å
404	E	81.6	Confident	81.8	Confident	130 Å²	130	70.9 Å²	70.9	61%	0.607	39%	0.389	S	S	*	.	H	α-helix	trans	-58.2	-35.1	177.1	-67	-173.7	160.6	0	0	112.4	V407 E408	E404-V407 PolarHBondContact O-N 2.96Å; E404-E408 PolarHBondContact O-N 3.23Å
405	Q	86.9	Confident	82.2	Confident	158 Å²	158	69.8 Å²	69.8	74%	0.738	38%	0.384	S	S	*	.	H	α-helix	trans	-66.7	-40.5	177.4	-69	-179.8	-7.2	0	0	112.6	T403 E408 S409	T403-Q405 PolarHBondContact O-N 3.37Å; Q405-E408 PolarHBondContact O-N 2.89Å; Q405-S409 PolarHBondContact O-N 3.16Å
406	E	86.3	Confident	82.4	Confident	92 Å²	92	71.1 Å²	71.1	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-66.7	-40.4	176.1	-72	166.3	136.8	0	0	111.2	L402 T403 E408 S409 I410	L402-E406 HydrophobicContact CD2-CB 4.22Å; T403-E406 PolarHBondContact N-OE2 3.06Å; T403-E406 PolarHBondContact O-N 3.33Å; T403-E406 VanDerWaalsContact OG1-CD 3.32Å; T403-E406 VanDerWaalsContact OG1-CG 3.25Å; T403-E406 WeakPolarHBondContact OG1-CG 3.45Å; T403-E406 PolarHBondContact OG1-N 3.41Å; T403-E406 PolarHBondContact OG1-OE2 3.25Å; E406-E408 VanDerWaalsContact C-N 3.33Å; E406-E408 PolarHBondContact O-N 2.89Å; E406-S409 PolarHBondContact O-N 3.15Å; E406-I410 VanDerWaalsContact O-CG1 3.28Å; E406-I410 WeakPolarHBondContact O-CG1 3.46Å; E406-I410 PolarHBondContact O-N 2.91Å
407	V	85.6	Confident	83	Confident	14 Å²	14	69 Å²	69	9%	0.085	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-47.1	173.8	174.7	0	0	0	0	110	L395 L402 T403 E404 S409 I410 L411	L395-V407 HydrophobicContact CD2-CG1 4.46Å; L402-V407 HydrophobicContact CB-CG2 4.06Å; L402-V407 HydrophobicContact CD1-CG2 4.49Å; T403-V407 WeakPolarHBondContact O-CG2 3.49Å; T403-V407 PolarHBondContact O-N 3.04Å; T403-V407 VanDerWaalsContact O-N 3.09Å; E404-V407 PolarHBondContact O-N 2.96Å; V407-S409 PolarHBondContact O-N 3.04Å; V407-I410 PolarHBondContact O-N 3.26Å; V407-L411 HydrophobicContact CG1-CD1 4.15Å; V407-L411 HydrophobicContact CG1-CG 4.34Å; V407-L411 VanDerWaalsContact O-CG 3.32Å; V407-L411 WeakPolarHBondContact O-CG 3.42Å; V407-L411 PolarHBondContact O-N 3.04Å
408	E	89.1	Confident	84.2	Confident	78 Å²	78	63.5 Å²	63.5	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-59.2	-45.9	178	-178.4	163.2	-147.8	0	0	112.5	E404 Q405 E406 I410 L411 D412 N452 K456	E404-E408 PolarHBondContact O-N 3.23Å; Q405-E408 PolarHBondContact O-N 2.89Å; E406-E408 VanDerWaalsContact C-N 3.33Å; E406-E408 PolarHBondContact O-N 2.89Å; E408-I410 VanDerWaalsContact C-N 3.29Å; E408-I410 PolarHBondContact O-N 3Å; E408-L411 PolarHBondContact O-N 3.18Å; E408-L411 VanDerWaalsContact O-N 3.11Å; E408-D412 PolarHBondContact O-N 3.38Å; E408-N452 PolarHBondContact OE1-ND2 3.36Å; E408-K456 IonicContact OE1-NZ 3.46Å
409	S	91.2	Very high	85.9	Confident	58 Å²	58	65.3 Å²	65.3	41%	0.406	34%	0.341	S	S	.	.	H	α-helix	trans	-59.5	-39.4	176.6	-173.6	0	0	0	0	112.5	Q405 E406 V407 D412 K413	Q405-S409 PolarHBondContact O-N 3.16Å; E406-S409 PolarHBondContact O-N 3.15Å; V407-S409 PolarHBondContact O-N 3.04Å; S409-D412 PolarHBondContact O-N 3.42Å; S409-K413 WeakPolarHBondContact O-CG 3.44Å; S409-K413 PolarHBondContact O-N 3.28Å; S409-K413 VanDerWaalsContact O-N 3.14Å
410	I	89.8	Confident	87.7	Confident	33 Å²	33	64.2 Å²	64.2	17%	0.169	33%	0.332	C	S	.	.	H	α-helix	trans	-66.4	-41.2	176.1	-67.9	165.2	0	0	0	110.8	F390 K394 L402 E406 V407 E408 K413 A414	F390-I410 HydrophobicContact CE1-CG2 3.66Å; F390-I410 HydrophobicContact CZ-CG2 3.77Å; K394-I410 HydrophobicContact CG-CG2 4.09Å; L402-I410 HydrophobicContact CD1-CD1 4.19Å; E406-I410 VanDerWaalsContact O-CG1 3.28Å; E406-I410 WeakPolarHBondContact O-CG1 3.46Å; E406-I410 PolarHBondContact O-N 2.91Å; V407-I410 PolarHBondContact O-N 3.26Å; E408-I410 VanDerWaalsContact C-N 3.29Å; E408-I410 PolarHBondContact O-N 3Å; I410-K413 PolarHBondContact O-N 2.69Å; I410-A414 WeakPolarHBondContact O-CB 3.27Å; I410-A414 PolarHBondContact O-N 2.89Å
411	L	92	Very high	89.2	Confident	4 Å²	4	55 Å²	55	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-40.1	177.2	-65.4	178.3	0	0	0	111.5	I391 L395 V407 E408 K413 A414 M415 M453	I391-L411 HydrophobicContact CG1-CD2 4.35Å; I391-L411 HydrophobicContact CG2-CD2 3.9Å; L395-L411 HydrophobicContact CD2-CD1 4.16Å; V407-L411 HydrophobicContact CG1-CD1 4.15Å; V407-L411 HydrophobicContact CG1-CG 4.34Å; V407-L411 VanDerWaalsContact O-CG 3.32Å; V407-L411 WeakPolarHBondContact O-CG 3.42Å; V407-L411 PolarHBondContact O-N 3.04Å; E408-L411 PolarHBondContact O-N 3.18Å; E408-L411 VanDerWaalsContact O-N 3.11Å; L411-K413 VanDerWaalsContact C-N 3.34Å; L411-K413 PolarHBondContact O-N 2.96Å; L411-A414 WeakPolarHBondContact O-CB 3.43Å; L411-A414 PolarHBondContact O-N 3.36Å; L411-M415 VanDerWaalsContact O-CG 3.31Å; L411-M415 WeakPolarHBondContact O-CG 3.46Å; L411-M415 PolarHBondContact O-N 2.86Å; L411-M453 HydrophobicContact CB-SD 4.23Å; L411-M453 HydrophobicContact CD1-CB 4.45Å; L411-M453 HydrophobicContact CD1-SD 4.22Å; L411-M453 HydrophobicContact CD2-SD 3.94Å; L411-M453 HydrophobicContact CG-SD 4.35Å
412	D	94.1	Very high	90.5	Very high	75 Å²	75	54.4 Å²	54.4	40%	0.401	27%	0.267	S	S	.	.	H	α-helix	trans	-61	-43	175	-77.3	-28.5	0	0	0	112.2	E408 S409 M415 V416 K456	E408-D412 PolarHBondContact O-N 3.38Å; S409-D412 PolarHBondContact O-N 3.42Å; D412-M415 PolarHBondContact O-N 3.34Å; D412-V416 PolarHBondContact O-N 3.48Å; D412-K456 WeakPolarHBondContact OD1-CD 3.43Å; D412-K456 WeakPolarHBondContact OD1-CE 3.22Å; D412-K456 IonicContact OD1-NZ 2.75Å; D412-K456 PolarHBondContact OD1-NZ 3.43Å; D412-K456 IonicContact OD2-NZ 3.54Å
413	K	93.8	Very high	91.3	Very high	99 Å²	99	52.9 Å²	52.9	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-64.1	-41.7	174.5	-70	178.2	-175.9	-178.2	0	111.7	L345 S409 I410 L411 M415 V416	L345-K413 HydrophobicContact CD2-CB 3.94Å; L345-K413 WeakPolarHBondContact CD2-O 3.48Å; S409-K413 WeakPolarHBondContact O-CG 3.44Å; S409-K413 PolarHBondContact O-N 3.28Å; S409-K413 VanDerWaalsContact O-N 3.14Å; I410-K413 PolarHBondContact O-N 2.69Å; L411-K413 VanDerWaalsContact C-N 3.34Å; L411-K413 PolarHBondContact O-N 2.96Å; K413-M415 VanDerWaalsContact C-N 3.27Å; K413-M415 PolarHBondContact O-N 2.89Å; K413-V416 VanDerWaalsContact O-CB 3.31Å; K413-V416 WeakPolarHBondContact O-CB 3.35Å; K413-V416 PolarHBondContact O-N 3.2Å; K413-V416 VanDerWaalsContact O-N 3.12Å
414	A	95	Very high	91.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-36	175.2	0	0	0	0	0	112	L387 F390 I391 I410 L411 V416 L417 F418	L387-A414 HydrophobicContact CD1-CB 4.13Å; F390-A414 HydrophobicContact CE1-CB 4.38Å; I391-A414 HydrophobicContact CD1-CB 4.47Å; I391-A414 HydrophobicContact CG1-CB 4.3Å; I410-A414 WeakPolarHBondContact O-CB 3.27Å; I410-A414 PolarHBondContact O-N 2.89Å; L411-A414 WeakPolarHBondContact O-CB 3.43Å; L411-A414 PolarHBondContact O-N 3.36Å; A414-V416 VanDerWaalsContact C-N 3.28Å; A414-V416 PolarHBondContact O-N 3.19Å; A414-L417 PolarHBondContact O-N 3.38Å; A414-L417 VanDerWaalsContact O-N 3.13Å; A414-F418 PolarHBondContact O-N 2.91Å
415	M	95.4	Very high	92.4	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.039	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-24.7	175.6	-72.4	-56.2	-59.5	0	0	113.4	L411 D412 K413 F418 R419 M453 K456 L457 E460	L411-M415 VanDerWaalsContact O-CG 3.31Å; L411-M415 WeakPolarHBondContact O-CG 3.46Å; L411-M415 PolarHBondContact O-N 2.86Å; D412-M415 PolarHBondContact O-N 3.34Å; K413-M415 VanDerWaalsContact C-N 3.27Å; K413-M415 PolarHBondContact O-N 2.89Å; M415-F418 HydrophobicContact CE-CB 4.27Å; M415-F418 HydrophobicContact CE-CD1 3.46Å; M415-F418 VanDerWaalsContact CE-CD1 3.46Å; M415-F418 HydrophobicContact CE-CE1 4.06Å; M415-F418 HydrophobicContact CE-CG 4.07Å; M415-F418 PolarHBondContact O-N 3.24Å; M415-F418 HydrophobicContact SD-CB 4.19Å; M415-F418 HydrophobicContact SD-CD1 4.29Å; M415-F418 HydrophobicContact SD-CG 4.32Å; M415-R419 PolarHBondContact O-N 2.94Å; M415-R419 VanDerWaalsContact O-N 3.13Å; M415-R419 PolarHBondContact O-NE 3.35Å; M415-M453 HydrophobicContact CG-CE 4.26Å; M415-M453 HydrophobicContact SD-CE 3.39Å; M415-M453 WeakPolarHBondContact SD-CE 3.36Å; M415-M453 HydrophobicContact SD-SD 4.44Å; M415-K456 HydrophobicContact CE-CB 4.33Å; M415-K456 HydrophobicContact CG-CB 4.09Å; M415-K456 HydrophobicContact CG-CD 4.13Å; M415-K456 HydrophobicContact SD-CB 4.39Å; M415-L457 HydrophobicContact CE-CD2 4.03Å; M415-L457 HydrophobicContact SD-CD2 4Å; M415-E460 HydrophobicContact CE-CB 4.32Å; M415-E460 HydrophobicContact CE-CG 3.56Å
416	V	93.9	Very high	92.7	Very high	29 Å²	29	37.4 Å²	37.4	18%	0.176	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-45.6	168.9	180	0	0	0	0	110.4	D412 K413 A414 R419 F420	D412-V416 PolarHBondContact O-N 3.48Å; K413-V416 VanDerWaalsContact O-CB 3.31Å; K413-V416 WeakPolarHBondContact O-CB 3.35Å; K413-V416 PolarHBondContact O-N 3.2Å; K413-V416 VanDerWaalsContact O-N 3.12Å; A414-V416 VanDerWaalsContact C-N 3.28Å; A414-V416 PolarHBondContact O-N 3.19Å; V416-R419 VanDerWaalsContact CG2-NH2 3.34Å; V416-R419 WeakPolarHBondContact O-CB 3.28Å; V416-R419 PolarHBondContact O-N 2.99Å; V416-F420 HydrophobicContact CG1-CD2 4.49Å; V416-F420 HydrophobicContact CG1-CE2 3.71Å; V416-F420 HydrophobicContact CG1-CZ 4.08Å; V416-F420 WeakPolarHBondContact O-CD2 3.36Å
417	L	95.5	Very high	93.2	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-39	176.4	-62.9	-177.9	0	0	0	111.8	I341 L344 L345 F373 L377 A414 R419 F420 M421	I341-L417 HydrophobicContact CG2-CD1 4.06Å; L344-L417 HydrophobicContact CB-CD1 3.92Å; L344-L417 HydrophobicContact CB-CD2 4.37Å; L345-L417 HydrophobicContact CD2-CD1 3.46Å; L345-L417 VanDerWaalsContact CD2-CD1 3.46Å; L345-L417 HydrophobicContact CD2-CG 3.75Å; L345-L417 HydrophobicContact CG-CD1 3.87Å; F373-L417 HydrophobicContact CD1-CD2 4.14Å; F373-L417 HydrophobicContact CE1-CD2 4.41Å; L377-L417 VanDerWaalsContact CD2-O 3.22Å; L377-L417 WeakPolarHBondContact CD2-O 3.26Å; A414-L417 PolarHBondContact O-N 3.38Å; A414-L417 VanDerWaalsContact O-N 3.13Å; L417-R419 PolarHBondContact O-N 3.32Å; L417-F420 HydrophobicContact CD2-CD2 4.45Å; L417-F420 PolarHBondContact O-N 2.76Å; L417-F420 VanDerWaalsContact O-N 3.11Å; L417-M421 PolarHBondContact O-N 3.23Å
418	F	96	Very high	93.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.1	-39	174.6	178.6	-102.2	0	0	0	112.3	L387 A414 M415 F420 M421 K424 F427 L457 E460 C461 F465	L387-F418 HydrophobicContact CD2-CB 3.92Å; L387-F418 HydrophobicContact CD2-CD2 4.29Å; A414-F418 PolarHBondContact O-N 2.91Å; M415-F418 HydrophobicContact CE-CB 4.27Å; M415-F418 HydrophobicContact CE-CD1 3.46Å; M415-F418 VanDerWaalsContact CE-CD1 3.46Å; M415-F418 HydrophobicContact CE-CE1 4.06Å; M415-F418 HydrophobicContact CE-CG 4.07Å; M415-F418 PolarHBondContact O-N 3.24Å; M415-F418 HydrophobicContact SD-CB 4.19Å; M415-F418 HydrophobicContact SD-CD1 4.29Å; M415-F418 HydrophobicContact SD-CG 4.32Å; F418-F420 VanDerWaalsContact C-N 3.31Å; F418-F420 PolarHBondContact O-N 2.87Å; F418-M421 VanDerWaalsContact O-CB 3.25Å; F418-M421 WeakPolarHBondContact O-CB 3.36Å; F418-M421 PolarHBondContact O-N 2.82Å; F418-M421 VanDerWaalsContact O-N 3.11Å; F418-K424 HydrophobicContact CE1-CD 3.89Å; F418-K424 HydrophobicContact CE1-CG 4.44Å; F418-K424 HydrophobicContact CE2-CB 4.05Å; F418-K424 HydrophobicContact CE2-CD 4.29Å; F418-K424 HydrophobicContact CE2-CG 3.94Å; F418-K424 HydrophobicContact CZ-CB 3.96Å; F418-K424 HydrophobicContact CZ-CD 3.68Å; F418-K424 HydrophobicContact CZ-CG 3.83Å; F418-K424 WeakPolarHBondContact O-CE 3.29Å; F418-F427 AromaticContact CD2-CD1 3.97Å; F418-F427 HydrophobicContact CD2-CD1 3.97Å; F418-F427 HydrophobicContact CD2-CD2 4.41Å; F418-F427 HydrophobicContact CD2-CE1 4.12Å; F418-F427 HydrophobicContact CD2-CG 4.12Å; F418-F427 HydrophobicContact CD2-CZ 4.42Å; F418-F427 HydrophobicContact CE2-CB 4.32Å; F418-F427 AromaticContact CE2-CD1 3.43Å; F418-F427 HydrophobicContact CE2-CD1 3.43Å; F418-F427 VanDerWaalsContact CE2-CD1 3.43Å; F418-F427 AromaticContact CE2-CE1 3.83Å; F418-F427 HydrophobicContact CE2-CE1 3.83Å; F418-F427 AromaticContact CE2-CG 3.87Å; F418-F427 HydrophobicContact CE2-CG 3.87Å; F418-F427 HydrophobicContact CZ-CD1 4.4Å; F418-L457 HydrophobicContact CD1-CD2 4.47Å; F418-L457 HydrophobicContact CE1-CD2 4.1Å; F418-L457 HydrophobicContact CE2-CD2 4.19Å; F418-L457 HydrophobicContact CZ-CD2 3.93Å; F418-E460 HydrophobicContact CD1-CB 4.37Å; F418-E460 HydrophobicContact CD1-CG 4.43Å; F418-E460 HydrophobicContact CE1-CB 3.98Å; F418-C461 VanDerWaalsContact CE1-SG 3.57Å; F418-C461 VanDerWaalsContact CZ-SG 3.57Å; F418-F465 HydrophobicContact CZ-CZ 4.24Å
419	R	94.4	Very high	93.7	Very high	120 Å²	120	32.5 Å²	32.5	45%	0.453	15%	0.154	S	C	.	.	H	α-helix	trans	-61.7	-37.2	177.2	-82.6	-178.5	-83.4	152.6	-11.9	113.2	M415 V416 L417 M421 K424 E460	M415-R419 PolarHBondContact O-N 2.94Å; M415-R419 VanDerWaalsContact O-N 3.13Å; M415-R419 PolarHBondContact O-NE 3.35Å; V416-R419 VanDerWaalsContact CG2-NH2 3.34Å; V416-R419 WeakPolarHBondContact O-CB 3.28Å; V416-R419 PolarHBondContact O-N 2.99Å; L417-R419 PolarHBondContact O-N 3.32Å; R419-M421 PolarHBondContact O-N 3.15Å; R419-K424 PolarHBondContact O-NZ 3Å; R419-E460 WeakPolarHBondContact CD-OE1 3.41Å; R419-E460 VanDerWaalsContact CD-OE2 3.28Å; R419-E460 WeakPolarHBondContact CD-OE2 3.5Å; R419-E460 HydrophobicContact CG-CG 4.35Å; R419-E460 WeakPolarHBondContact CG-OE2 3.48Å; R419-E460 IonicContact NE-OE1 3.64Å
420	F	94.5	Very high	93.7	Very high	26 Å²	26	30.3 Å²	30.3	11%	0.114	14%	0.137	C	C	.	.	H	α-helix	trans	-75.4	-9.2	177.1	-59.1	-40.4	0	0	0	113.6	A370 F373 E374 L377 N378 V416 L417 F418	A370-F420 HydrophobicContact CB-CE1 3.82Å; A370-F420 HydrophobicContact CB-CZ 4.17Å; F373-F420 HydrophobicContact CB-CD2 3.59Å; F373-F420 HydrophobicContact CB-CE2 3.69Å; F373-F420 HydrophobicContact CB-CG 4.11Å; F373-F420 HydrophobicContact CB-CZ 4.32Å; F373-F420 HydrophobicContact CD1-CD2 4.44Å; F373-F420 HydrophobicContact CD1-CE2 4.45Å; F373-F420 HydrophobicContact CG-CD2 4.29Å; F373-F420 HydrophobicContact CG-CE2 4.12Å; E374-F420 HydrophobicContact CB-CB 4.31Å; E374-F420 HydrophobicContact CB-CD1 4.47Å; L377-F420 HydrophobicContact CD2-CB 3.89Å; N378-F420 PolarHBondContact ND2-O 3.37Å; V416-F420 HydrophobicContact CG1-CD2 4.49Å; V416-F420 HydrophobicContact CG1-CE2 3.71Å; V416-F420 HydrophobicContact CG1-CZ 4.08Å; V416-F420 WeakPolarHBondContact O-CD2 3.36Å; L417-F420 HydrophobicContact CD2-CD2 4.45Å; L417-F420 PolarHBondContact O-N 2.76Å; L417-F420 VanDerWaalsContact O-N 3.11Å; F418-F420 VanDerWaalsContact C-N 3.31Å; F418-F420 PolarHBondContact O-N 2.87Å
421	M	93.8	Very high	93.9	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.01	13%	0.129	C	C	.	.			trans	-79.7	134.6	179.8	-167.8	172.6	-70.6	0	0	111.5	L377 P384 L387 L417 F418 R419 K424 F427	L377-M421 HydrophobicContact CD2-CB 4.28Å; P384-M421 HydrophobicContact CB-CE 4.29Å; P384-M421 HydrophobicContact CB-SD 3.68Å; P384-M421 HydrophobicContact CG-CE 4.3Å; P384-M421 HydrophobicContact CG-CG 4.38Å; P384-M421 HydrophobicContact CG-SD 3.7Å; L387-M421 HydrophobicContact CB-CE 4.07Å; L387-M421 HydrophobicContact CD2-CE 3.64Å; L417-M421 PolarHBondContact O-N 3.23Å; F418-M421 VanDerWaalsContact O-CB 3.25Å; F418-M421 WeakPolarHBondContact O-CB 3.36Å; F418-M421 PolarHBondContact O-N 2.82Å; F418-M421 VanDerWaalsContact O-N 3.11Å; R419-M421 PolarHBondContact O-N 3.15Å; M421-K424 PolarHBondContact O-NZ 3.12Å; M421-F427 HydrophobicContact SD-CB 3.98Å
422	Q	92.1	Very high	93.9	Very high	70 Å²	70	29.9 Å²	29.9	33%	0.327	13%	0.134	S	C	.	.	S	Bend	trans	-85.4	-43.3	175.1	-71	177.2	8	0	0	111.8	N378 K424 F767	N378-Q422 PolarHBondContact OD1-N 3.28Å; Q422-K424 PolarHBondContact O-N 3.08Å; Q422-K424 VanDerWaalsContact O-N 3.15Å; Q422-F767 WeakPolarHBondContact O-CA 3.32Å
423	E	92.7	Very high	93.6	Very high	39 Å²	39	29.3 Å²	29.3	18%	0.182	13%	0.128	C	C	.	.			trans	-89.6	64	-177.3	-56.6	-158.1	109.4	0	0	112.9	P384 D425 V426 F427 R725 R732	P384-E423 HydrophobicContact CG-CB 4.31Å; E423-D425 VanDerWaalsContact C-N 3.29Å; E423-D425 PolarHBondContact O-N 3.33Å; E423-V426 HydrophobicContact CB-CB 4.17Å; E423-V426 HydrophobicContact CB-CG2 3.9Å; E423-V426 PolarHBondContact O-N 2.86Å; E423-F427 PolarHBondContact O-N 2.78Å; E423-R725 VanDerWaalsContact CD-NH2 3.27Å; E423-R725 IonicContact OE1-CZ 2.66Å; E423-R725 IonicContact OE1-NH1 2.9Å; E423-R725 IonicContact OE1-NH2 3.9Å; E423-R725 PolarHBondContact OE1-NH2 2.78Å; E423-R725 IonicContact OE2-CZ 2.72Å; E423-R725 VanDerWaalsContact OE2-CZ 3.27Å; E423-R725 IonicContact OE2-NH1 2.75Å; E423-R725 PolarHBondContact OE2-NH1 2.75Å; E423-R725 IonicContact OE2-NH2 2.8Å; E423-R725 PolarHBondContact OE2-NH2 3.48Å; E423-R732 IonicContact OE1-CZ 3.7Å; E423-R732 IonicContact OE1-NH1 2.76Å; E423-R732 PolarHBondContact OE1-NH1 2.99Å; E423-R732 IonicContact OE1-NH2 3.64Å; E423-R732 PolarHBondContact OE1-NH2 3.27Å
424	K	95.1	Very high	93.4	Very high	24 Å²	24	24.9 Å²	24.9	10%	0.104	11%	0.109	C	C	.	.	H	α-helix	trans	-69.7	-25.5	-177.4	-62.4	-179.4	171.5	75.4	0	113.2	F418 R419 M421 Q422 F427 E428 F465 A765 R766	F418-K424 HydrophobicContact CE1-CD 3.89Å; F418-K424 HydrophobicContact CE1-CG 4.44Å; F418-K424 HydrophobicContact CE2-CB 4.05Å; F418-K424 HydrophobicContact CE2-CD 4.29Å; F418-K424 HydrophobicContact CE2-CG 3.94Å; F418-K424 HydrophobicContact CZ-CB 3.96Å; F418-K424 HydrophobicContact CZ-CD 3.68Å; F418-K424 HydrophobicContact CZ-CG 3.83Å; F418-K424 WeakPolarHBondContact O-CE 3.29Å; R419-K424 PolarHBondContact O-NZ 3Å; M421-K424 PolarHBondContact O-NZ 3.12Å; Q422-K424 PolarHBondContact O-N 3.08Å; Q422-K424 VanDerWaalsContact O-N 3.15Å; K424-F427 WeakPolarHBondContact O-CB 3.32Å; K424-F427 PolarHBondContact O-N 3.4Å; K424-E428 PolarHBondContact O-N 3.42Å; K424-F465 HydrophobicContact CB-CE2 4.45Å; K424-A765 WeakPolarHBondContact CD-O 3.45Å; K424-R766 WeakPolarHBondContact CA-O 3.44Å; K424-R766 WeakPolarHBondContact CB-O 3.28Å; K424-R766 PolarHBondContact N-O 3.24Å
425	D	93.2	Very high	93.1	Very high	10 Å²	10	24.9 Å²	24.9	5%	0.053	11%	0.109	C	C	.	.	H	α-helix	trans	-68.4	-35.9	173.5	61	-21.2	0	0	0	113.3	E423 F427 E428 R429 V728 R732 R766 F767	E423-D425 VanDerWaalsContact C-N 3.29Å; E423-D425 PolarHBondContact O-N 3.33Å; D425-F427 VanDerWaalsContact C-N 3.35Å; D425-E428 WeakPolarHBondContact O-CB 3.37Å; D425-E428 PolarHBondContact O-N 3.36Å; D425-R429 PolarHBondContact O-N 3.14Å; D425-R429 VanDerWaalsContact O-N 3.17Å; D425-V728 WeakPolarHBondContact OD2-CG1 3.4Å; D425-R732 IonicContact OD1-CZ 2.9Å; D425-R732 IonicContact OD1-NE 2.72Å; D425-R732 IonicContact OD1-NH2 3.9Å; D425-R732 PolarHBondContact OD1-NH2 2.81Å; D425-R732 WeakPolarHBondContact OD2-CG 3.48Å; D425-R732 IonicContact OD2-CZ 3.74Å; D425-R732 IonicContact OD2-NE 2.76Å; D425-R732 PolarHBondContact OD2-NE 3.49Å; D425-R732 IonicContact OD2-NH2 2.68Å; D425-R732 PolarHBondContact OD2-NH2 2.98Å; D425-R766 PolarHBondContact N-O 2.89Å; D425-F767 WeakPolarHBondContact OD2-CD1 3.38Å
426	V	94.1	Very high	92.8	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-64.3	-43.9	170.8	-179.6	0	0	0	0	109.7	P384 E423 R429 Y430 V728	P384-V426 HydrophobicContact CB-CB 4.1Å; P384-V426 HydrophobicContact CB-CG1 3.91Å; P384-V426 HydrophobicContact CG-CB 4.3Å; P384-V426 HydrophobicContact CG-CG1 4.23Å; E423-V426 HydrophobicContact CB-CB 4.17Å; E423-V426 HydrophobicContact CB-CG2 3.9Å; E423-V426 PolarHBondContact O-N 2.86Å; V426-R429 PolarHBondContact O-N 3.39Å; V426-Y430 HydrophobicContact CG1-CD2 3.98Å; V426-Y430 HydrophobicContact CG1-CE2 3.61Å; V426-Y430 WeakPolarHBondContact O-CD2 3.43Å; V426-Y430 PolarHBondContact O-N 2.74Å; V426-V728 HydrophobicContact CG2-CG1 3.93Å
427	F	95.6	Very high	92.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.5	-47.4	172.7	170.7	-87	0	0	0	111.7	P384 L387 I391 F418 M421 E423 K424 D425 R429 Y430 Y431 L457	P384-F427 HydrophobicContact CB-CB 4Å; P384-F427 WeakPolarHBondContact O-CD2 3.41Å; L387-F427 HydrophobicContact CB-CD2 4.26Å; L387-F427 HydrophobicContact CB-CE2 4.23Å; L387-F427 HydrophobicContact CD2-CD2 4.24Å; L387-F427 HydrophobicContact CD2-CE2 4.12Å; L387-F427 HydrophobicContact CG-CD2 4.28Å; L387-F427 HydrophobicContact CG-CE2 3.91Å; I391-F427 HydrophobicContact CD1-CE2 3.92Å; I391-F427 HydrophobicContact CD1-CZ 3.82Å; F418-F427 AromaticContact CD2-CD1 3.97Å; F418-F427 HydrophobicContact CD2-CD1 3.97Å; F418-F427 HydrophobicContact CD2-CD2 4.41Å; F418-F427 HydrophobicContact CD2-CE1 4.12Å; F418-F427 HydrophobicContact CD2-CG 4.12Å; F418-F427 HydrophobicContact CD2-CZ 4.42Å; F418-F427 HydrophobicContact CE2-CB 4.32Å; F418-F427 AromaticContact CE2-CD1 3.43Å; F418-F427 HydrophobicContact CE2-CD1 3.43Å; F418-F427 VanDerWaalsContact CE2-CD1 3.43Å; F418-F427 AromaticContact CE2-CE1 3.83Å; F418-F427 HydrophobicContact CE2-CE1 3.83Å; F418-F427 AromaticContact CE2-CG 3.87Å; F418-F427 HydrophobicContact CE2-CG 3.87Å; F418-F427 HydrophobicContact CZ-CD1 4.4Å; M421-F427 HydrophobicContact SD-CB 3.98Å; E423-F427 PolarHBondContact O-N 2.78Å; K424-F427 WeakPolarHBondContact O-CB 3.32Å; K424-F427 PolarHBondContact O-N 3.4Å; D425-F427 VanDerWaalsContact C-N 3.35Å; F427-R429 PolarHBondContact O-N 3.39Å; F427-Y430 PolarHBondContact O-N 2.87Å; F427-Y431 HydrophobicContact CE1-CD2 4.14Å; F427-Y431 HydrophobicContact CE1-CG 4.04Å; F427-Y431 AromaticContact CZ-CD2 3.75Å; F427-Y431 HydrophobicContact CZ-CD2 3.75Å; F427-Y431 HydrophobicContact CZ-CG 4.12Å; F427-Y431 VanDerWaalsContact O-CB 3.3Å; F427-Y431 WeakPolarHBondContact O-CB 3.31Å; F427-Y431 PolarHBondContact O-N 2.94Å; F427-L457 HydrophobicContact CE1-CD1 4.35Å; F427-L457 HydrophobicContact CE1-CD2 3.78Å; F427-L457 HydrophobicContact CZ-CD2 4.42Å
428	E	94	Very high	91.8	Very high	16 Å²	16	28.3 Å²	28.3	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-50.9	-45.7	179.6	-166.5	-164.6	145.6	0	0	111	K424 D425 Y431 K432 F465 R766	K424-E428 PolarHBondContact O-N 3.42Å; D425-E428 WeakPolarHBondContact O-CB 3.37Å; D425-E428 PolarHBondContact O-N 3.36Å; E428-Y431 PolarHBondContact O-N 3.11Å; E428-K432 WeakPolarHBondContact O-CB 3.42Å; E428-K432 PolarHBondContact O-N 3.34Å; E428-F465 HydrophobicContact CB-CE1 4.31Å; E428-F465 HydrophobicContact CB-CE2 3.63Å; E428-F465 HydrophobicContact CB-CZ 3.48Å; E428-F465 VanDerWaalsContact CB-CZ 3.48Å; E428-F465 HydrophobicContact CG-CD2 4.24Å; E428-F465 HydrophobicContact CG-CE1 4.03Å; E428-F465 HydrophobicContact CG-CE2 3.75Å; E428-F465 HydrophobicContact CG-CZ 3.63Å; E428-F465 WeakPolarHBondContact OE2-CD2 3.32Å; E428-F465 WeakPolarHBondContact OE2-CE2 3.47Å; E428-R766 IonicContact OE2-CZ 3.24Å; E428-R766 IonicContact OE2-NH2 2.94Å; E428-R766 PolarHBondContact OE2-NH2 3.34Å
429	R	91.2	Very high	91.3	Very high	64 Å²	64	29.1 Å²	29.1	24%	0.242	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-50.4	-178.6	-172.9	170	-170.6	112.5	15.6	112.6	D425 V426 F427 K432 Q433 T724 K727 V728 D731	D425-R429 PolarHBondContact O-N 3.14Å; D425-R429 VanDerWaalsContact O-N 3.17Å; V426-R429 PolarHBondContact O-N 3.39Å; F427-R429 PolarHBondContact O-N 3.39Å; R429-K432 PolarHBondContact O-N 3.32Å; R429-Q433 PolarHBondContact O-N 3.11Å; R429-Q433 VanDerWaalsContact O-N 3.13Å; R429-T724 HydrophobicContact CG-CG2 4.09Å; R429-K727 VanDerWaalsContact NH2-CB 3.25Å; R429-V728 HydrophobicContact CB-CG2 4.28Å; R429-V728 HydrophobicContact CG-CG2 4.44Å; R429-D731 IonicContact NH1-OD2 3.79Å; R429-D731 PolarHBondContact NH1-OD2 3.44Å
430	Y	91.8	Very high	90.7	Very high	13 Å²	13	25.1 Å²	25.1	5%	0.051	11%	0.111	C	C	.	.	H	α-helix	trans	-62.9	-44.3	176.4	-72.5	-62.3	0	0	0	111.2	E385 V426 F427 K432 Q433 H434 E716 T724	E385-Y430 HydrophobicContact CB-CD2 3.82Å; E385-Y430 HydrophobicContact CB-CE1 4.37Å; E385-Y430 HydrophobicContact CB-CE2 3.65Å; E385-Y430 HydrophobicContact CB-CG 4.26Å; E385-Y430 HydrophobicContact CG-CD1 4.09Å; E385-Y430 HydrophobicContact CG-CD2 4.28Å; E385-Y430 HydrophobicContact CG-CE1 3.95Å; E385-Y430 HydrophobicContact CG-CE2 4.15Å; E385-Y430 HydrophobicContact CG-CG 4.26Å; V426-Y430 HydrophobicContact CG1-CD2 3.98Å; V426-Y430 HydrophobicContact CG1-CE2 3.61Å; V426-Y430 WeakPolarHBondContact O-CD2 3.43Å; V426-Y430 PolarHBondContact O-N 2.74Å; F427-Y430 PolarHBondContact O-N 2.87Å; Y430-K432 VanDerWaalsContact C-N 3.35Å; Y430-K432 PolarHBondContact O-N 2.7Å; Y430-Q433 PolarHBondContact O-N 2.97Å; Y430-H434 PolarHBondContact O-N 3.05Å; Y430-H434 PolarHBondContact O-ND1 2.99Å; Y430-E716 HydrophobicContact CE1-CG 4.15Å; Y430-E716 WeakPolarHBondContact CE1-OE2 3.3Å; Y430-T724 HydrophobicContact CD1-CG2 4.47Å; Y430-T724 HydrophobicContact CE1-CG2 3.85Å; Y430-T724 HydrophobicContact CE2-CG2 4.46Å
431	Y	94.3	Very high	89.8	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-44.6	178.3	-173.4	-92.7	0	0	0	111.7	S388 I391 F427 E428 Q433 H434 L435 M453 L457 L469	S388-Y431 WeakPolarHBondContact OG-CA 3.3Å; S388-Y431 PolarHBondContact OG-N 3.42Å; I391-Y431 HydrophobicContact CG2-CE2 3.82Å; F427-Y431 HydrophobicContact CE1-CD2 4.14Å; F427-Y431 HydrophobicContact CE1-CG 4.04Å; F427-Y431 AromaticContact CZ-CD2 3.75Å; F427-Y431 HydrophobicContact CZ-CD2 3.75Å; F427-Y431 HydrophobicContact CZ-CG 4.12Å; F427-Y431 VanDerWaalsContact O-CB 3.3Å; F427-Y431 WeakPolarHBondContact O-CB 3.31Å; F427-Y431 PolarHBondContact O-N 2.94Å; E428-Y431 PolarHBondContact O-N 3.11Å; Y431-Q433 VanDerWaalsContact C-N 3.33Å; Y431-Q433 PolarHBondContact O-N 2.97Å; Y431-H434 PolarHBondContact O-N 3.3Å; Y431-L435 HydrophobicContact CE1-CB 4.42Å; Y431-L435 HydrophobicContact CE1-CD2 4.33Å; Y431-L435 WeakPolarHBondContact O-CB 3.27Å; Y431-L435 PolarHBondContact O-N 3.13Å; Y431-M453 HydrophobicContact CE2-CG 4.25Å; Y431-M453 VanDerWaalsContact OH-CG 3.25Å; Y431-M453 WeakPolarHBondContact OH-CG 3.44Å; Y431-L457 HydrophobicContact CD1-CD1 4.12Å; Y431-L457 HydrophobicContact CE1-CD1 3.9Å; Y431-L469 HydrophobicContact CD1-CD1 3.93Å; Y431-L469 HydrophobicContact CD1-CD2 4.26Å; Y431-L469 HydrophobicContact CE1-CD1 4.03Å
432	K	91.2	Very high	88.9	Confident	27 Å²	27	32 Å²	32	12%	0.117	15%	0.152	C	C	.	.	H	α-helix	trans	-58.8	-42.1	175.8	175.9	172.5	155.9	166.6	0	112.1	E428 R429 Y430 A436 L469 M472 G510 Y511 W512 P513	E428-K432 WeakPolarHBondContact O-CB 3.42Å; E428-K432 PolarHBondContact O-N 3.34Å; R429-K432 PolarHBondContact O-N 3.32Å; Y430-K432 VanDerWaalsContact C-N 3.35Å; Y430-K432 PolarHBondContact O-N 2.7Å; K432-A436 VanDerWaalsContact O-CB 3.3Å; K432-A436 WeakPolarHBondContact O-CB 3.22Å; K432-A436 PolarHBondContact O-N 2.99Å; K432-L469 HydrophobicContact CB-CD2 3.84Å; K432-L469 HydrophobicContact CG-CD2 4.16Å; K432-M472 HydrophobicContact CG-SD 4.03Å; K432-G510 PolarHBondContact NZ-O 3.19Å; K432-Y511 WeakPolarHBondContact CE-O 3.44Å; K432-Y511 PolarHBondContact NZ-O 2.93Å; K432-W512 VanDerWaalsContact CE-C 3.48Å; K432-P513 HydrophobicContact CG-CG 4.41Å
433	Q	87.8	Confident	88.1	Confident	62 Å²	62	33.5 Å²	33.5	29%	0.29	16%	0.157	S	C	.	.	H	α-helix	trans	-65.9	-43.2	176.8	-176.3	172.4	-12.1	0	0	112.5	R429 Y430 Y431 A436 R437 E716	R429-Q433 PolarHBondContact O-N 3.11Å; R429-Q433 VanDerWaalsContact O-N 3.13Å; Y430-Q433 PolarHBondContact O-N 2.97Å; Y431-Q433 VanDerWaalsContact C-N 3.33Å; Y431-Q433 PolarHBondContact O-N 2.97Å; Q433-A436 PolarHBondContact O-N 2.76Å; Q433-R437 PolarHBondContact O-N 3.02Å; Q433-R437 VanDerWaalsContact O-N 3.11Å; Q433-E716 VanDerWaalsContact CD-OE1 3.29Å; Q433-E716 PolarHBondContact NE2-OE1 3.25Å; Q433-E716 PolarHBondContact OE1-OE1 3.28Å
434	H	88.9	Confident	87.4	Confident	7 Å²	7	31.8 Å²	31.8	3%	0.032	15%	0.149	C	C	.	.	H	α-helix	trans	-65.2	-46.3	176.6	-63.2	161.4	0	0	0	111.7	S388 L389 D392 Y430 Y431 A436 R437 R438	S388-H434 PolarHBondContact OG-ND1 3.37Å; L389-H434 WeakPolarHBondContact CD2-CE1 3.49Å; D392-H434 HydrophobicContact CB-CB 4.01Å; Y430-H434 PolarHBondContact O-N 3.05Å; Y430-H434 PolarHBondContact O-ND1 2.99Å; Y431-H434 PolarHBondContact O-N 3.3Å; H434-A436 PolarHBondContact O-N 3.3Å; H434-R437 PolarHBondContact CD2-NH2 3.2Å; H434-R437 PolarHBondContact O-N 2.62Å; H434-R438 WeakPolarHBondContact O-CG 3.46Å; H434-R438 PolarHBondContact O-N 3.1Å
435	L	90.5	Very high	86.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-46.8	175.2	179.6	64.4	0	0	0	111.4	Y431 R437 R438 L439 E450 I454 L469 M472 F473	Y431-L435 HydrophobicContact CE1-CB 4.42Å; Y431-L435 HydrophobicContact CE1-CD2 4.33Å; Y431-L435 WeakPolarHBondContact O-CB 3.27Å; Y431-L435 PolarHBondContact O-N 3.13Å; L435-R437 VanDerWaalsContact C-N 3.29Å; L435-R437 PolarHBondContact O-N 2.65Å; L435-R438 PolarHBondContact O-N 3.03Å; L435-R438 VanDerWaalsContact O-N 3.12Å; L435-L439 HydrophobicContact CD1-CD1 4.09Å; L435-L439 HydrophobicContact CD1-CD2 4.44Å; L435-L439 HydrophobicContact CD1-CG 4Å; L435-L439 HydrophobicContact CD2-CD1 4.5Å; L435-L439 HydrophobicContact CG-CD1 3.96Å; L435-L439 HydrophobicContact CG-CG 4.25Å; L435-L439 WeakPolarHBondContact O-CG 3.42Å; L435-L439 PolarHBondContact O-N 2.91Å; L435-E450 WeakPolarHBondContact CD1-OE2 3.46Å; L435-I454 HydrophobicContact CD2-CD1 4.18Å; L435-L469 HydrophobicContact CD2-CB 4.17Å; L435-L469 HydrophobicContact CD2-CD2 3.91Å; L435-M472 HydrophobicContact CB-CE 4.3Å; L435-M472 HydrophobicContact CD2-CE 4.07Å; L435-M472 HydrophobicContact CD2-SD 4.4Å; L435-M472 HydrophobicContact CG-CE 3.99Å; L435-F473 HydrophobicContact CD1-CE2 3.99Å; L435-F473 HydrophobicContact CD1-CZ 4.28Å; L435-F473 HydrophobicContact CD2-CE2 4.23Å
436	A	87.3	Confident	86	Confident	4 Å²	4	34.3 Å²	34.3	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-56.9	-45.3	178.6	0	0	0	0	0	111.6	K432 Q433 H434 L439 L440 M472 W512 P513	K432-A436 VanDerWaalsContact O-CB 3.3Å; K432-A436 WeakPolarHBondContact O-CB 3.22Å; K432-A436 PolarHBondContact O-N 2.99Å; Q433-A436 PolarHBondContact O-N 2.76Å; H434-A436 PolarHBondContact O-N 3.3Å; A436-L439 PolarHBondContact O-N 2.96Å; A436-L440 WeakPolarHBondContact O-CB 3.32Å; A436-L440 VanDerWaalsContact O-CG 3.24Å; A436-L440 WeakPolarHBondContact O-CG 3.49Å; A436-L440 PolarHBondContact O-N 3.42Å; A436-M472 VanDerWaalsContact CA-CE 3.46Å; A436-M472 HydrophobicContact CB-CE 3.59Å; A436-W512 HydrophobicContact CB-CE3 3.85Å; A436-W512 HydrophobicContact CB-CZ3 4Å; A436-P513 HydrophobicContact CB-CG 3.55Å
437	R	83.1	Confident	85.6	Confident	105 Å²	105	38.3 Å²	38.3	40%	0.396	19%	0.189	S	C	.	.	H	α-helix	trans	-61.8	-44.5	176.4	-178.3	174.6	61.8	-143.6	0.9	111.6	D392 Q433 H434 L435 T441	D392-R437 IonicContact OD2-NH2 2.76Å; D392-R437 PolarHBondContact OD2-NH2 3.42Å; Q433-R437 PolarHBondContact O-N 3.02Å; Q433-R437 VanDerWaalsContact O-N 3.11Å; H434-R437 PolarHBondContact CD2-NH2 3.2Å; H434-R437 PolarHBondContact O-N 2.62Å; L435-R437 VanDerWaalsContact C-N 3.29Å; L435-R437 PolarHBondContact O-N 2.65Å; R437-T441 WeakPolarHBondContact O-CB 3.43Å; R437-T441 WeakPolarHBondContact O-CG2 3.39Å; R437-T441 PolarHBondContact O-N 2.87Å; R437-T441 VanDerWaalsContact O-N 3.12Å; R437-T441 PolarHBondContact O-OG1 2.76Å
438	R	86.5	Confident	85.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-44.6	179.4	-68.1	-166.8	-55.7	-88.4	5.8	112.2	D392 K396 H434 L435 N442 K443 S444 E450	D392-R438 VanDerWaalsContact OD1-CD 3.26Å; D392-R438 WeakPolarHBondContact OD1-CD 3.39Å; D392-R438 WeakPolarHBondContact OD1-CG 3.38Å; D392-R438 IonicContact OD1-CZ 2.87Å; D392-R438 IonicContact OD1-NE 3.51Å; D392-R438 IonicContact OD1-NH1 2.82Å; D392-R438 PolarHBondContact OD1-NH1 3.21Å; K396-R438 HydrophobicContact CG-CG 4.49Å; H434-R438 WeakPolarHBondContact O-CG 3.46Å; H434-R438 PolarHBondContact O-N 3.1Å; L435-R438 PolarHBondContact O-N 3.03Å; L435-R438 VanDerWaalsContact O-N 3.12Å; R438-N442 WeakPolarHBondContact O-CA 3.48Å; R438-N442 PolarHBondContact O-N 3.49Å; R438-K443 PolarHBondContact O-N 2.95Å; R438-S444 WeakPolarHBondContact CB-OG 3.46Å; R438-E450 IonicContact CZ-OE1 3.73Å; R438-E450 IonicContact CZ-OE2 2.81Å; R438-E450 IonicContact NE-OE1 3.07Å; R438-E450 PolarHBondContact NE-OE1 3.41Å; R438-E450 IonicContact NE-OE2 3.02Å; R438-E450 IonicContact NH2-OE1 3.23Å; R438-E450 PolarHBondContact NH2-OE1 3.09Å; R438-E450 IonicContact NH2-OE2 3.87Å; R438-E450 PolarHBondContact NH2-OE2 2.75Å
439	L	85.4	Confident	85	Confident	17 Å²	17	43.8 Å²	43.8	9%	0.089	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-48.4	178.4	-68.7	179.9	0	0	0	112.3	L435 A436 T441 N442 M472 F473 M476 W512	L435-L439 HydrophobicContact CD1-CD1 4.09Å; L435-L439 HydrophobicContact CD1-CD2 4.44Å; L435-L439 HydrophobicContact CD1-CG 4Å; L435-L439 HydrophobicContact CD2-CD1 4.5Å; L435-L439 HydrophobicContact CG-CD1 3.96Å; L435-L439 HydrophobicContact CG-CG 4.25Å; L435-L439 WeakPolarHBondContact O-CG 3.42Å; L435-L439 PolarHBondContact O-N 2.91Å; A436-L439 PolarHBondContact O-N 2.96Å; L439-T441 VanDerWaalsContact C-N 3.33Å; L439-T441 PolarHBondContact O-N 3.1Å; L439-N442 PolarHBondContact O-N 2.83Å; L439-M472 HydrophobicContact CD1-CB 4.12Å; L439-M472 HydrophobicContact CD1-CE 4.21Å; L439-F473 HydrophobicContact CD1-CD2 4.45Å; L439-F473 HydrophobicContact CD1-CE2 4.28Å; L439-F473 HydrophobicContact CD1-CZ 4.43Å; L439-F473 HydrophobicContact CD2-CD1 4.4Å; L439-F473 HydrophobicContact CD2-CE1 3.74Å; L439-F473 HydrophobicContact CD2-CE2 4.36Å; L439-F473 HydrophobicContact CD2-CZ 3.71Å; L439-M476 HydrophobicContact CB-CG 4.31Å; L439-M476 HydrophobicContact CB-SD 4.5Å; L439-M476 HydrophobicContact CD1-CG 4.31Å; L439-W512 HydrophobicContact CB-CH2 4.18Å; L439-W512 HydrophobicContact CB-CZ3 4.44Å; L439-W512 HydrophobicContact CD1-CH2 3.99Å
440	L	81.6	Confident	85	Confident	36 Å²	36	40.7 Å²	40.7	19%	0.188	21%	0.209	C	C	.	.	H	α-helix	trans	-70.7	-30.1	-176.4	-66.3	171.9	0	0	0	113.2	A436 M476 R505 L507 W512 M553	A436-L440 WeakPolarHBondContact O-CB 3.32Å; A436-L440 VanDerWaalsContact O-CG 3.24Å; A436-L440 WeakPolarHBondContact O-CG 3.49Å; A436-L440 PolarHBondContact O-N 3.42Å; L440-M476 HydrophobicContact CD2-CE 4.19Å; L440-M476 HydrophobicContact CD2-SD 4.44Å; L440-R505 PolarHBondContact O-NH1 3.38Å; L440-L507 HydrophobicContact CD2-CD1 4.08Å; L440-L507 HydrophobicContact CD2-CD2 4.29Å; L440-W512 HydrophobicContact CD1-CE3 4.24Å; L440-W512 HydrophobicContact CD1-CZ3 4.02Å; L440-W512 HydrophobicContact CD2-CH2 4.23Å; L440-W512 HydrophobicContact CD2-CZ3 3.95Å; L440-W512 HydrophobicContact CG-CE3 4.44Å; L440-W512 HydrophobicContact CG-CH2 4.4Å; L440-W512 HydrophobicContact CG-CZ3 3.74Å; L440-M553 HydrophobicContact CD1-CE 3.27Å
441	T	75.6	Confident	85.1	Confident	73 Å²	73	45.4 Å²	45.4	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-91.7	-0.8	177.1	63	0	0	0	0	113.5	R437 L439 K443	R437-T441 WeakPolarHBondContact O-CB 3.43Å; R437-T441 WeakPolarHBondContact O-CG2 3.39Å; R437-T441 PolarHBondContact O-N 2.87Å; R437-T441 VanDerWaalsContact O-N 3.12Å; R437-T441 PolarHBondContact O-OG1 2.76Å; L439-T441 VanDerWaalsContact C-N 3.33Å; L439-T441 PolarHBondContact O-N 3.1Å; T441-K443 PolarHBondContact O-N 3.23Å; T441-K443 WeakPolarHBondContact OG1-CG 3.48Å
442	N	75.6	Confident	85	Confident	99 Å²	99	48 Å²	48	53%	0.529	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	41.2	-175.8	-163	2.8	0	0	0	113.4	K397 R438 L439	K397-N442 PolarHBondContact NZ-O 3.33Å; K397-N442 PolarHBondContact NZ-OD1 2.98Å; R438-N442 WeakPolarHBondContact O-CA 3.48Å; R438-N442 PolarHBondContact O-N 3.49Å; L439-N442 PolarHBondContact O-N 2.83Å
443	K	75.2	Confident	85.1	Confident	101 Å²	101	46.7 Å²	46.7	44%	0.439	24%	0.238	S	C	.	.			trans	-103.1	5.1	-176.7	-72.9	-172.4	178.6	-173.8	0	114.2	K396 K397 R438 T441	K396-K443 CarbonylContact C-O 3.55Å; K396-K443 WeakPolarHBondContact CA-O 3.43Å; K397-K443 PolarHBondContact N-O 3.45Å; R438-K443 PolarHBondContact O-N 2.95Å; T441-K443 PolarHBondContact O-N 3.23Å; T441-K443 WeakPolarHBondContact OG1-CG 3.48Å
444	S	77.9	Confident	85.5	Confident	3 Å²	3	44 Å²	44	2%	0.021	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-68.6	137.8	174.6	-64.8	0	0	0	0	111.4	L395 K397 R438 E450	L395-S444 WeakPolarHBondContact O-CA 3.36Å; K397-S444 VanDerWaalsContact CD-O 3.32Å; K397-S444 WeakPolarHBondContact CD-O 3.49Å; K397-S444 WeakPolarHBondContact CE-O 3.4Å; K397-S444 VanDerWaalsContact CG-O 3.24Å; K397-S444 WeakPolarHBondContact CG-O 3.38Å; K397-S444 PolarHBondContact NZ-O 3.41Å; R438-S444 WeakPolarHBondContact CB-OG 3.46Å; S444-E450 WeakPolarHBondContact CB-OE1 3.5Å; S444-E450 PolarHBondContact OG-OE1 3.3Å
445	V	74.5	Confident	85.8	Confident	63 Å²	63	46.9 Å²	46.9	38%	0.382	25%	0.246	S	C	.	.	S	Bend	trans	-57.4	-53.5	177	172.6	0	0	0	0	110.7	L395 K396	L395-V445 WeakPolarHBondContact O-CG2 3.17Å; L395-V445 PolarHBondContact O-N 2.57Å; K396-V445 WeakPolarHBondContact O-CG2 3.38Å
446	S	83.6	Confident	86	Confident	24 Å²	24	48.4 Å²	48.4	17%	0.168	25%	0.253	C	S	.	.			trans	-150.8	138.5	-179	173.4	0	0	0	0	109.7	D448 S449 E450	S446-D448 PolarHBondContact O-N 2.86Å; S446-D448 PolarHBondContact OG-N 2.95Å; S446-S449 PolarHBondContact O-N 2.81Å; S446-E450 WeakPolarHBondContact O-CG 3.44Å; S446-E450 PolarHBondContact O-N 3.46Å
447	D	85.8	Confident	86.4	Confident	87 Å²	87	48.2 Å²	48.2	47%	0.465	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-29.9	175.5	-76.4	1.8	0	0	0	111.4	E450 K451	D447-E450 PolarHBondContact O-N 2.86Å; D447-K451 VanDerWaalsContact O-CG 3.32Å; D447-K451 WeakPolarHBondContact O-CG 3.45Å; D447-K451 PolarHBondContact O-N 2.75Å
448	D	89.1	Confident	86.9	Confident	112 Å²	112	46.5 Å²	46.5	60%	0.599	25%	0.247	S	C	*	.	H	α-helix	trans	-73.9	-39.9	-179.5	-67.6	-28.6	0	0	0	111.5	S446 E450 K451 N452	S446-D448 PolarHBondContact O-N 2.86Å; S446-D448 PolarHBondContact OG-N 2.95Å; D448-E450 VanDerWaalsContact C-N 3.31Å; D448-E450 PolarHBondContact O-N 3.02Å; D448-K451 PolarHBondContact O-N 2.93Å; D448-N452 WeakPolarHBondContact O-CB 3.22Å; D448-N452 PolarHBondContact O-N 3.33Å
449	S	89.1	Confident	87.2	Confident	19 Å²	19	51.8 Å²	51.8	13%	0.133	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-38.4	173.1	-52.6	0	0	0	0	111.9	S446 N452 M453	S446-S449 PolarHBondContact O-N 2.81Å; S449-N452 PolarHBondContact O-N 2.79Å; S449-M453 PolarHBondContact O-N 2.87Å
450	E	90.9	Very high	87.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-44.1	176.5	-64.6	-89	-160	0	0	111.7	L435 R438 S444 S446 D447 D448 M453 I454 F473	L435-E450 WeakPolarHBondContact CD1-OE2 3.46Å; R438-E450 IonicContact CZ-OE1 3.73Å; R438-E450 IonicContact CZ-OE2 2.81Å; R438-E450 IonicContact NE-OE1 3.07Å; R438-E450 PolarHBondContact NE-OE1 3.41Å; R438-E450 IonicContact NE-OE2 3.02Å; R438-E450 IonicContact NH2-OE1 3.23Å; R438-E450 PolarHBondContact NH2-OE1 3.09Å; R438-E450 IonicContact NH2-OE2 3.87Å; R438-E450 PolarHBondContact NH2-OE2 2.75Å; S444-E450 WeakPolarHBondContact CB-OE1 3.5Å; S444-E450 PolarHBondContact OG-OE1 3.3Å; S446-E450 WeakPolarHBondContact O-CG 3.44Å; S446-E450 PolarHBondContact O-N 3.46Å; D447-E450 PolarHBondContact O-N 2.86Å; D448-E450 VanDerWaalsContact C-N 3.31Å; D448-E450 PolarHBondContact O-N 3.02Å; E450-M453 PolarHBondContact O-N 3.08Å; E450-I454 WeakPolarHBondContact O-CG1 3.48Å; E450-I454 PolarHBondContact O-N 3.33Å; E450-F473 HydrophobicContact CB-CE1 4.41Å; E450-F473 HydrophobicContact CB-CE2 4.24Å; E450-F473 HydrophobicContact CB-CZ 3.52Å; E450-F473 HydrophobicContact CG-CZ 4.29Å
451	K	92.2	Very high	87.8	Confident	111 Å²	111	53.9 Å²	53.9	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-40.1	174.9	-73.4	171.2	-171.2	163.9	0	111.9	D447 D448 I454 S455	D447-K451 VanDerWaalsContact O-CG 3.32Å; D447-K451 WeakPolarHBondContact O-CG 3.45Å; D447-K451 PolarHBondContact O-N 2.75Å; D448-K451 PolarHBondContact O-N 2.93Å; K451-I454 PolarHBondContact O-N 3.45Å; K451-S455 PolarHBondContact O-N 3.06Å
452	N	92.8	Very high	88.5	Confident	55 Å²	55	51.9 Å²	51.9	29%	0.294	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-47.3	175.1	-174.6	-31.3	0	0	0	110.2	E408 D448 S449 I454 S455 K456	E408-N452 PolarHBondContact OE1-ND2 3.36Å; D448-N452 WeakPolarHBondContact O-CB 3.22Å; D448-N452 PolarHBondContact O-N 3.33Å; S449-N452 PolarHBondContact O-N 2.79Å; N452-I454 VanDerWaalsContact C-N 3.32Å; N452-I454 PolarHBondContact O-N 2.94Å; N452-S455 WeakPolarHBondContact O-CA 3.37Å; N452-S455 VanDerWaalsContact O-CB 3.24Å; N452-S455 WeakPolarHBondContact O-CB 3.41Å; N452-S455 PolarHBondContact O-N 3.48Å; N452-K456 WeakPolarHBondContact O-CG 3.28Å; N452-K456 PolarHBondContact O-N 3.34Å; N452-K456 WeakPolarHBondContact OD1-CE 3.39Å; N452-K456 PolarHBondContact OD1-NZ 3.26Å
453	M	94.6	Very high	89.1	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-42.7	175.7	-173.6	62.3	-154.9	0	0	112.5	I391 L395 L411 M415 Y431 S449 E450 S455 K456 L457	I391-M453 HydrophobicContact CD1-CE 3.72Å; I391-M453 HydrophobicContact CG2-CE 4.36Å; I391-M453 HydrophobicContact CG2-CG 4.31Å; I391-M453 HydrophobicContact CG2-SD 4.31Å; L395-M453 HydrophobicContact CD1-CB 4.45Å; L395-M453 HydrophobicContact CD1-CG 4.4Å; L411-M453 HydrophobicContact CB-SD 4.23Å; L411-M453 HydrophobicContact CD1-CB 4.45Å; L411-M453 HydrophobicContact CD1-SD 4.22Å; L411-M453 HydrophobicContact CD2-SD 3.94Å; L411-M453 HydrophobicContact CG-SD 4.35Å; M415-M453 HydrophobicContact CG-CE 4.26Å; M415-M453 HydrophobicContact SD-CE 3.39Å; M415-M453 WeakPolarHBondContact SD-CE 3.36Å; M415-M453 HydrophobicContact SD-SD 4.44Å; Y431-M453 HydrophobicContact CE2-CG 4.25Å; Y431-M453 VanDerWaalsContact OH-CG 3.25Å; Y431-M453 WeakPolarHBondContact OH-CG 3.44Å; S449-M453 PolarHBondContact O-N 2.87Å; E450-M453 PolarHBondContact O-N 3.08Å; M453-S455 VanDerWaalsContact C-N 3.33Å; M453-S455 PolarHBondContact O-N 3.42Å; M453-K456 PolarHBondContact O-N 2.89Å; M453-L457 HydrophobicContact CE-CD1 4.36Å; M453-L457 HydrophobicContact CE-CD2 4.09Å; M453-L457 HydrophobicContact CE-CG 4.04Å; M453-L457 WeakPolarHBondContact O-CG 3.12Å; M453-L457 PolarHBondContact O-N 3Å
454	I	94.4	Very high	89.7	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-40.2	174.3	-67.7	172.1	0	0	0	111.2	L435 E450 K451 N452 K456 L457 K458 T466 L469 E470 F473	L435-I454 HydrophobicContact CD2-CD1 4.18Å; E450-I454 WeakPolarHBondContact O-CG1 3.48Å; E450-I454 PolarHBondContact O-N 3.33Å; K451-I454 PolarHBondContact O-N 3.45Å; N452-I454 VanDerWaalsContact C-N 3.32Å; N452-I454 PolarHBondContact O-N 2.94Å; I454-K456 VanDerWaalsContact C-N 3.34Å; I454-K456 PolarHBondContact O-N 2.67Å; I454-L457 PolarHBondContact O-N 3.15Å; I454-K458 WeakPolarHBondContact O-CB 3.31Å; I454-K458 PolarHBondContact O-N 3.4Å; I454-T466 HydrophobicContact CG2-CG2 4.07Å; I454-L469 HydrophobicContact CD1-CB 3.98Å; I454-L469 HydrophobicContact CG1-CB 4.35Å; I454-E470 HydrophobicContact CG2-CG 3.87Å; I454-F473 HydrophobicContact CD1-CD2 3.7Å; I454-F473 HydrophobicContact CD1-CE2 3.47Å; I454-F473 VanDerWaalsContact CD1-CE2 3.47Å
455	S	95.2	Very high	90.3	Very high	66 Å²	66	53.8 Å²	53.8	46%	0.462	30%	0.298	S	S	.	.	H	α-helix	trans	-59.5	-43.7	174.9	-168.2	0	0	0	0	111.7	K451 N452 M453 L457 K458 T459	K451-S455 PolarHBondContact O-N 3.06Å; N452-S455 WeakPolarHBondContact O-CA 3.37Å; N452-S455 VanDerWaalsContact O-CB 3.24Å; N452-S455 WeakPolarHBondContact O-CB 3.41Å; N452-S455 PolarHBondContact O-N 3.48Å; M453-S455 VanDerWaalsContact C-N 3.33Å; M453-S455 PolarHBondContact O-N 3.42Å; S455-L457 PolarHBondContact O-N 3.32Å; S455-K458 WeakPolarHBondContact O-CB 3.47Å; S455-K458 PolarHBondContact O-N 2.91Å; S455-K458 VanDerWaalsContact O-N 3.16Å; S455-T459 PolarHBondContact O-N 3.41Å; S455-T459 PolarHBondContact O-OG1 2.88Å
456	K	95.3	Very high	91.2	Very high	33 Å²	33	50.8 Å²	50.8	14%	0.143	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-43.8	175	-61.9	-176	-162.3	-68	0	111.6	E408 D412 M415 N452 M453 I454 K458 T459 E460	E408-K456 IonicContact OE1-NZ 3.46Å; D412-K456 WeakPolarHBondContact OD1-CD 3.43Å; D412-K456 WeakPolarHBondContact OD1-CE 3.22Å; D412-K456 IonicContact OD1-NZ 2.75Å; D412-K456 PolarHBondContact OD1-NZ 3.43Å; D412-K456 IonicContact OD2-NZ 3.54Å; M415-K456 HydrophobicContact CE-CB 4.33Å; M415-K456 HydrophobicContact CG-CB 4.09Å; M415-K456 HydrophobicContact CG-CD 4.13Å; M415-K456 HydrophobicContact SD-CB 4.39Å; N452-K456 WeakPolarHBondContact O-CG 3.28Å; N452-K456 PolarHBondContact O-N 3.34Å; N452-K456 WeakPolarHBondContact OD1-CE 3.39Å; N452-K456 PolarHBondContact OD1-NZ 3.26Å; M453-K456 PolarHBondContact O-N 2.89Å; I454-K456 VanDerWaalsContact C-N 3.34Å; I454-K456 PolarHBondContact O-N 2.67Å; K456-K458 VanDerWaalsContact C-N 3.31Å; K456-K458 PolarHBondContact O-N 3.35Å; K456-T459 PolarHBondContact O-N 3.19Å; K456-E460 PolarHBondContact O-N 3.03Å
457	L	95.3	Very high	91.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-36.7	174.6	-67.5	172	0	0	0	112.5	M415 F418 F427 Y431 M453 I454 S455 E460 C461 F465 T466 L469	M415-L457 HydrophobicContact CE-CD2 4.03Å; M415-L457 HydrophobicContact SD-CD2 4Å; F418-L457 HydrophobicContact CD1-CD2 4.47Å; F418-L457 HydrophobicContact CE1-CD2 4.1Å; F418-L457 HydrophobicContact CE2-CD2 4.19Å; F418-L457 HydrophobicContact CZ-CD2 3.93Å; F427-L457 HydrophobicContact CE1-CD1 4.35Å; F427-L457 HydrophobicContact CE1-CD2 3.78Å; F427-L457 HydrophobicContact CZ-CD2 4.42Å; Y431-L457 HydrophobicContact CD1-CD1 4.12Å; Y431-L457 HydrophobicContact CE1-CD1 3.9Å; M453-L457 HydrophobicContact CE-CD1 4.36Å; M453-L457 HydrophobicContact CE-CD2 4.09Å; M453-L457 HydrophobicContact CE-CG 4.04Å; M453-L457 WeakPolarHBondContact O-CG 3.12Å; M453-L457 PolarHBondContact O-N 3Å; I454-L457 PolarHBondContact O-N 3.15Å; S455-L457 PolarHBondContact O-N 3.32Å; L457-E460 PolarHBondContact O-N 2.83Å; L457-C461 PolarHBondContact O-N 3.22Å; L457-F465 HydrophobicContact CB-CD1 4.48Å; L457-F465 HydrophobicContact CB-CE1 4.36Å; L457-F465 HydrophobicContact CD2-CE1 4.4Å; L457-T466 HydrophobicContact CB-CG2 3.92Å; L457-L469 HydrophobicContact CD1-CD1 4.28Å
458	K	94.4	Very high	91.9	Very high	68 Å²	68	52.4 Å²	52.4	30%	0.296	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-39.8	178	-170.3	178.4	-166.5	153.2	0	112	I454 S455 K456 E460 G462 C463 T466 E470	I454-K458 WeakPolarHBondContact O-CB 3.31Å; I454-K458 PolarHBondContact O-N 3.4Å; S455-K458 WeakPolarHBondContact O-CB 3.47Å; S455-K458 PolarHBondContact O-N 2.91Å; S455-K458 VanDerWaalsContact O-N 3.16Å; K456-K458 VanDerWaalsContact C-N 3.31Å; K456-K458 PolarHBondContact O-N 3.35Å; K458-E460 VanDerWaalsContact C-N 3.31Å; K458-E460 PolarHBondContact O-N 2.99Å; K458-G462 WeakPolarHBondContact O-CA 3.45Å; K458-G462 PolarHBondContact O-N 2.93Å; K458-C463 WeakPolarHBondContact CE-SG 3.45Å; K458-T466 HydrophobicContact CB-CG2 3.77Å; K458-T466 HydrophobicContact CG-CG2 4.46Å; K458-E470 WeakPolarHBondContact CD-OE1 3.5Å; K458-E470 IonicContact NZ-OE1 2.73Å; K458-E470 PolarHBondContact NZ-OE1 3.37Å; K458-E470 IonicContact NZ-OE2 2.84Å
459	T	93	Very high	92.2	Very high	114 Å²	114	47.1 Å²	47.1	70%	0.699	26%	0.259	S	S	*	.	H	α-helix	trans	-62.3	-39.9	176.2	-59.5	0	0	0	0	111.5	S455 K456	S455-T459 PolarHBondContact O-N 3.41Å; S455-T459 PolarHBondContact O-OG1 2.88Å; K456-T459 PolarHBondContact O-N 3.19Å
460	E	89.8	Confident	92.4	Very high	77 Å²	77	49.1 Å²	49.1	36%	0.36	27%	0.266	S	S	.	.	H	α-helix	trans	-79.3	-41	-178	-65.8	-61.3	154.8	0	0	113.8	M415 F418 R419 K456 L457 K458	M415-E460 HydrophobicContact CE-CB 4.32Å; M415-E460 HydrophobicContact CE-CG 3.56Å; F418-E460 HydrophobicContact CD1-CB 4.37Å; F418-E460 HydrophobicContact CD1-CG 4.43Å; F418-E460 HydrophobicContact CE1-CB 3.98Å; R419-E460 WeakPolarHBondContact CD-OE1 3.41Å; R419-E460 VanDerWaalsContact CD-OE2 3.28Å; R419-E460 WeakPolarHBondContact CD-OE2 3.5Å; R419-E460 HydrophobicContact CG-CG 4.35Å; R419-E460 WeakPolarHBondContact CG-OE2 3.48Å; R419-E460 IonicContact NE-OE1 3.64Å; K456-E460 PolarHBondContact O-N 3.03Å; L457-E460 PolarHBondContact O-N 2.83Å; K458-E460 VanDerWaalsContact C-N 3.31Å; K458-E460 PolarHBondContact O-N 2.99Å
461	C	89.9	Confident	92.6	Very high	20 Å²	20	49.3 Å²	49.3	14%	0.135	27%	0.268	C	S	.	.	H	α-helix	trans	-114.4	-6.8	-170.6	-62.3	0	0	0	0	114.5	F418 L457 F465	F418-C461 VanDerWaalsContact CE1-SG 3.57Å; F418-C461 VanDerWaalsContact CZ-SG 3.57Å; L457-C461 PolarHBondContact O-N 3.22Å; C461-F465 HydrophobicContact CB-CB 3.52Å; C461-F465 HydrophobicContact CB-CD1 3.72Å; C461-F465 HydrophobicContact CB-CD2 3.78Å; C461-F465 HydrophobicContact CB-CE1 4.34Å; C461-F465 HydrophobicContact CB-CE2 4.38Å; C461-F465 HydrophobicContact CB-CG 3.4Å
462	G	89.9	Confident	92.7	Very high	30 Å²	30	44 Å²	44	31%	0.309	25%	0.245	S	C	.	.			trans	83	172	-178.6	0	0	0	0	0	115	K458 Q464 F465	K458-G462 WeakPolarHBondContact O-CA 3.45Å; K458-G462 PolarHBondContact O-N 2.93Å; G462-Q464 VanDerWaalsContact C-N 3.29Å; G462-Q464 PolarHBondContact O-N 3.09Å; G462-F465 WeakPolarHBondContact O-CB 3.38Å; G462-F465 PolarHBondContact O-N 3.12Å
463	C	89.6	Confident	92.6	Very high	80 Å²	80	42.4 Å²	42.4	54%	0.541	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-28.5	-173.7	-51.8	0	0	0	0	114.4	K458 F465 T466 S467	K458-C463 WeakPolarHBondContact CE-SG 3.45Å; C463-F465 VanDerWaalsContact C-N 3.31Å; C463-F465 PolarHBondContact O-N 3.33Å; C463-T466 PolarHBondContact O-N 3.47Å; C463-S467 WeakPolarHBondContact O-CB 3.44Å; C463-S467 PolarHBondContact O-N 3.41Å
464	Q	87.6	Confident	92.6	Very high	160 Å²	160	50.3 Å²	50.3	75%	0.748	27%	0.265	S	S	*	.	H	α-helix	trans	-67.4	-35.3	-179.6	-69.1	-177.2	1.5	0	0	111.6	G462	G462-Q464 VanDerWaalsContact C-N 3.29Å; G462-Q464 PolarHBondContact O-N 3.09Å
465	F	89.4	Confident	92.5	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.013	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-41.8	177.5	-172.8	-92.9	0	0	0	111.7	F418 K424 E428 L457 C461 G462 C463	F418-F465 HydrophobicContact CZ-CZ 4.24Å; K424-F465 HydrophobicContact CB-CE2 4.45Å; E428-F465 HydrophobicContact CB-CE1 4.31Å; E428-F465 HydrophobicContact CB-CE2 3.63Å; E428-F465 HydrophobicContact CB-CZ 3.48Å; E428-F465 VanDerWaalsContact CB-CZ 3.48Å; E428-F465 HydrophobicContact CG-CD2 4.24Å; E428-F465 HydrophobicContact CG-CE1 4.03Å; E428-F465 HydrophobicContact CG-CE2 3.75Å; E428-F465 HydrophobicContact CG-CZ 3.63Å; E428-F465 WeakPolarHBondContact OE2-CD2 3.32Å; E428-F465 WeakPolarHBondContact OE2-CE2 3.47Å; L457-F465 HydrophobicContact CB-CD1 4.48Å; L457-F465 HydrophobicContact CB-CE1 4.36Å; L457-F465 HydrophobicContact CD2-CE1 4.4Å; C461-F465 HydrophobicContact CB-CB 3.52Å; C461-F465 HydrophobicContact CB-CD1 3.72Å; C461-F465 HydrophobicContact CB-CD2 3.78Å; C461-F465 HydrophobicContact CB-CE1 4.34Å; C461-F465 HydrophobicContact CB-CE2 4.38Å; C461-F465 HydrophobicContact CB-CG 3.4Å; G462-F465 WeakPolarHBondContact O-CB 3.38Å; G462-F465 PolarHBondContact O-N 3.12Å; C463-F465 VanDerWaalsContact C-N 3.31Å; C463-F465 PolarHBondContact O-N 3.33Å
466	T	94	Very high	92.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-90.7	-12.2	-175.7	61.7	0	0	0	0	114.6	I454 L457 K458 C463 K468 L469 E470	I454-T466 HydrophobicContact CG2-CG2 4.07Å; L457-T466 HydrophobicContact CB-CG2 3.92Å; K458-T466 HydrophobicContact CB-CG2 3.77Å; K458-T466 HydrophobicContact CG-CG2 4.46Å; C463-T466 PolarHBondContact O-N 3.47Å; T466-K468 VanDerWaalsContact C-N 3.29Å; T466-K468 PolarHBondContact O-N 2.68Å; T466-K468 VanDerWaalsContact O-N 3.16Å; T466-L469 WeakPolarHBondContact O-CA 3.36Å; T466-L469 WeakPolarHBondContact O-CB 3.4Å; T466-L469 PolarHBondContact O-N 3.31Å; T466-E470 PolarHBondContact O-N 2.82Å; T466-E470 PolarHBondContact OG1-OE1 3.35Å; T466-E470 VanDerWaalsContact OG1-OE1 3.05Å
467	S	92.6	Very high	92.1	Very high	54 Å²	54	50.2 Å²	50.2	38%	0.378	27%	0.267	S	S	.	.	H	α-helix	trans	-52.5	-42.4	-173	175.6	0	0	0	0	113.7	C463 G471	C463-S467 WeakPolarHBondContact O-CB 3.44Å; C463-S467 PolarHBondContact O-N 3.41Å; S467-G471 PolarHBondContact O-N 3.04Å
468	K	92.1	Very high	92.1	Very high	92 Å²	92	54.3 Å²	54.3	40%	0.4	29%	0.288	S	S	.	.	H	α-helix	trans	-68.3	-38.4	177.8	-64.8	177.9	-175.2	167.7	0	111.9	T466 G471 M472 Y511	T466-K468 VanDerWaalsContact C-N 3.29Å; T466-K468 PolarHBondContact O-N 2.68Å; T466-K468 VanDerWaalsContact O-N 3.16Å; K468-G471 PolarHBondContact O-N 2.96Å; K468-M472 WeakPolarHBondContact O-CG 3.44Å; K468-M472 PolarHBondContact O-N 3.22Å; K468-Y511 HydrophobicContact CB-CD1 4.38Å; K468-Y511 HydrophobicContact CG-CD1 4.1Å
469	L	94	Very high	92	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-67.5	-44	178.3	-54.3	175.5	0	0	0	111.1	Y431 K432 L435 I454 L457 T466 G471 M472 F473	Y431-L469 HydrophobicContact CD1-CD1 3.93Å; Y431-L469 HydrophobicContact CD1-CD2 4.26Å; Y431-L469 HydrophobicContact CE1-CD1 4.03Å; K432-L469 HydrophobicContact CB-CD2 3.84Å; K432-L469 HydrophobicContact CG-CD2 4.16Å; L435-L469 HydrophobicContact CD2-CB 4.17Å; L435-L469 HydrophobicContact CD2-CD2 3.91Å; I454-L469 HydrophobicContact CD1-CB 3.98Å; I454-L469 HydrophobicContact CG1-CB 4.35Å; L457-L469 HydrophobicContact CD1-CD1 4.28Å; T466-L469 WeakPolarHBondContact O-CA 3.36Å; T466-L469 WeakPolarHBondContact O-CB 3.4Å; T466-L469 PolarHBondContact O-N 3.31Å; L469-G471 VanDerWaalsContact C-N 3.28Å; L469-G471 PolarHBondContact O-N 3.33Å; L469-M472 HydrophobicContact CD2-SD 4.26Å; L469-M472 WeakPolarHBondContact O-CB 3.31Å; L469-M472 PolarHBondContact O-N 2.87Å; L469-F473 PolarHBondContact O-N 3.43Å
470	E	94.4	Very high	91.9	Very high	61 Å²	61	50 Å²	50	29%	0.285	26%	0.264	S	S	.	.	H	α-helix	trans	-62.7	-37.6	173.5	-67	176.7	-169.2	0	0	111.2	I454 K458 T466 M472 F473 R474	I454-E470 HydrophobicContact CG2-CG 3.87Å; K458-E470 WeakPolarHBondContact CD-OE1 3.5Å; K458-E470 IonicContact NZ-OE1 2.73Å; K458-E470 PolarHBondContact NZ-OE1 3.37Å; K458-E470 IonicContact NZ-OE2 2.84Å; T466-E470 PolarHBondContact O-N 2.82Å; T466-E470 PolarHBondContact OG1-OE1 3.35Å; T466-E470 VanDerWaalsContact OG1-OE1 3.05Å; E470-M472 VanDerWaalsContact C-N 3.34Å; E470-M472 PolarHBondContact O-N 3.15Å; E470-F473 PolarHBondContact O-N 3.37Å; E470-R474 PolarHBondContact O-N 3.31Å; E470-R474 VanDerWaalsContact O-N 3.1Å
471	G	94.1	Very high	92.2	Very high	4 Å²	4	50.2 Å²	50.2	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-60	-39.2	173.1	0	0	0	0	0	113.2	S467 K468 L469 F473 R474 D475	S467-G471 PolarHBondContact O-N 3.04Å; K468-G471 PolarHBondContact O-N 2.96Å; L469-G471 VanDerWaalsContact C-N 3.28Å; L469-G471 PolarHBondContact O-N 3.33Å; G471-F473 PolarHBondContact O-N 3.34Å; G471-R474 WeakPolarHBondContact O-CB 3.47Å; G471-R474 PolarHBondContact O-N 3.17Å; G471-D475 PolarHBondContact O-N 3.42Å
472	M	93.5	Very high	92.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-40.9	176.3	-66.9	164.9	58.6	0	0	112.1	K432 L435 A436 L439 K468 L469 E470 D475 M476 W512	K432-M472 HydrophobicContact CG-SD 4.03Å; L435-M472 HydrophobicContact CB-CE 4.3Å; L435-M472 HydrophobicContact CD2-CE 4.07Å; L435-M472 HydrophobicContact CD2-SD 4.4Å; L435-M472 HydrophobicContact CG-CE 3.99Å; A436-M472 VanDerWaalsContact CA-CE 3.46Å; A436-M472 HydrophobicContact CB-CE 3.59Å; L439-M472 HydrophobicContact CD1-CB 4.12Å; L439-M472 HydrophobicContact CD1-CE 4.21Å; K468-M472 WeakPolarHBondContact O-CG 3.44Å; K468-M472 PolarHBondContact O-N 3.22Å; L469-M472 HydrophobicContact CD2-SD 4.26Å; L469-M472 WeakPolarHBondContact O-CB 3.31Å; L469-M472 PolarHBondContact O-N 2.87Å; E470-M472 VanDerWaalsContact C-N 3.34Å; E470-M472 PolarHBondContact O-N 3.15Å; M472-D475 PolarHBondContact O-N 2.77Å; M472-M476 WeakPolarHBondContact O-CG 3.39Å; M472-M476 PolarHBondContact O-N 3.48Å; M472-M476 VanDerWaalsContact O-N 3.09Å; M472-W512 HydrophobicContact CB-CD2 4.44Å; M472-W512 HydrophobicContact CB-CH2 4Å; M472-W512 HydrophobicContact CB-CZ2 3.61Å; M472-W512 HydrophobicContact CE-CD2 4.3Å; M472-W512 HydrophobicContact CE-CE3 3.83Å; M472-W512 HydrophobicContact CE-CH2 4.22Å; M472-W512 HydrophobicContact CE-CZ3 3.77Å; M472-W512 HydrophobicContact CG-CD2 3.87Å; M472-W512 HydrophobicContact CG-CE3 4.33Å; M472-W512 HydrophobicContact CG-CG 4.25Å; M472-W512 HydrophobicContact CG-CH2 4.41Å; M472-W512 HydrophobicContact CG-CZ2 3.96Å; M472-W512 VanDerWaalsContact O-CZ2 3.32Å; M472-W512 WeakPolarHBondContact O-CZ2 3.46Å
473	F	92	Very high	92.6	Very high	21 Å²	21	48.5 Å²	48.5	9%	0.092	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-42.9	174	-88.5	-82.3	0	0	0	112.2	L435 L439 E450 I454 L469 E470 G471 D475 M476 S477	L435-F473 HydrophobicContact CD1-CE2 3.99Å; L435-F473 HydrophobicContact CD1-CZ 4.28Å; L435-F473 HydrophobicContact CD2-CE2 4.23Å; L439-F473 HydrophobicContact CD1-CD2 4.45Å; L439-F473 HydrophobicContact CD1-CE2 4.28Å; L439-F473 HydrophobicContact CD1-CZ 4.43Å; L439-F473 HydrophobicContact CD2-CD1 4.4Å; L439-F473 HydrophobicContact CD2-CE1 3.74Å; L439-F473 HydrophobicContact CD2-CE2 4.36Å; L439-F473 HydrophobicContact CD2-CZ 3.71Å; E450-F473 HydrophobicContact CB-CE1 4.41Å; E450-F473 HydrophobicContact CB-CE2 4.24Å; E450-F473 HydrophobicContact CB-CZ 3.52Å; E450-F473 HydrophobicContact CG-CZ 4.29Å; I454-F473 HydrophobicContact CD1-CD2 3.7Å; I454-F473 HydrophobicContact CD1-CE2 3.47Å; I454-F473 VanDerWaalsContact CD1-CE2 3.47Å; L469-F473 PolarHBondContact O-N 3.43Å; E470-F473 PolarHBondContact O-N 3.37Å; G471-F473 PolarHBondContact O-N 3.34Å; F473-D475 VanDerWaalsContact C-N 3.31Å; F473-D475 PolarHBondContact O-N 3.18Å; F473-M476 PolarHBondContact O-N 2.96Å; F473-M476 VanDerWaalsContact O-N 3.16Å; F473-S477 PolarHBondContact O-N 2.8Å; F473-S477 PolarHBondContact O-OG 3.01Å
474	R	93.5	Very high	92.9	Very high	165 Å²	165	48.9 Å²	48.9	62%	0.623	25%	0.249	S	C	*	.	H	α-helix	trans	-60.4	-43.1	177.1	-167	-177.7	-56.8	-171.6	2.7	111.5	E470 G471 M476 S477 I478	E470-R474 PolarHBondContact O-N 3.31Å; E470-R474 VanDerWaalsContact O-N 3.1Å; G471-R474 WeakPolarHBondContact O-CB 3.47Å; G471-R474 PolarHBondContact O-N 3.17Å; R474-M476 VanDerWaalsContact C-N 3.33Å; R474-M476 PolarHBondContact O-N 3.39Å; R474-S477 PolarHBondContact O-N 3.12Å; R474-I478 HydrophobicContact CG-CD1 3.72Å; R474-I478 HydrophobicContact CG-CG1 4.32Å; R474-I478 WeakPolarHBondContact O-CB 3.5Å; R474-I478 VanDerWaalsContact O-CG1 3.27Å; R474-I478 WeakPolarHBondContact O-CG1 3.47Å; R474-I478 PolarHBondContact O-N 2.86Å
475	D	93.7	Very high	93.2	Very high	13 Å²	13	44.1 Å²	44.1	7%	0.07	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-42.2	175.3	-74.7	-15.4	0	0	0	111.3	G471 M472 F473 S479 T508 W512	G471-D475 PolarHBondContact O-N 3.42Å; M472-D475 PolarHBondContact O-N 2.77Å; F473-D475 VanDerWaalsContact C-N 3.31Å; F473-D475 PolarHBondContact O-N 3.18Å; D475-S479 WeakPolarHBondContact O-CB 3.43Å; D475-S479 PolarHBondContact O-N 3.38Å; D475-T508 PolarHBondContact OD1-OG1 3.5Å; D475-T508 VanDerWaalsContact OD2-CB 3.27Å; D475-T508 WeakPolarHBondContact OD2-CB 3.38Å; D475-T508 PolarHBondContact OD2-N 2.84Å; D475-T508 PolarHBondContact OD2-OG1 3.45Å; D475-W512 HydrophobicContact CB-CZ2 4.15Å; D475-W512 PolarHBondContact OD2-NE1 3.13Å
476	M	90.7	Very high	93.5	Very high	18 Å²	18	44 Å²	44	9%	0.089	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-47.4	176.9	-70.8	-60.2	93.4	0	0	112	L439 L440 M472 F473 R474 S479 N480 R505 L507 W512	L439-M476 HydrophobicContact CB-CG 4.31Å; L439-M476 HydrophobicContact CB-SD 4.5Å; L439-M476 HydrophobicContact CD1-CG 4.31Å; L440-M476 HydrophobicContact CD2-CE 4.19Å; L440-M476 HydrophobicContact CD2-SD 4.44Å; M472-M476 WeakPolarHBondContact O-CG 3.39Å; M472-M476 PolarHBondContact O-N 3.48Å; M472-M476 VanDerWaalsContact O-N 3.09Å; F473-M476 PolarHBondContact O-N 2.96Å; F473-M476 VanDerWaalsContact O-N 3.16Å; R474-M476 VanDerWaalsContact C-N 3.33Å; R474-M476 PolarHBondContact O-N 3.39Å; M476-S479 PolarHBondContact O-N 3.04Å; M476-N480 VanDerWaalsContact O-CG 3.27Å; M476-N480 PolarHBondContact O-N 3.39Å; M476-N480 PolarHBondContact O-ND2 3.27Å; M476-R505 HydrophobicContact CE-CB 4.48Å; M476-L507 HydrophobicContact CE-CD2 3.14Å; M476-W512 HydrophobicContact CE-CH2 3.51Å; M476-W512 HydrophobicContact CE-CZ2 3.46Å; M476-W512 VanDerWaalsContact CE-CZ2 3.46Å; M476-W512 HydrophobicContact CG-CH2 4.01Å; M476-W512 HydrophobicContact CG-CZ2 4.23Å; M476-W512 HydrophobicContact SD-CH2 4Å; M476-W512 HydrophobicContact SD-CZ2 4.41Å
477	S	91.6	Very high	93.4	Very high	74 Å²	74	49 Å²	49	52%	0.517	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-50.1	178	-58.4	0	0	0	0	111.9	F473 R474 S479 N480 T481	F473-S477 PolarHBondContact O-N 2.8Å; F473-S477 PolarHBondContact O-OG 3.01Å; R474-S477 PolarHBondContact O-N 3.12Å; S477-S479 VanDerWaalsContact C-N 3.28Å; S477-S479 PolarHBondContact O-N 3.49Å; S477-N480 PolarHBondContact O-N 3.25Å; S477-T481 PolarHBondContact O-N 3.46Å; S477-T481 VanDerWaalsContact O-N 3.11Å; S477-T481 PolarHBondContact O-OG1 3.34Å
478	I	93.9	Very high	93.5	Very high	86 Å²	86	52.4 Å²	52.4	44%	0.441	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-41	179.3	-69.8	173.3	0	0	0	110.4	R474 N480 T481 T482	R474-I478 HydrophobicContact CG-CD1 3.72Å; R474-I478 HydrophobicContact CG-CG1 4.32Å; R474-I478 WeakPolarHBondContact O-CB 3.5Å; R474-I478 VanDerWaalsContact O-CG1 3.27Å; R474-I478 WeakPolarHBondContact O-CG1 3.47Å; R474-I478 PolarHBondContact O-N 2.86Å; I478-N480 PolarHBondContact O-N 3.47Å; I478-T481 PolarHBondContact O-N 3.18Å; I478-T482 WeakPolarHBondContact O-CB 3.22Å; I478-T482 PolarHBondContact O-N 3.22Å; I478-T482 PolarHBondContact O-OG1 3.46Å
479	S	92.9	Very high	93.5	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-35.8	-179	-166.5	0	0	0	0	112.6	D475 M476 S477 T482 M483 V504 R505 V506	D475-S479 WeakPolarHBondContact O-CB 3.43Å; D475-S479 PolarHBondContact O-N 3.38Å; M476-S479 PolarHBondContact O-N 3.04Å; S477-S479 VanDerWaalsContact C-N 3.28Å; S477-S479 PolarHBondContact O-N 3.49Å; S479-T482 PolarHBondContact O-N 2.9Å; S479-M483 WeakPolarHBondContact O-CB 3.33Å; S479-M483 PolarHBondContact O-N 3.33Å; S479-V504 PolarHBondContact OG-O 2.87Å; S479-R505 VanDerWaalsContact OG-CA 3.23Å; S479-R505 WeakPolarHBondContact OG-CA 3.37Å; S479-V506 PolarHBondContact OG-N 3.48Å
480	N	91.5	Very high	93.4	Very high	89 Å²	89	52.7 Å²	52.7	48%	0.476	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-48	173.9	-69.7	-20.5	0	0	0	110.6	M476 S477 I478 T482 M483 D484	M476-N480 VanDerWaalsContact O-CG 3.27Å; M476-N480 PolarHBondContact O-N 3.39Å; M476-N480 PolarHBondContact O-ND2 3.27Å; S477-N480 PolarHBondContact O-N 3.25Å; I478-N480 PolarHBondContact O-N 3.47Å; N480-T482 VanDerWaalsContact C-N 3.35Å; N480-T482 PolarHBondContact O-N 3.14Å; N480-M483 WeakPolarHBondContact O-CB 3.24Å; N480-M483 PolarHBondContact O-N 3.26Å; N480-M483 VanDerWaalsContact O-N 3.11Å; N480-D484 PolarHBondContact O-N 2.9Å
481	T	94.9	Very high	93.1	Very high	80 Å²	80	57.5 Å²	57.5	49%	0.491	28%	0.281	S	S	.	.	H	α-helix	trans	-59.2	-44.8	175.6	-54.7	0	0	0	0	112	S477 I478 M483 D484 E485	S477-T481 PolarHBondContact O-N 3.46Å; S477-T481 VanDerWaalsContact O-N 3.11Å; S477-T481 PolarHBondContact O-OG1 3.34Å; I478-T481 PolarHBondContact O-N 3.18Å; T481-M483 PolarHBondContact O-N 3.05Å; T481-D484 PolarHBondContact O-N 3.36Å; T481-E485 WeakPolarHBondContact O-CG 3.47Å; T481-E485 PolarHBondContact O-N 3.36Å
482	T	94.6	Very high	93	Very high	7 Å²	7	62.7 Å²	62.7	4%	0.043	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-35.8	177.5	-54.9	0	0	0	0	111.4	I478 S479 N480 F486 F537 Y538	I478-T482 WeakPolarHBondContact O-CB 3.22Å; I478-T482 PolarHBondContact O-N 3.22Å; I478-T482 PolarHBondContact O-OG1 3.46Å; S479-T482 PolarHBondContact O-N 2.9Å; N480-T482 VanDerWaalsContact C-N 3.35Å; N480-T482 PolarHBondContact O-N 3.14Å; T482-F486 WeakPolarHBondContact O-CB 3.2Å; T482-F486 PolarHBondContact O-N 3.13Å; T482-F537 HydrophobicContact CG2-CE1 4.18Å; T482-Y538 HydrophobicContact CG2-CD2 4.02Å; T482-Y538 HydrophobicContact CG2-CE2 4.29Å
483	M	94.7	Very high	92.8	Very high	7 Å²	7	66 Å²	66	3%	0.034	33%	0.332	C	S	.	.	H	α-helix	trans	-70.1	-38.4	178.1	-167.9	64.4	-137.6	0	0	111.8	S479 N480 T481 F486 R487 L502 T503	S479-M483 WeakPolarHBondContact O-CB 3.33Å; S479-M483 PolarHBondContact O-N 3.33Å; N480-M483 WeakPolarHBondContact O-CB 3.24Å; N480-M483 PolarHBondContact O-N 3.26Å; N480-M483 VanDerWaalsContact O-N 3.11Å; T481-M483 PolarHBondContact O-N 3.05Å; M483-F486 HydrophobicContact CE-CD1 3.57Å; M483-F486 HydrophobicContact CE-CE1 4.24Å; M483-F486 PolarHBondContact O-N 3.28Å; M483-F486 HydrophobicContact SD-CD1 4.31Å; M483-R487 HydrophobicContact CE-CG 4.06Å; M483-R487 WeakPolarHBondContact O-CG 3.13Å; M483-R487 PolarHBondContact O-N 3.17Å; M483-L502 WeakPolarHBondContact CE-O 3.47Å; M483-T503 HydrophobicContact CG-CG2 4.48Å
484	D	94.6	Very high	92.5	Very high	88 Å²	88	67.9 Å²	67.9	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-67.8	-41.8	175.4	-67.1	-28.8	0	0	0	111.7	N480 T481 F486 R487 Q488	N480-D484 PolarHBondContact O-N 2.9Å; T481-D484 PolarHBondContact O-N 3.36Å; D484-F486 VanDerWaalsContact C-N 3.31Å; D484-F486 PolarHBondContact O-N 3.16Å; D484-R487 PolarHBondContact O-N 3Å; D484-R487 IonicContact OD1-NH1 2.74Å; D484-R487 PolarHBondContact OD1-NH1 2.82Å; D484-Q488 PolarHBondContact O-N 2.86Å
485	E	94.8	Very high	92.2	Very high	61 Å²	61	63 Å²	63	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-60.5	-39.8	171.7	-68.8	173.7	158	0	0	112	T481 Q488 H489 F537 K541	T481-E485 WeakPolarHBondContact O-CG 3.47Å; T481-E485 PolarHBondContact O-N 3.36Å; E485-Q488 PolarHBondContact O-N 3.5Å; E485-H489 WeakPolarHBondContact O-CB 3.31Å; E485-H489 PolarHBondContact O-N 3.35Å; E485-F537 HydrophobicContact CB-CZ 4.13Å; E485-K541 IonicContact OE1-NZ 3.61Å; E485-K541 PolarHBondContact OE1-NZ 2.93Å; E485-K541 IonicContact OE2-NZ 3.54Å; E485-K541 PolarHBondContact OE2-NZ 3.39Å
486	F	95.1	Very high	91.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-65	-43.4	175.9	179	-116.7	0	0	0	111.7	T482 M483 D484 Q488 H489 L490 L497 V533 F534 F537	T482-F486 WeakPolarHBondContact O-CB 3.2Å; T482-F486 PolarHBondContact O-N 3.13Å; M483-F486 HydrophobicContact CE-CD1 3.57Å; M483-F486 HydrophobicContact CE-CE1 4.24Å; M483-F486 PolarHBondContact O-N 3.28Å; M483-F486 HydrophobicContact SD-CD1 4.31Å; D484-F486 VanDerWaalsContact C-N 3.31Å; D484-F486 PolarHBondContact O-N 3.16Å; F486-Q488 VanDerWaalsContact C-N 3.31Å; F486-Q488 PolarHBondContact O-N 3.24Å; F486-H489 WeakPolarHBondContact O-CB 3.4Å; F486-H489 PolarHBondContact O-N 3.38Å; F486-L490 HydrophobicContact CD1-CD1 4.05Å; F486-L490 HydrophobicContact CE1-CD1 3.63Å; F486-L490 HydrophobicContact CE1-CG 4.23Å; F486-L490 HydrophobicContact CE2-CD1 4.47Å; F486-L490 HydrophobicContact CE2-CD2 4.05Å; F486-L490 HydrophobicContact CE2-CG 4.2Å; F486-L490 HydrophobicContact CZ-CD1 3.88Å; F486-L490 HydrophobicContact CZ-CD2 3.91Å; F486-L490 HydrophobicContact CZ-CG 4.06Å; F486-L490 WeakPolarHBondContact O-CG 3.28Å; F486-L490 PolarHBondContact O-N 3.18Å; F486-L497 HydrophobicContact CE1-CD1 4.39Å; F486-L497 HydrophobicContact CZ-CD2 4.21Å; F486-V533 HydrophobicContact CE2-CG1 4.16Å; F486-V533 HydrophobicContact CZ-CG1 4.13Å; F486-F534 HydrophobicContact CB-CD2 4.4Å; F486-F534 HydrophobicContact CB-CE2 4.45Å; F486-F534 AromaticContact CD1-CD2 3.8Å; F486-F534 HydrophobicContact CD1-CD2 3.8Å; F486-F534 HydrophobicContact CD1-CE2 4.5Å; F486-F534 HydrophobicContact CD2-CD2 4.03Å; F486-F534 HydrophobicContact CE1-CB 4.21Å; F486-F534 AromaticContact CE1-CD2 3.97Å; F486-F534 HydrophobicContact CE1-CD2 3.97Å; F486-F534 HydrophobicContact CE2-CB 4.16Å; F486-F534 HydrophobicContact CE2-CD2 4.2Å; F486-F534 AromaticContact CG-CD2 3.81Å; F486-F534 HydrophobicContact CG-CD2 3.81Å; F486-F534 HydrophobicContact CG-CE2 4.34Å; F486-F534 HydrophobicContact CZ-CB 3.82Å; F486-F534 HydrophobicContact CZ-CD2 4.16Å; F486-F537 HydrophobicContact CB-CD1 4.01Å; F486-F537 HydrophobicContact CB-CE1 3.65Å; F486-F537 HydrophobicContact CB-CZ 4.06Å; F486-F537 HydrophobicContact CD2-CB 3.91Å; F486-F537 AromaticContact CD2-CD1 3.51Å; F486-F537 HydrophobicContact CD2-CD1 3.51Å; F486-F537 HydrophobicContact CD2-CD2 4.16Å; F486-F537 HydrophobicContact CD2-CE1 4.04Å; F486-F537 AromaticContact CD2-CG 3.59Å; F486-F537 HydrophobicContact CD2-CG 3.59Å; F486-F537 HydrophobicContact CE2-CB 4.04Å; F486-F537 HydrophobicContact CE2-CD1 4.39Å; F486-F537 HydrophobicContact CE2-CG 4.23Å; F486-F537 HydrophobicContact CG-CD1 4.13Å; F486-F537 HydrophobicContact CG-CE1 4.28Å
487	R	93.3	Very high	91.7	Very high	106 Å²	106	66.6 Å²	66.6	40%	0.4	37%	0.373	S	S	.	.	H	α-helix	trans	-59.6	-42.3	174.8	-72.3	171.1	-177.7	152.1	-4.4	111.5	M483 D484 L490 Q491	M483-R487 HydrophobicContact CE-CG 4.06Å; M483-R487 WeakPolarHBondContact O-CG 3.13Å; M483-R487 PolarHBondContact O-N 3.17Å; D484-R487 PolarHBondContact O-N 3Å; D484-R487 IonicContact OD1-NH1 2.74Å; D484-R487 PolarHBondContact OD1-NH1 2.82Å; R487-L490 PolarHBondContact O-N 3.1Å; R487-Q491 WeakPolarHBondContact O-CG 3.33Å; R487-Q491 PolarHBondContact O-N 3.47Å; R487-Q491 VanDerWaalsContact O-N 3.15Å
488	Q	93.3	Very high	91.2	Very high	125 Å²	125	65.7 Å²	65.7	58%	0.584	38%	0.375	S	S	*	.	H	α-helix	trans	-63.2	-43.6	174.8	-171.4	179.3	15.9	0	0	111.5	D484 E485 F486 L490 Q491 T492	D484-Q488 PolarHBondContact O-N 2.86Å; E485-Q488 PolarHBondContact O-N 3.5Å; F486-Q488 VanDerWaalsContact C-N 3.31Å; F486-Q488 PolarHBondContact O-N 3.24Å; Q488-L490 VanDerWaalsContact C-N 3.33Å; Q488-L490 PolarHBondContact O-N 2.91Å; Q488-Q491 WeakPolarHBondContact O-CB 3.43Å; Q488-Q491 PolarHBondContact O-N 2.74Å; Q488-Q491 VanDerWaalsContact O-N 3.15Å; Q488-T492 PolarHBondContact O-N 3.24Å; Q488-T492 PolarHBondContact O-OG1 3.41Å; Q488-T492 VanDerWaalsContact O-OG1 3.09Å
489	H	92.3	Very high	90.7	Very high	71 Å²	71	65.6 Å²	65.6	33%	0.329	40%	0.395	S	S	.	.	H	α-helix	trans	-58.9	-42.3	176.4	179.1	75.8	0	0	0	112.4	E485 F486 Q491 T492 T493 F537	E485-H489 WeakPolarHBondContact O-CB 3.31Å; E485-H489 PolarHBondContact O-N 3.35Å; F486-H489 WeakPolarHBondContact O-CB 3.4Å; F486-H489 PolarHBondContact O-N 3.38Å; H489-Q491 VanDerWaalsContact C-N 3.33Å; H489-Q491 PolarHBondContact O-N 2.92Å; H489-T492 PolarHBondContact O-N 3.01Å; H489-T493 WeakPolarHBondContact CE1-CG2 3.36Å; H489-T493 WeakPolarHBondContact O-CB 3.46Å; H489-T493 PolarHBondContact O-N 3.37Å; H489-T493 PolarHBondContact O-OG1 2.97Å; H489-F537 HydrophobicContact CB-CD2 4.09Å; H489-F537 HydrophobicContact CB-CE2 3.85Å; H489-F537 AromaticContact CD2-CD2 3.79Å; H489-F537 AromaticContact CG-CD2 3.8Å
490	L	92	Very high	90.6	Very high	28 Å²	28	67.4 Å²	67.4	15%	0.147	41%	0.406	C	S	.	.	H	α-helix	trans	-62.1	-41	175.6	-66.5	173.8	0	0	0	111.8	F486 R487 Q488 G494 V495 L497 V533	F486-L490 HydrophobicContact CD1-CD1 4.05Å; F486-L490 HydrophobicContact CE1-CD1 3.63Å; F486-L490 HydrophobicContact CE1-CG 4.23Å; F486-L490 HydrophobicContact CE2-CD1 4.47Å; F486-L490 HydrophobicContact CE2-CD2 4.05Å; F486-L490 HydrophobicContact CE2-CG 4.2Å; F486-L490 HydrophobicContact CZ-CD1 3.88Å; F486-L490 HydrophobicContact CZ-CD2 3.91Å; F486-L490 HydrophobicContact CZ-CG 4.06Å; F486-L490 WeakPolarHBondContact O-CG 3.28Å; F486-L490 PolarHBondContact O-N 3.18Å; R487-L490 PolarHBondContact O-N 3.1Å; Q488-L490 VanDerWaalsContact C-N 3.33Å; Q488-L490 PolarHBondContact O-N 2.91Å; L490-G494 WeakPolarHBondContact O-CA 3.42Å; L490-G494 PolarHBondContact O-N 3.3Å; L490-V495 HydrophobicContact CD2-CB 4.21Å; L490-V495 HydrophobicContact CD2-CG1 4.38Å; L490-L497 HydrophobicContact CD1-CD1 3.7Å; L490-L497 HydrophobicContact CD1-CD2 4.41Å; L490-L497 HydrophobicContact CD1-CG 4.04Å; L490-L497 HydrophobicContact CD2-CD2 4.06Å; L490-L497 HydrophobicContact CD2-CG 4.3Å; L490-V533 HydrophobicContact CD2-CG1 4.23Å
491	Q	89.3	Confident	90.5	Very high	161 Å²	161	70.2 Å²	70.2	75%	0.752	42%	0.421	S	S	*	.	H	α-helix	trans	-65.6	-40.8	176.7	-69.4	173.1	4.7	0	0	112.2	R487 Q488 H489	R487-Q491 WeakPolarHBondContact O-CG 3.33Å; R487-Q491 PolarHBondContact O-N 3.47Å; R487-Q491 VanDerWaalsContact O-N 3.15Å; Q488-Q491 WeakPolarHBondContact O-CB 3.43Å; Q488-Q491 PolarHBondContact O-N 2.74Å; Q488-Q491 VanDerWaalsContact O-N 3.15Å; H489-Q491 VanDerWaalsContact C-N 3.33Å; H489-Q491 PolarHBondContact O-N 2.92Å
492	T	91.6	Very high	90.4	Very high	114 Å²	114	67.9 Å²	67.9	70%	0.699	41%	0.405	S	S	*	.	H	α-helix	trans	-75.1	-39.4	-178.5	-54.2	0	0	0	0	113	Q488 H489	Q488-T492 PolarHBondContact O-N 3.24Å; Q488-T492 PolarHBondContact O-OG1 3.41Å; Q488-T492 VanDerWaalsContact O-OG1 3.09Å; H489-T492 PolarHBondContact O-N 3.01Å
493	T	89.2	Confident	90.3	Very high	68 Å²	68	71.2 Å²	71.2	42%	0.417	43%	0.426	S	S	.	.	H	α-helix	trans	-88.8	-16.7	-176.4	56.7	0	0	0	0	113.8	H489 V495	H489-T493 WeakPolarHBondContact CE1-CG2 3.36Å; H489-T493 WeakPolarHBondContact O-CB 3.46Å; H489-T493 PolarHBondContact O-N 3.37Å; H489-T493 PolarHBondContact O-OG1 2.97Å; T493-V495 PolarHBondContact O-N 3.34Å; T493-V495 WeakPolarHBondContact OG1-CG2 3.11Å
494	G	84.5	Confident	90.2	Very high	62 Å²	62	71.8 Å²	71.8	64%	0.639	43%	0.43	S	S	*	.			trans	69.1	13.3	-175.9	0	0	0	0	0	114.1	L490 S496	L490-G494 WeakPolarHBondContact O-CA 3.42Å; L490-G494 PolarHBondContact O-N 3.3Å; G494-S496 PolarHBondContact O-N 3.27Å
495	V	87.9	Confident	90	Very high	62 Å²	62	72.7 Å²	72.7	38%	0.376	43%	0.427	S	S	.	.			trans	-66.7	122.2	177.5	175.7	0	0	0	0	109.5	L490 T493 V533	L490-V495 HydrophobicContact CD2-CB 4.21Å; L490-V495 HydrophobicContact CD2-CG1 4.38Å; T493-V495 PolarHBondContact O-N 3.34Å; T493-V495 WeakPolarHBondContact OG1-CG2 3.11Å; V495-V533 HydrophobicContact CG1-CG1 3.78Å; V495-V533 HydrophobicContact CG1-CG2 4.32Å
496	S	86.1	Confident	89.9	Confident	84 Å²	84	70.9 Å²	70.9	59%	0.587	42%	0.42	S	S	*	.			trans	-88.3	137.5	179.6	-180	0	0	0	0	111.9	G494 G498	G494-S496 PolarHBondContact O-N 3.27Å; S496-G498 VanDerWaalsContact C-N 3.29Å; S496-G498 PolarHBondContact OG-N 2.92Å
497	L	88.4	Confident	89.7	Confident	22 Å²	22	73 Å²	73	12%	0.115	43%	0.431	C	S	.	.			trans	-88.4	10.4	172.6	-60.2	-178	0	0	0	113.3	F486 L490 G499 V500 L502 A530 V533	F486-L497 HydrophobicContact CE1-CD1 4.39Å; F486-L497 HydrophobicContact CZ-CD2 4.21Å; L490-L497 HydrophobicContact CD1-CD1 3.7Å; L490-L497 HydrophobicContact CD1-CD2 4.41Å; L490-L497 HydrophobicContact CD1-CG 4.04Å; L490-L497 HydrophobicContact CD2-CD2 4.06Å; L490-L497 HydrophobicContact CD2-CG 4.3Å; L497-G499 PolarHBondContact O-N 3.33Å; L497-V500 WeakPolarHBondContact CB-O 3.35Å; L497-V500 PolarHBondContact O-N 3.11Å; L497-L502 HydrophobicContact CD1-CB 4.17Å; L497-A530 HydrophobicContact CB-CB 4.28Å; L497-A530 HydrophobicContact CD2-CB 4.25Å; L497-V533 HydrophobicContact CD2-CB 4Å; L497-V533 HydrophobicContact CD2-CG1 3.9Å; L497-V533 HydrophobicContact CD2-CG2 4.42Å
498	G	81	Confident	89.7	Confident	56 Å²	56	70.8 Å²	70.8	58%	0.577	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	35.1	177.9	0	0	0	0	0	113.9	S496 V500	S496-G498 VanDerWaalsContact C-N 3.29Å; S496-G498 PolarHBondContact OG-N 2.92Å; G498-V500 VanDerWaalsContact C-N 3.34Å; G498-V500 PolarHBondContact O-N 3.06Å
499	G	82.8	Confident	89.4	Confident	83 Å²	83	71 Å²	71	86%	0.856	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	6.2	178.3	0	0	0	0	0	115.3	L497	L497-G499 PolarHBondContact O-N 3.33Å
500	V	90.3	Very high	88.9	Confident	41 Å²	41	69.6 Å²	69.6	25%	0.248	44%	0.444	C	S	.	.			trans	-91.3	122.3	175.2	-179.5	0	0	0	0	110.3	L497 G498 L502 A530	L497-V500 WeakPolarHBondContact CB-O 3.35Å; L497-V500 PolarHBondContact O-N 3.11Å; G498-V500 VanDerWaalsContact C-N 3.34Å; G498-V500 PolarHBondContact O-N 3.06Å; V500-L502 PolarHBondContact O-N 2.82Å; V500-A530 HydrophobicContact CB-CB 4.1Å; V500-A530 HydrophobicContact CG1-CB 4.11Å
501	D	90.9	Very high	88.7	Confident	148 Å²	148	72.3 Å²	72.3	79%	0.791	45%	0.453	S	S	*	.			trans	-82.3	107.5	165.5	-176.9	14.1	0	0	0	109.4
502	L	92.4	Very high	88.7	Confident	31 Å²	31	65 Å²	65	16%	0.162	42%	0.418	C	S	.	.			trans	-104.6	128.7	-175	-179.1	67.7	0	0	0	110.3	M483 L497 V500 V504 A530 F534	M483-L502 WeakPolarHBondContact CE-O 3.47Å; L497-L502 HydrophobicContact CD1-CB 4.17Å; V500-L502 PolarHBondContact O-N 2.82Å; L502-V504 HydrophobicContact CD1-CG2 3.91Å; L502-V504 HydrophobicContact CD2-CG2 3.74Å; L502-V504 HydrophobicContact CG-CG2 3.68Å; L502-A530 HydrophobicContact CD2-CB 4.23Å; L502-A530 WeakPolarHBondContact CD2-O 3.2Å; L502-F534 HydrophobicContact CD2-CB 3.93Å
503	T	91.9	Very high	88.1	Confident	78 Å²	78	62.2 Å²	62.2	48%	0.479	40%	0.402	S	S	.	.			trans	-123.6	120.9	165.8	-64.5	0	0	0	0	109	M483	M483-T503 HydrophobicContact CG-CG2 4.48Å
504	V	92.1	Very high	87.2	Confident	19 Å²	19	61.3 Å²	61.3	12%	0.115	40%	0.397	C	S	.	.			trans	-111.5	136.3	-178.7	-173.1	0	0	0	0	110.4	S479 L502 V506 F534	S479-V504 PolarHBondContact OG-O 2.87Å; L502-V504 HydrophobicContact CD1-CG2 3.91Å; L502-V504 HydrophobicContact CD2-CG2 3.74Å; L502-V504 HydrophobicContact CG-CG2 3.68Å; V504-V506 HydrophobicContact CG1-CG2 4.21Å; V504-F534 HydrophobicContact CB-CD1 4.14Å; V504-F534 HydrophobicContact CB-CD2 4.36Å; V504-F534 HydrophobicContact CB-CE1 3.83Å; V504-F534 HydrophobicContact CB-CE2 4.06Å; V504-F534 HydrophobicContact CB-CG 4.4Å; V504-F534 HydrophobicContact CB-CZ 3.78Å; V504-F534 HydrophobicContact CG1-CD1 4.03Å; V504-F534 HydrophobicContact CG1-CE1 3.53Å; V504-F534 HydrophobicContact CG1-CZ 3.86Å; V504-F534 HydrophobicContact CG2-CB 4.5Å; V504-F534 HydrophobicContact CG2-CD1 3.85Å; V504-F534 HydrophobicContact CG2-CD2 4.1Å; V504-F534 HydrophobicContact CG2-CE1 4.09Å; V504-F534 HydrophobicContact CG2-CE2 4.31Å; V504-F534 HydrophobicContact CG2-CG 3.87Å; V504-F534 HydrophobicContact CG2-CZ 4.31Å
505	R	91	Very high	86.2	Confident	106 Å²	106	63.7 Å²	63.7	40%	0.4	39%	0.391	S	S	.	.			trans	-109.3	113.8	168.8	-67.2	-172.4	-177.9	116.6	-1.8	110.6	L440 M476 S479 L507	L440-R505 PolarHBondContact O-NH1 3.38Å; M476-R505 HydrophobicContact CE-CB 4.48Å; S479-R505 VanDerWaalsContact OG-CA 3.23Å; S479-R505 WeakPolarHBondContact OG-CA 3.37Å; R505-L507 HydrophobicContact CB-CD2 4.27Å
506	V	92.3	Very high	84.8	Confident	24 Å²	24	66.8 Å²	66.8	15%	0.145	42%	0.416	C	S	.	.			trans	-93.3	121.4	179.2	-174.1	0	0	0	0	109.5	S479 V504 F534 Y538 L547	S479-V506 PolarHBondContact OG-N 3.48Å; V504-V506 HydrophobicContact CG1-CG2 4.21Å; V506-F534 HydrophobicContact CG2-CE1 3.97Å; V506-F534 HydrophobicContact CG2-CZ 3.82Å; V506-Y538 HydrophobicContact CB-CE2 4.28Å; V506-Y538 HydrophobicContact CG1-CE1 4.5Å; V506-Y538 HydrophobicContact CG1-CE2 3.99Å; V506-Y538 HydrophobicContact CG2-CD2 4.18Å; V506-Y538 HydrophobicContact CG2-CE2 3.94Å; V506-L547 HydrophobicContact CG1-CD2 3.96Å
507	L	91.3	Very high	83.8	Confident	45 Å²	45	66.3 Å²	66.3	24%	0.236	42%	0.417	C	S	.	.			trans	-118.3	136.1	-172	-48.3	-176	0	0	0	110.4	L440 M476 R505 T509 W512	L440-L507 HydrophobicContact CD2-CD1 4.08Å; L440-L507 HydrophobicContact CD2-CD2 4.29Å; M476-L507 HydrophobicContact CE-CD2 3.14Å; R505-L507 HydrophobicContact CB-CD2 4.27Å; L507-T509 PolarHBondContact O-N 3.34Å; L507-W512 HydrophobicContact CB-CD2 4.34Å; L507-W512 HydrophobicContact CB-CG 4.08Å; L507-W512 HydrophobicContact CD1-CD2 3.96Å; L507-W512 HydrophobicContact CD1-CE3 4.15Å; L507-W512 HydrophobicContact CD1-CG 4.21Å; L507-W512 HydrophobicContact CD2-CD2 4.29Å; L507-W512 HydrophobicContact CD2-CH2 4.26Å; L507-W512 HydrophobicContact CD2-CZ2 3.75Å; L507-W512 HydrophobicContact CG-CD2 4.43Å
508	T	92.3	Very high	82.9	Confident	58 Å²	58	67.5 Å²	67.5	36%	0.356	43%	0.425	S	S	.	.			trans	-74.3	124.5	178.2	-61.6	0	0	0	0	110.6	D475 G510 Y511	D475-T508 PolarHBondContact OD1-OG1 3.5Å; D475-T508 VanDerWaalsContact OD2-CB 3.27Å; D475-T508 WeakPolarHBondContact OD2-CB 3.38Å; D475-T508 PolarHBondContact OD2-N 2.84Å; D475-T508 PolarHBondContact OD2-OG1 3.45Å; T508-G510 PolarHBondContact O-N 2.91Å; T508-Y511 HydrophobicContact CG2-CD2 3.86Å; T508-Y511 HydrophobicContact CG2-CE2 4Å; T508-Y511 HydrophobicContact CG2-CG 4.25Å; T508-Y511 PolarHBondContact O-N 3.31Å
509	T	86.9	Confident	82.7	Confident	131 Å²	131	65.6 Å²	65.6	80%	0.804	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	131.7	177.9	-60.2	0	0	0	0	110.1	L507	L507-T509 PolarHBondContact O-N 3.34Å
510	G	83.8	Confident	82.6	Confident	41 Å²	41	68.3 Å²	68.3	42%	0.423	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	-25.8	-177.4	0	0	0	0	0	114.9	K432 T508	K432-G510 PolarHBondContact NZ-O 3.19Å; T508-G510 PolarHBondContact O-N 2.91Å
511	Y	87.4	Confident	82.6	Confident	84 Å²	84	67 Å²	67	33%	0.329	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-34.6	172.6	-70.1	-8.1	0	0	0	112.4	K432 K468 T508	K432-Y511 WeakPolarHBondContact CE-O 3.44Å; K432-Y511 PolarHBondContact NZ-O 2.93Å; K468-Y511 HydrophobicContact CB-CD1 4.38Å; K468-Y511 HydrophobicContact CG-CD1 4.1Å; T508-Y511 HydrophobicContact CG2-CD2 3.86Å; T508-Y511 HydrophobicContact CG2-CE2 4Å; T508-Y511 HydrophobicContact CG2-CG 4.25Å; T508-Y511 PolarHBondContact O-N 3.31Å
512	W	88.3	Confident	82.6	Confident	7 Å²	7	63.4 Å²	63.4	3%	0.027	36%	0.364	C	S	.	.	S	Bend	trans	-96.3	154.2	-176.9	-64.5	78	0	0	0	112	K432 A436 L439 L440 M472 D475 M476 L507 T514	K432-W512 VanDerWaalsContact CE-C 3.48Å; A436-W512 HydrophobicContact CB-CE3 3.85Å; A436-W512 HydrophobicContact CB-CZ3 4Å; L439-W512 HydrophobicContact CB-CH2 4.18Å; L439-W512 HydrophobicContact CB-CZ3 4.44Å; L439-W512 HydrophobicContact CD1-CH2 3.99Å; L440-W512 HydrophobicContact CD1-CE3 4.24Å; L440-W512 HydrophobicContact CD1-CZ3 4.02Å; L440-W512 HydrophobicContact CD2-CH2 4.23Å; L440-W512 HydrophobicContact CD2-CZ3 3.95Å; L440-W512 HydrophobicContact CG-CE3 4.44Å; L440-W512 HydrophobicContact CG-CH2 4.4Å; L440-W512 HydrophobicContact CG-CZ3 3.74Å; M472-W512 HydrophobicContact CB-CD2 4.44Å; M472-W512 HydrophobicContact CB-CH2 4Å; M472-W512 HydrophobicContact CB-CZ2 3.61Å; M472-W512 HydrophobicContact CE-CD2 4.3Å; M472-W512 HydrophobicContact CE-CE3 3.83Å; M472-W512 HydrophobicContact CE-CH2 4.22Å; M472-W512 HydrophobicContact CE-CZ3 3.77Å; M472-W512 HydrophobicContact CG-CD2 3.87Å; M472-W512 HydrophobicContact CG-CE3 4.33Å; M472-W512 HydrophobicContact CG-CG 4.25Å; M472-W512 HydrophobicContact CG-CH2 4.41Å; M472-W512 HydrophobicContact CG-CZ2 3.96Å; M472-W512 VanDerWaalsContact O-CZ2 3.32Å; M472-W512 WeakPolarHBondContact O-CZ2 3.46Å; D475-W512 HydrophobicContact CB-CZ2 4.15Å; D475-W512 PolarHBondContact OD2-NE1 3.13Å; M476-W512 HydrophobicContact CE-CH2 3.51Å; M476-W512 HydrophobicContact CE-CZ2 3.46Å; M476-W512 VanDerWaalsContact CE-CZ2 3.46Å; M476-W512 HydrophobicContact CG-CH2 4.01Å; M476-W512 HydrophobicContact CG-CZ2 4.23Å; M476-W512 HydrophobicContact SD-CH2 4Å; M476-W512 HydrophobicContact SD-CZ2 4.41Å; L507-W512 HydrophobicContact CB-CD2 4.34Å; L507-W512 HydrophobicContact CB-CG 4.08Å; L507-W512 HydrophobicContact CD1-CD2 3.96Å; L507-W512 HydrophobicContact CD1-CE3 4.15Å; L507-W512 HydrophobicContact CD1-CG 4.21Å; L507-W512 HydrophobicContact CD2-CD2 4.29Å; L507-W512 HydrophobicContact CD2-CH2 4.26Å; L507-W512 HydrophobicContact CD2-CZ2 3.75Å; L507-W512 HydrophobicContact CG-CD2 4.43Å; W512-T514 VanDerWaalsContact C-N 3.28Å; W512-T514 HydrophobicContact CB-CG2 4.15Å; W512-T514 PolarHBondContact O-N 3.42Å
513	P	79.9	Confident	82.5	Confident	56 Å²	56	62.8 Å²	62.8	36%	0.364	36%	0.361	S	S	.	.			trans	-79.6	78.1	172.7	31.6	-29.6	0	0	0	109.2	K432 A436	K432-P513 HydrophobicContact CG-CG 4.41Å; A436-P513 HydrophobicContact CB-CG 3.55Å
514	T	69.9	Low	82.5	Confident	50 Å²	50	59.8 Å²	59.8	31%	0.307	34%	0.343	S	S	.	.			trans	-97.4	146.6	176.8	51.5	0	0	0	0	111	W512	W512-T514 VanDerWaalsContact C-N 3.28Å; W512-T514 HydrophobicContact CB-CG2 4.15Å; W512-T514 PolarHBondContact O-N 3.42Å
515	Q	64.1	Low	82.4	Confident	111 Å²	111	63.4 Å²	63.4	52%	0.519	37%	0.366	S	S	.	.			trans	-64.3	148.8	172.9	-62.8	-175	31	0	0	110.6	A517	Q515-A517 PolarHBondContact O-N 2.94Å
516	S	57.1	Low	82.3	Confident	128 Å²	128	61.3 Å²	61.3	90%	0.895	37%	0.368	S	S	*	.	S	Bend	trans	-65.5	-23.8	-178	-44.8	0	0	0	0	113.2
517	A	65.8	Low	82.3	Confident	73 Å²	73	61.6 Å²	61.6	60%	0.603	37%	0.37	S	S	*	.	S	Bend	trans	-129.6	125.8	176.4	0	0	0	0	0	110.1	Q515	Q515-A517 PolarHBondContact O-N 2.94Å
518	T	69.9	Low	82.3	Confident	47 Å²	47	64.8 Å²	64.8	29%	0.288	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-70.6	126.3	172.3	-54.6	0	0	0	0	108.9	K520 L549 Q550	T518-K520 PolarHBondContact O-N 3.01Å; T518-L549 WeakPolarHBondContact CG2-O 3.27Å; T518-Q550 PolarHBondContact OG1-NE2 2.93Å; T518-Q550 PolarHBondContact OG1-OE1 3.02Å
519	P	76.6	Confident	82.4	Confident	16 Å²	16	67 Å²	67	10%	0.104	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-56.5	132.5	171.7	-22.9	33.2	0	0	0	110.1	H551 H552 F596 P622	P519-H551 PolarHBondContact O-ND1 3.27Å; P519-H552 HydrophobicContact CG-CB 4.31Å; P519-F596 HydrophobicContact CB-CE1 4.42Å; P519-F596 HydrophobicContact CB-CZ 3.82Å; P519-F596 HydrophobicContact CG-CZ 4.2Å; P519-P622 HydrophobicContact CB-CG 4.02Å
520	K	80.7	Confident	82.7	Confident	141 Å²	141	60.8 Å²	60.8	61%	0.613	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-63.8	145.4	171.3	-62.2	-171.5	-175.3	179	0	109.5	T518 D620 P622	T518-K520 PolarHBondContact O-N 3.01Å; K520-D620 CarbonylContact C-O 3.56Å; K520-D620 VanDerWaalsContact CB-O 3.31Å; K520-D620 WeakPolarHBondContact CB-O 3.49Å; K520-D620 WeakPolarHBondContact CB-OD2 3.24Å; K520-D620 WeakPolarHBondContact CD-OD2 3.4Å; K520-P622 WeakPolarHBondContact O-CD 3.4Å
521	C	89.4	Confident	83.1	Confident	12 Å²	12	60.1 Å²	60.1	8%	0.081	33%	0.332	C	S	.	.			trans	-166.8	123.1	178.5	-172.3	0	0	0	0	109.5	I523 H551 F596 T619 I621	C521-I523 PolarHBondContact O-N 2.93Å; C521-H551 HydrophobicContact CB-CB 3.98Å; C521-F596 HydrophobicContact CB-CD1 4.39Å; C521-F596 HydrophobicContact CB-CE1 4.04Å; C521-T619 CarbonylContact C-O 3.5Å; C521-T619 WeakPolarHBondContact CA-O 3.39Å; C521-I621 HydrophobicContact CB-CG1 4.43Å
522	N	91.9	Very high	83.4	Confident	73 Å²	73	59 Å²	59	39%	0.39	33%	0.33	S	S	.	.			trans	-83.2	91.6	173.9	-70.3	-27	0	0	0	110	T599 E618 T619	N522-T599 WeakPolarHBondContact O-CG2 3.29Å; N522-E618 WeakPolarHBondContact CB-O 3.34Å; N522-E618 PolarHBondContact ND2-O 3.4Å; N522-T619 PolarHBondContact N-O 3.41Å
523	I	90.6	Very high	83.7	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.097	34%	0.335	C	S	.	.			trans	-62.1	138.1	179.2	-59	179	0	0	0	110.9	C521 P527 R528 L549 M598	C521-I523 PolarHBondContact O-N 2.93Å; I523-P527 HydrophobicContact CG2-CB 3.85Å; I523-R528 HydrophobicContact CB-CB 4.47Å; I523-R528 HydrophobicContact CG2-CB 4.29Å; I523-R528 PolarHBondContact O-NE 3.1Å; I523-R528 VanDerWaalsContact O-NE 3.09Å; I523-R528 PolarHBondContact O-NH2 2.93Å; I523-L549 HydrophobicContact CD1-CD2 3.26Å; I523-L549 HydrophobicContact CD1-CG 4.46Å; I523-M598 HydrophobicContact CG2-CE 4.41Å
524	P	91.3	Very high	84.4	Confident	15 Å²	15	57.1 Å²	57.1	10%	0.097	32%	0.319	C	S	.	.			trans	-54.9	156	177	-26	35.2	0	0	0	114.2	S526 P527 R528 M602	P524-S526 PolarHBondContact O-N 3.47Å; P524-P527 WeakPolarHBondContact O-CD 3.4Å; P524-R528 VanDerWaalsContact O-CB 3.23Å; P524-R528 WeakPolarHBondContact O-CB 3.37Å; P524-R528 PolarHBondContact O-N 2.91Å; P524-M602 HydrophobicContact CB-CB 4.28Å; P524-M602 HydrophobicContact CB-CG 4.4Å; P524-M602 HydrophobicContact CG-CB 3.79Å; P524-M602 HydrophobicContact CG-CG 3.92Å
525	P	90.1	Very high	85.5	Confident	95 Å²	95	58.5 Å²	58.5	62%	0.617	32%	0.318	S	S	*	.	H	α-helix	trans	-55.7	-44	-173.2	-28.4	35.8	0	0	0	115.5	R528 H529	P525-R528 PolarHBondContact O-N 3.39Å; P525-H529 WeakPolarHBondContact O-CB 3.42Å; P525-H529 PolarHBondContact O-N 3.44Å
526	S	89.8	Confident	86.9	Confident	62 Å²	62	62.3 Å²	62.3	43%	0.434	33%	0.328	S	S	.	.	H	α-helix	trans	-67.4	-51.1	-175.2	-30.4	0	0	0	0	112.9	P524 R528 H529 A530	P524-S526 PolarHBondContact O-N 3.47Å; S526-R528 VanDerWaalsContact C-N 3.3Å; S526-R528 PolarHBondContact O-N 2.83Å; S526-H529 PolarHBondContact O-N 2.74Å; S526-A530 PolarHBondContact O-N 3.28Å; S526-A530 VanDerWaalsContact O-N 3.14Å
527	P	91.4	Very high	88.7	Confident	29 Å²	29	57.8 Å²	57.8	19%	0.188	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-33	173.2	-21.8	33.6	0	0	0	113.4	I523 P524 A530 F531 M598	I523-P527 HydrophobicContact CG2-CB 3.85Å; P524-P527 WeakPolarHBondContact O-CD 3.4Å; P527-A530 PolarHBondContact O-N 3.36Å; P527-F531 PolarHBondContact O-N 3.02Å; P527-M598 HydrophobicContact CB-CE 4.45Å; P527-M598 HydrophobicContact CG-CE 4.28Å; P527-M598 HydrophobicContact CG-SD 4.21Å
528	R	92.1	Very high	90.1	Very high	113 Å²	113	54.8 Å²	54.8	43%	0.426	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-44.4	175.2	-175.7	-172.2	-63.2	154.6	-7.2	111.4	I523 P524 P525 S526 F531 E532	I523-R528 HydrophobicContact CB-CB 4.47Å; I523-R528 HydrophobicContact CG2-CB 4.29Å; I523-R528 PolarHBondContact O-NE 3.1Å; I523-R528 VanDerWaalsContact O-NE 3.09Å; I523-R528 PolarHBondContact O-NH2 2.93Å; P524-R528 VanDerWaalsContact O-CB 3.23Å; P524-R528 WeakPolarHBondContact O-CB 3.37Å; P524-R528 PolarHBondContact O-N 2.91Å; P525-R528 PolarHBondContact O-N 3.39Å; S526-R528 VanDerWaalsContact C-N 3.3Å; S526-R528 PolarHBondContact O-N 2.83Å; R528-F531 PolarHBondContact O-N 3.14Å; R528-E532 PolarHBondContact O-N 3.23Å
529	H	92.9	Very high	91.3	Very high	104 Å²	104	55.3 Å²	55.3	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-48.7	175.8	178.6	70.2	0	0	0	111.4	P525 S526 F531 E532 V533	P525-H529 WeakPolarHBondContact O-CB 3.42Å; P525-H529 PolarHBondContact O-N 3.44Å; S526-H529 PolarHBondContact O-N 2.74Å; H529-F531 VanDerWaalsContact C-N 3.29Å; H529-F531 PolarHBondContact O-N 2.64Å; H529-E532 PolarHBondContact O-N 3.44Å; H529-E532 VanDerWaalsContact O-N 3.13Å; H529-V533 WeakPolarHBondContact O-CG2 3.18Å; H529-V533 PolarHBondContact O-N 2.83Å
530	A	93.3	Very high	92.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-42.2	177.8	0	0	0	0	0	112.1	L497 V500 L502 S526 P527 V533 F534	L497-A530 HydrophobicContact CB-CB 4.28Å; L497-A530 HydrophobicContact CD2-CB 4.25Å; V500-A530 HydrophobicContact CB-CB 4.1Å; V500-A530 HydrophobicContact CG1-CB 4.11Å; L502-A530 HydrophobicContact CD2-CB 4.23Å; L502-A530 WeakPolarHBondContact CD2-O 3.2Å; S526-A530 PolarHBondContact O-N 3.28Å; S526-A530 VanDerWaalsContact O-N 3.14Å; P527-A530 PolarHBondContact O-N 3.36Å; A530-V533 PolarHBondContact O-N 2.95Å; A530-F534 PolarHBondContact O-N 3.38Å
531	F	93.4	Very high	92.6	Very high	27 Å²	27	56.3 Å²	56.3	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-40	175.7	179	-106.2	0	0	0	112.9	P527 R528 H529 V533 F534 R535 L549	P527-F531 PolarHBondContact O-N 3.02Å; R528-F531 PolarHBondContact O-N 3.14Å; H529-F531 VanDerWaalsContact C-N 3.29Å; H529-F531 PolarHBondContact O-N 2.64Å; F531-V533 VanDerWaalsContact C-N 3.34Å; F531-V533 PolarHBondContact O-N 2.86Å; F531-F534 PolarHBondContact O-N 2.63Å; F531-R535 WeakPolarHBondContact O-CB 3.47Å; F531-R535 PolarHBondContact O-N 3.45Å; F531-L549 HydrophobicContact CD1-CD2 4.08Å; F531-L549 HydrophobicContact CD2-CD1 4.28Å; F531-L549 HydrophobicContact CD2-CD2 4.27Å; F531-L549 HydrophobicContact CE1-CB 4.28Å; F531-L549 HydrophobicContact CE1-CD2 4.07Å; F531-L549 HydrophobicContact CE2-CD1 3.84Å; F531-L549 HydrophobicContact CE2-CD2 4.28Å; F531-L549 HydrophobicContact CE2-CG 4.47Å; F531-L549 HydrophobicContact CG-CD2 4.17Å; F531-L549 HydrophobicContact CZ-CB 4.01Å; F531-L549 HydrophobicContact CZ-CD1 4.15Å; F531-L549 HydrophobicContact CZ-CD2 4.17Å; F531-L549 HydrophobicContact CZ-CG 4.36Å
532	E	92.9	Very high	92.7	Very high	60 Å²	60	57.8 Å²	57.8	28%	0.28	29%	0.294	S	S	.	.	H	α-helix	trans	-66.6	-34.1	177.7	-77.6	-62.8	141.6	0	0	112.5	R528 H529 R535 R536	R528-E532 PolarHBondContact O-N 3.23Å; H529-E532 PolarHBondContact O-N 3.44Å; H529-E532 VanDerWaalsContact O-N 3.13Å; E532-R535 PolarHBondContact O-N 3.43Å; E532-R535 WeakPolarHBondContact OE1-CD 3.3Å; E532-R535 IonicContact OE1-CZ 2.8Å; E532-R535 IonicContact OE1-NH1 3.27Å; E532-R535 PolarHBondContact OE1-NH1 2.96Å; E532-R536 WeakPolarHBondContact O-CG 3.39Å; E532-R536 PolarHBondContact O-N 3.23Å
533	V	94.4	Very high	92.7	Very high	23 Å²	23	59.6 Å²	59.6	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-49.1	170.4	174.3	0	0	0	0	110.5	F486 L490 V495 L497 H529 A530 F531 R535 R536 F537	F486-V533 HydrophobicContact CE2-CG1 4.16Å; F486-V533 HydrophobicContact CZ-CG1 4.13Å; L490-V533 HydrophobicContact CD2-CG1 4.23Å; V495-V533 HydrophobicContact CG1-CG1 3.78Å; V495-V533 HydrophobicContact CG1-CG2 4.32Å; L497-V533 HydrophobicContact CD2-CB 4Å; L497-V533 HydrophobicContact CD2-CG1 3.9Å; L497-V533 HydrophobicContact CD2-CG2 4.42Å; H529-V533 WeakPolarHBondContact O-CG2 3.18Å; H529-V533 PolarHBondContact O-N 2.83Å; A530-V533 PolarHBondContact O-N 2.95Å; F531-V533 VanDerWaalsContact C-N 3.34Å; F531-V533 PolarHBondContact O-N 2.86Å; V533-R535 VanDerWaalsContact C-N 3.35Å; V533-R535 PolarHBondContact O-N 3.41Å; V533-R536 PolarHBondContact O-N 3.13Å; V533-F537 PolarHBondContact O-N 3.48Å; V533-F537 VanDerWaalsContact O-N 3.14Å
534	F	95	Very high	92.6	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.009	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-43.2	175.1	175.9	-92.8	0	0	0	112.3	F486 L502 V504 V506 A530 F531 R536 F537 Y538 L547	F486-F534 HydrophobicContact CB-CD2 4.4Å; F486-F534 HydrophobicContact CB-CE2 4.45Å; F486-F534 AromaticContact CD1-CD2 3.8Å; F486-F534 HydrophobicContact CD1-CD2 3.8Å; F486-F534 HydrophobicContact CD1-CE2 4.5Å; F486-F534 HydrophobicContact CD2-CD2 4.03Å; F486-F534 HydrophobicContact CE1-CB 4.21Å; F486-F534 AromaticContact CE1-CD2 3.97Å; F486-F534 HydrophobicContact CE1-CD2 3.97Å; F486-F534 HydrophobicContact CE2-CB 4.16Å; F486-F534 HydrophobicContact CE2-CD2 4.2Å; F486-F534 AromaticContact CG-CD2 3.81Å; F486-F534 HydrophobicContact CG-CD2 3.81Å; F486-F534 HydrophobicContact CG-CE2 4.34Å; F486-F534 HydrophobicContact CZ-CB 3.82Å; F486-F534 HydrophobicContact CZ-CD2 4.16Å; L502-F534 HydrophobicContact CD2-CB 3.93Å; V504-F534 HydrophobicContact CB-CD1 4.14Å; V504-F534 HydrophobicContact CB-CD2 4.36Å; V504-F534 HydrophobicContact CB-CE1 3.83Å; V504-F534 HydrophobicContact CB-CE2 4.06Å; V504-F534 HydrophobicContact CB-CG 4.4Å; V504-F534 HydrophobicContact CB-CZ 3.78Å; V504-F534 HydrophobicContact CG1-CD1 4.03Å; V504-F534 HydrophobicContact CG1-CE1 3.53Å; V504-F534 HydrophobicContact CG1-CZ 3.86Å; V504-F534 HydrophobicContact CG2-CB 4.5Å; V504-F534 HydrophobicContact CG2-CD1 3.85Å; V504-F534 HydrophobicContact CG2-CD2 4.1Å; V504-F534 HydrophobicContact CG2-CE1 4.09Å; V504-F534 HydrophobicContact CG2-CE2 4.31Å; V504-F534 HydrophobicContact CG2-CG 3.87Å; V504-F534 HydrophobicContact CG2-CZ 4.31Å; V506-F534 HydrophobicContact CG2-CE1 3.97Å; V506-F534 HydrophobicContact CG2-CZ 3.82Å; A530-F534 PolarHBondContact O-N 3.38Å; F531-F534 PolarHBondContact O-N 2.63Å; F534-R536 PolarHBondContact O-N 2.82Å; F534-F537 WeakPolarHBondContact O-CB 3.18Å; F534-F537 PolarHBondContact O-N 3.33Å; F534-Y538 HydrophobicContact CE1-CD2 4.5Å; F534-Y538 HydrophobicContact CZ-CD2 4.23Å; F534-Y538 WeakPolarHBondContact O-CB 3.27Å; F534-Y538 PolarHBondContact O-N 3.06Å; F534-L547 HydrophobicContact CE1-CD1 4.48Å
535	R	93.9	Very high	92.6	Very high	79 Å²	79	69 Å²	69	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-59.8	-44.7	-179.7	-175.5	-176.3	-173.8	173.6	1.9	111.5	F531 E532 V533 Y538 L539 L547	F531-R535 WeakPolarHBondContact O-CB 3.47Å; F531-R535 PolarHBondContact O-N 3.45Å; E532-R535 PolarHBondContact O-N 3.43Å; E532-R535 WeakPolarHBondContact OE1-CD 3.3Å; E532-R535 IonicContact OE1-CZ 2.8Å; E532-R535 IonicContact OE1-NH1 3.27Å; E532-R535 PolarHBondContact OE1-NH1 2.96Å; V533-R535 VanDerWaalsContact C-N 3.35Å; V533-R535 PolarHBondContact O-N 3.41Å; R535-Y538 PolarHBondContact O-N 3.2Å; R535-L539 HydrophobicContact CG-CD1 3.85Å; R535-L539 HydrophobicContact CG-CG 4.36Å; R535-L539 WeakPolarHBondContact O-CB 3.39Å; R535-L539 VanDerWaalsContact O-CG 3.28Å; R535-L539 WeakPolarHBondContact O-CG 3.31Å; R535-L539 PolarHBondContact O-N 3.35Å; R535-L547 HydrophobicContact CG-CD1 4.16Å
536	R	93.3	Very high	92.6	Very high	190 Å²	190	72.4 Å²	72.4	72%	0.717	38%	0.381	S	S	*	.	H	α-helix	trans	-63.2	-45.1	176.6	-72.2	174.5	-175	-177.5	0.2	111.7	E532 V533 F534 Y538 G540	E532-R536 WeakPolarHBondContact O-CG 3.39Å; E532-R536 PolarHBondContact O-N 3.23Å; V533-R536 PolarHBondContact O-N 3.13Å; F534-R536 PolarHBondContact O-N 2.82Å; R536-Y538 PolarHBondContact O-N 2.91Å; R536-G540 PolarHBondContact O-N 3.11Å
537	F	94.8	Very high	92.7	Very high	34 Å²	34	70.8 Å²	70.8	15%	0.149	37%	0.367	C	S	.	.	H	α-helix	trans	-56.4	-50.8	174	164.9	-97.7	0	0	0	111.5	T482 E485 F486 H489 V533 F534 G540 K541	T482-F537 HydrophobicContact CG2-CE1 4.18Å; E485-F537 HydrophobicContact CB-CZ 4.13Å; F486-F537 HydrophobicContact CB-CD1 4.01Å; F486-F537 HydrophobicContact CB-CE1 3.65Å; F486-F537 HydrophobicContact CB-CZ 4.06Å; F486-F537 HydrophobicContact CD2-CB 3.91Å; F486-F537 AromaticContact CD2-CD1 3.51Å; F486-F537 HydrophobicContact CD2-CD1 3.51Å; F486-F537 HydrophobicContact CD2-CD2 4.16Å; F486-F537 HydrophobicContact CD2-CE1 4.04Å; F486-F537 AromaticContact CD2-CG 3.59Å; F486-F537 HydrophobicContact CD2-CG 3.59Å; F486-F537 HydrophobicContact CE2-CB 4.04Å; F486-F537 HydrophobicContact CE2-CD1 4.39Å; F486-F537 HydrophobicContact CE2-CG 4.23Å; F486-F537 HydrophobicContact CG-CD1 4.13Å; F486-F537 HydrophobicContact CG-CE1 4.28Å; H489-F537 HydrophobicContact CB-CD2 4.09Å; H489-F537 HydrophobicContact CB-CE2 3.85Å; H489-F537 AromaticContact CD2-CD2 3.79Å; H489-F537 AromaticContact CG-CD2 3.8Å; V533-F537 PolarHBondContact O-N 3.48Å; V533-F537 VanDerWaalsContact O-N 3.14Å; F534-F537 WeakPolarHBondContact O-CB 3.18Å; F534-F537 PolarHBondContact O-N 3.33Å; F537-G540 PolarHBondContact O-N 3.25Å; F537-K541 PolarHBondContact O-N 3.33Å
538	Y	95.1	Very high	92.5	Very high	10 Å²	10	73.4 Å²	73.4	4%	0.039	38%	0.383	C	S	.	.	H	α-helix	trans	-64.2	-46.9	-177.5	-173.7	-88.6	0	0	0	112.5	T482 V506 F534 R535 R536 G540 K541 H542 R545 L547	T482-Y538 HydrophobicContact CG2-CD2 4.02Å; T482-Y538 HydrophobicContact CG2-CE2 4.29Å; V506-Y538 HydrophobicContact CB-CE2 4.28Å; V506-Y538 HydrophobicContact CG1-CE1 4.5Å; V506-Y538 HydrophobicContact CG1-CE2 3.99Å; V506-Y538 HydrophobicContact CG2-CD2 4.18Å; V506-Y538 HydrophobicContact CG2-CE2 3.94Å; F534-Y538 HydrophobicContact CE1-CD2 4.5Å; F534-Y538 HydrophobicContact CZ-CD2 4.23Å; F534-Y538 WeakPolarHBondContact O-CB 3.27Å; F534-Y538 PolarHBondContact O-N 3.06Å; R535-Y538 PolarHBondContact O-N 3.2Å; R536-Y538 PolarHBondContact O-N 2.91Å; Y538-G540 VanDerWaalsContact C-N 3.32Å; Y538-G540 PolarHBondContact O-N 2.88Å; Y538-K541 PolarHBondContact O-N 2.86Å; Y538-H542 HydrophobicContact CD1-CB 4.41Å; Y538-H542 AromaticContact CD2-CD2 3.79Å; Y538-H542 HydrophobicContact CE1-CB 4.04Å; Y538-H542 AromaticContact CE1-CD2 3.87Å; Y538-H542 AromaticContact CE2-CD2 3.47Å; Y538-H542 VanDerWaalsContact CE2-CD2 3.47Å; Y538-H542 WeakPolarHBondContact CE2-CD2 3.49Å; Y538-H542 AromaticContact CE2-NE2 3.92Å; Y538-H542 AromaticContact CZ-CD2 3.51Å; Y538-H542 WeakPolarHBondContact O-CB 3.25Å; Y538-H542 PolarHBondContact O-CD2 3.13Å; Y538-H542 PolarHBondContact O-N 2.91Å; Y538-R545 PolarHBondContact OH-NH1 3.43Å; Y538-L547 HydrophobicContact CD1-CD1 3.58Å; Y538-L547 HydrophobicContact CD1-CD2 3.89Å; Y538-L547 HydrophobicContact CD1-CG 3.87Å; Y538-L547 HydrophobicContact CE1-CD1 4.32Å; Y538-L547 HydrophobicContact CE1-CD2 3.76Å; Y538-L547 HydrophobicContact CE1-CG 4.18Å; Y538-L547 HydrophobicContact CG-CD1 3.91Å
539	L	94.6	Very high	92.3	Very high	57 Å²	57	70.8 Å²	70.8	30%	0.298	38%	0.377	S	S	.	.	H	α-helix	trans	-70.7	-28.3	-179.2	-67	178.7	0	0	0	112.7	R535 K541 H542 R545 L547	R535-L539 HydrophobicContact CG-CD1 3.85Å; R535-L539 HydrophobicContact CG-CG 4.36Å; R535-L539 WeakPolarHBondContact O-CB 3.39Å; R535-L539 VanDerWaalsContact O-CG 3.28Å; R535-L539 WeakPolarHBondContact O-CG 3.31Å; R535-L539 PolarHBondContact O-N 3.35Å; L539-K541 VanDerWaalsContact C-N 3.32Å; L539-H542 CarbonylContact O-C 3.42Å; L539-R545 HydrophobicContact CD2-CB 4.39Å; L539-R545 WeakPolarHBondContact CD2-O 3.32Å; L539-L547 HydrophobicContact CD2-CG 4.49Å
540	G	92.6	Very high	92	Very high	70 Å²	70	68 Å²	68	72%	0.722	36%	0.364	S	S	*	.	H	α-helix	trans	-64.5	-36	171.5	0	0	0	0	0	112.6	R536 F537 Y538	R536-G540 PolarHBondContact O-N 3.11Å; F537-G540 PolarHBondContact O-N 3.25Å; Y538-G540 VanDerWaalsContact C-N 3.32Å; Y538-G540 PolarHBondContact O-N 2.88Å
541	K	92	Very high	91.6	Very high	108 Å²	108	69.2 Å²	69.2	47%	0.47	37%	0.37	S	S	.	.	H	α-helix	trans	-84.5	-27.6	176.5	-169.9	169.8	179.7	171.6	0	113.4	E485 F537 Y538 L539	E485-K541 IonicContact OE1-NZ 3.61Å; E485-K541 PolarHBondContact OE1-NZ 2.93Å; E485-K541 IonicContact OE2-NZ 3.54Å; E485-K541 PolarHBondContact OE2-NZ 3.39Å; F537-K541 PolarHBondContact O-N 3.33Å; Y538-K541 PolarHBondContact O-N 2.86Å; L539-K541 VanDerWaalsContact C-N 3.32Å
542	H	91.8	Very high	90.9	Very high	43 Å²	43	70.6 Å²	70.6	20%	0.199	38%	0.377	C	S	.	.	S	Bend	trans	-124.9	80.2	-176	-60	-67	0	0	0	111.7	Y538 L539 R545	Y538-H542 HydrophobicContact CD1-CB 4.41Å; Y538-H542 AromaticContact CD2-CD2 3.79Å; Y538-H542 HydrophobicContact CE1-CB 4.04Å; Y538-H542 AromaticContact CE1-CD2 3.87Å; Y538-H542 AromaticContact CE2-CD2 3.47Å; Y538-H542 VanDerWaalsContact CE2-CD2 3.47Å; Y538-H542 WeakPolarHBondContact CE2-CD2 3.49Å; Y538-H542 AromaticContact CE2-NE2 3.92Å; Y538-H542 AromaticContact CZ-CD2 3.51Å; Y538-H542 WeakPolarHBondContact O-CB 3.25Å; Y538-H542 PolarHBondContact O-CD2 3.13Å; Y538-H542 PolarHBondContact O-N 2.91Å; L539-H542 CarbonylContact O-C 3.42Å; H542-R545 HydrophobicContact CB-CG 4.21Å
543	S	90.4	Very high	90.3	Very high	112 Å²	112	71.5 Å²	71.5	78%	0.783	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	146	176.9	58.3	0	0	0	0	112.2	R545	S543-R545 VanDerWaalsContact C-N 3.31Å; S543-R545 PolarHBondContact O-N 2.88Å
544	G	89.1	Confident	89.8	Confident	92 Å²	92	71.8 Å²	71.8	95%	0.948	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	5.8	179.1	0	0	0	0	0	115.7
545	R	92.5	Very high	89.5	Confident	139 Å²	139	76.6 Å²	76.6	53%	0.525	42%	0.424	S	S	.	.			trans	-97.8	155.4	175.5	-61.3	-165.1	-177.8	-175.9	-3.8	112.3	Y538 L539 H542 S543	Y538-R545 PolarHBondContact OH-NH1 3.43Å; L539-R545 HydrophobicContact CD2-CB 4.39Å; L539-R545 WeakPolarHBondContact CD2-O 3.32Å; H542-R545 HydrophobicContact CB-CG 4.21Å; S543-R545 VanDerWaalsContact C-N 3.31Å; S543-R545 PolarHBondContact O-N 2.88Å
546	Q	89.8	Confident	89.4	Confident	166 Å²	166	73.8 Å²	73.8	78%	0.776	42%	0.417	S	S	*	.			trans	-120.3	131.7	169.5	-173.3	179.2	9.6	0	0	109.5
547	L	90.5	Very high	89.3	Confident	28 Å²	28	68.2 Å²	68.2	15%	0.147	40%	0.401	C	S	.	.			trans	-97.8	129.9	173.3	-70.3	178.8	0	0	0	110.1	V506 F534 R535 Y538 L539	V506-L547 HydrophobicContact CG1-CD2 3.96Å; F534-L547 HydrophobicContact CE1-CD1 4.48Å; R535-L547 HydrophobicContact CG-CD1 4.16Å; Y538-L547 HydrophobicContact CD1-CD1 3.58Å; Y538-L547 HydrophobicContact CD1-CD2 3.89Å; Y538-L547 HydrophobicContact CD1-CG 3.87Å; Y538-L547 HydrophobicContact CE1-CD1 4.32Å; Y538-L547 HydrophobicContact CE1-CD2 3.76Å; Y538-L547 HydrophobicContact CE1-CG 4.18Å; Y538-L547 HydrophobicContact CG-CD1 3.91Å; L539-L547 HydrophobicContact CD2-CG 4.49Å
548	T	88.4	Confident	89.3	Confident	85 Å²	85	68 Å²	68	52%	0.521	40%	0.402	S	S	.	.			trans	-120.2	120.7	172.7	-58.2	0	0	0	0	108.7
549	L	88.1	Confident	89.2	Confident	58 Å²	58	74.3 Å²	74.3	30%	0.304	44%	0.436	S	S	.	.			trans	-82.8	127.8	-176.8	-173.8	58	0	0	0	111.1	T518 I523 F531 H551	T518-L549 WeakPolarHBondContact CG2-O 3.27Å; I523-L549 HydrophobicContact CD1-CD2 3.26Å; I523-L549 HydrophobicContact CD1-CG 4.46Å; F531-L549 HydrophobicContact CD1-CD2 4.08Å; F531-L549 HydrophobicContact CD2-CD1 4.28Å; F531-L549 HydrophobicContact CD2-CD2 4.27Å; F531-L549 HydrophobicContact CE1-CB 4.28Å; F531-L549 HydrophobicContact CE1-CD2 4.07Å; F531-L549 HydrophobicContact CE2-CD1 3.84Å; F531-L549 HydrophobicContact CE2-CD2 4.28Å; F531-L549 HydrophobicContact CE2-CG 4.47Å; F531-L549 HydrophobicContact CG-CD2 4.17Å; F531-L549 HydrophobicContact CZ-CB 4.01Å; F531-L549 HydrophobicContact CZ-CD1 4.15Å; F531-L549 HydrophobicContact CZ-CD2 4.17Å; F531-L549 HydrophobicContact CZ-CG 4.36Å; L549-H551 PolarHBondContact O-N 3.45Å
550	Q	86.2	Confident	89	Confident	44 Å²	44	72.5 Å²	72.5	21%	0.206	43%	0.429	C	S	.	.			trans	-96.3	87.3	-179.2	-66.5	-61.8	-22.3	0	0	111.6	T518 H552 M553	T518-Q550 PolarHBondContact OG1-NE2 2.93Å; T518-Q550 PolarHBondContact OG1-OE1 3.02Å; Q550-H552 VanDerWaalsContact C-N 3.31Å; Q550-H552 PolarHBondContact O-N 2.66Å; Q550-H552 PolarHBondContact OE1-CE1 3.3Å; Q550-M553 HydrophobicContact CB-CB 4.34Å; Q550-M553 HydrophobicContact CB-CG 4.1Å; Q550-M553 HydrophobicContact CB-SD 3.89Å; Q550-M553 HydrophobicContact CG-SD 4.23Å; Q550-M553 PolarHBondContact O-N 3.46Å; Q550-M553 VanDerWaalsContact O-N 3.13Å
551	H	85.7	Confident	88.9	Confident	27 Å²	27	71.8 Å²	71.8	13%	0.125	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-55.2	-41	-174.1	-54.7	107.5	0	0	0	114	P519 C521 L549 M553 G554 T595 F596	P519-H551 PolarHBondContact O-ND1 3.27Å; C521-H551 HydrophobicContact CB-CB 3.98Å; L549-H551 PolarHBondContact O-N 3.45Å; H551-M553 PolarHBondContact O-N 3.31Å; H551-G554 PolarHBondContact O-N 3.42Å; H551-T595 HydrophobicContact CB-CG2 4.41Å; H551-T595 VanDerWaalsContact O-CB 3.23Å; H551-T595 WeakPolarHBondContact O-CB 3.49Å; H551-T595 PolarHBondContact O-OG1 2.87Å; H551-F596 HydrophobicContact CB-CD1 4.49Å; H551-F596 HydrophobicContact CB-CE1 3.71Å; H551-F596 HydrophobicContact CB-CZ 4.25Å
552	H	78.1	Confident	88.7	Confident	55 Å²	55	66.9 Å²	66.9	26%	0.255	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-68.8	-14.6	-177	68.8	-78.4	0	0	0	114.4	P519 Q550 F596	P519-H552 HydrophobicContact CG-CB 4.31Å; Q550-H552 VanDerWaalsContact C-N 3.31Å; Q550-H552 PolarHBondContact O-N 2.66Å; Q550-H552 PolarHBondContact OE1-CE1 3.3Å; H552-F596 HydrophobicContact CB-CE2 3.91Å; H552-F596 HydrophobicContact CB-CZ 3.94Å
553	M	79.7	Confident	88.2	Confident	80 Å²	80	70.9 Å²	70.9	39%	0.394	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-99.6	-5.6	-178.2	-56.5	-178.3	76.7	0	0	113	L440 Q550 H551	L440-M553 HydrophobicContact CD1-CE 3.27Å; Q550-M553 HydrophobicContact CB-CB 4.34Å; Q550-M553 HydrophobicContact CB-CG 4.1Å; Q550-M553 HydrophobicContact CB-SD 3.89Å; Q550-M553 HydrophobicContact CG-SD 4.23Å; Q550-M553 PolarHBondContact O-N 3.46Å; Q550-M553 VanDerWaalsContact O-N 3.13Å; H551-M553 PolarHBondContact O-N 3.31Å
554	G	84.1	Confident	87.1	Confident	29 Å²	29	65.8 Å²	65.8	30%	0.299	37%	0.37	S	S	.	.			trans	-89.5	158.8	-176.7	0	0	0	0	0	113.8	H551 T595	H551-G554 PolarHBondContact O-N 3.42Å; G554-T595 VanDerWaalsContact CA-OG1 3.27Å; G554-T595 WeakPolarHBondContact CA-OG1 3.42Å; G554-T595 PolarHBondContact O-N 3.44Å; G554-T595 PolarHBondContact O-OG1 3.06Å
555	S	88.3	Confident	85.6	Confident	103 Å²	103	64.3 Å²	64.3	72%	0.72	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	154.4	172	58.7	0	0	0	0	110.2	V593	S555-V593 CarbonylContact C-O 3.55Å; S555-V593 VanDerWaalsContact CA-O 3.23Å; S555-V593 WeakPolarHBondContact CA-O 3.35Å; S555-V593 WeakPolarHBondContact CB-O 3.31Å
556	A	91.5	Very high	83.7	Confident	20 Å²	20	64.5 Å²	64.5	17%	0.165	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	148.8	176.8	0	0	0	0	0	110.5	V593 M598	A556-V593 HydrophobicContact CB-CG2 4.41Å; A556-V593 PolarHBondContact N-O 2.83Å; A556-V593 WeakPolarHBondContact O-CG2 3.26Å; A556-V593 PolarHBondContact O-N 2.99Å; A556-M598 HydrophobicContact CB-CB 4.14Å; A556-M598 HydrophobicContact CB-CG 4.2Å; A556-M598 HydrophobicContact CB-SD 3.46Å; A556-M598 WeakPolarHBondContact CB-SD 3.02Å
557	D	93.1	Very high	81.7	Confident	72 Å²	72	65.9 Å²	65.9	39%	0.385	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.6	170.6	-79.2	6.7	0	0	0	108.1	I590 L591 Q592 R670	D557-I590 HydrophobicContact CB-CG2 4.01Å; D557-L591 CarbonylContact C-O 3.58Å; D557-L591 WeakPolarHBondContact CA-O 3.16Å; D557-Q592 WeakPolarHBondContact OD1-CB 3.45Å; D557-Q592 VanDerWaalsContact OD1-CG 3.23Å; D557-Q592 WeakPolarHBondContact OD1-CG 3.3Å; D557-Q592 PolarHBondContact OD1-NE2 3.48Å; D557-Q592 PolarHBondContact OD2-NE2 3.36Å; D557-R670 IonicContact OD2-CZ 2.97Å; D557-R670 IonicContact OD2-NE 3.7Å; D557-R670 PolarHBondContact OD2-NE 3.16Å; D557-R670 IonicContact OD2-NH2 2.61Å; D557-R670 PolarHBondContact OD2-NH2 3.48Å
558	L	93.1	Very high	79.7	Confident	30 Å²	30	71.5 Å²	71.5	16%	0.157	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.2	-177.2	-60.2	179.5	0	0	0	111.1	A560 I590 L591 V593 M598 L601	L558-A560 PolarHBondContact O-N 3.17Å; L558-I590 CarbonylContact O-C 3.57Å; L558-I590 WeakPolarHBondContact O-CA 3.38Å; L558-L591 HydrophobicContact CB-CB 4.45Å; L558-L591 PolarHBondContact N-O 3.44Å; L558-L591 PolarHBondContact O-N 3.49Å; L558-V593 HydrophobicContact CD1-CG2 3.81Å; L558-V593 HydrophobicContact CG-CG2 4.01Å; L558-M598 HydrophobicContact CD1-CB 4.13Å; L558-M598 HydrophobicContact CD1-CG 4.09Å; L558-M598 HydrophobicContact CD2-CG 3.96Å; L558-M598 HydrophobicContact CD2-SD 4.41Å; L558-M598 HydrophobicContact CG-CG 4.45Å; L558-L601 HydrophobicContact CD1-CB 4.29Å; L558-L601 HydrophobicContact CD1-CD1 4.07Å
559	N	92.7	Very high	77.9	Confident	143 Å²	143	77.6 Å²	77.6	77%	0.765	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	106.6	168.8	-67.3	-35.2	0	0	0	108.8
560	A	91.6	Very high	76.2	Confident	18 Å²	18	81.6 Å²	81.6	15%	0.149	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134	179.1	0	0	0	0	0	110.5	L558 F562 K588 H589 L591	L558-A560 PolarHBondContact O-N 3.17Å; A560-F562 HydrophobicContact CB-CD2 4.49Å; A560-F562 HydrophobicContact CB-CE2 3.69Å; A560-F562 HydrophobicContact CB-CZ 4.04Å; A560-K588 WeakPolarHBondContact O-CA 3.22Å; A560-H589 PolarHBondContact N-O 3.43Å; A560-H589 PolarHBondContact O-N 3.03Å; A560-L591 HydrophobicContact CB-CD1 3.62Å; A560-L591 HydrophobicContact CB-CG 3.77Å
561	T	90.5	Very high	74.5	Confident	56 Å²	56	83.4 Å²	83.4	34%	0.344	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.4	172.4	-56.5	0	0	0	0	108.5	Y563 T586 R587 K588	T561-Y563 HydrophobicContact CG2-CE1 4.15Å; T561-Y563 HydrophobicContact CG2-CE2 4.11Å; T561-T586 HydrophobicContact CG2-CG2 3.92Å; T561-R587 WeakPolarHBondContact CA-O 3.28Å; T561-K588 HydrophobicContact CG2-CG 4.36Å
562	F	87.8	Confident	72.8	Confident	5 Å²	5	85.6 Å²	85.6	2%	0.022	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138.3	176.4	-59.3	-87.8	0	0	0	108.9	A560 T586 R587 V642 V660 F664	A560-F562 HydrophobicContact CB-CD2 4.49Å; A560-F562 HydrophobicContact CB-CE2 3.69Å; A560-F562 HydrophobicContact CB-CZ 4.04Å; F562-T586 CarbonylContact O-C 3.38Å; F562-T586 VanDerWaalsContact O-CA 3.31Å; F562-T586 WeakPolarHBondContact O-CA 2.98Å; F562-R587 HydrophobicContact CB-CB 4.49Å; F562-R587 PolarHBondContact N-O 2.84Å; F562-R587 PolarHBondContact O-N 3.11Å; F562-V642 HydrophobicContact CE1-CG1 3.97Å; F562-V642 HydrophobicContact CZ-CG1 3.84Å; F562-V642 HydrophobicContact CZ-CG2 4.43Å; F562-V660 HydrophobicContact CD1-CG1 4.23Å; F562-V660 HydrophobicContact CE1-CG1 4.2Å; F562-F664 HydrophobicContact CD1-CB 4.18Å; F562-F664 HydrophobicContact CD2-CD1 4.08Å; F562-F664 HydrophobicContact CE1-CB 4.05Å; F562-F664 HydrophobicContact CE1-CD1 4.31Å; F562-F664 HydrophobicContact CE1-CG 4.42Å; F562-F664 AromaticContact CE2-CD1 3.61Å; F562-F664 HydrophobicContact CE2-CD1 3.61Å; F562-F664 HydrophobicContact CE2-CE1 4.18Å; F562-F664 HydrophobicContact CE2-CG 4.48Å; F562-F664 HydrophobicContact CZ-CB 4.32Å; F562-F664 AromaticContact CZ-CD1 3.73Å; F562-F664 HydrophobicContact CZ-CD1 3.73Å; F562-F664 HydrophobicContact CZ-CE1 4.41Å; F562-F664 HydrophobicContact CZ-CG 4.21Å
563	Y	81.7	Confident	71.2	Confident	126 Å²	126	90.7 Å²	90.7	49%	0.494	50%	0.497	S	S	.	.			trans	-99.3	-5.6	-168.9	-66.7	-88.3	0	0	0	114	T561 V581 T586 D662	T561-Y563 HydrophobicContact CG2-CE1 4.15Å; T561-Y563 HydrophobicContact CG2-CE2 4.11Å; Y563-V581 HydrophobicContact CD1-CG1 4.44Å; Y563-V581 HydrophobicContact CD1-CG2 4.37Å; Y563-T586 HydrophobicContact CD1-CG2 3.32Å; Y563-T586 HydrophobicContact CE1-CG2 3.59Å; Y563-T586 HydrophobicContact CG-CG2 4.13Å; Y563-D662 PolarHBondContact N-OD1 3.34Å
564	G	66.2	Low	69.4	Low	6 Å²	6	92.9 Å²	92.9	6%	0.062	51%	0.514	C	S	.	.			trans	65.9	174.8	-179.7	0	0	0	0	0	113	I566 D662	G564-I566 PolarHBondContact O-N 2.9Å; G564-D662 WeakPolarHBondContact CA-O 3.4Å
565	P	58.1	Low	67.3	Low	60 Å²	60	94.6 Å²	94.6	39%	0.39	53%	0.532	S	S	.	.			trans	-67.3	129.1	177.3	25.1	-30.7	0	0	0	111.2	K567	P565-K567 PolarHBondContact O-N 2.65Å
566	I	52.9	Low	65.1	Low	144 Å²	144	95.7 Å²	95.7	74%	0.738	53%	0.534	S	S	*	.			trans	-71.9	115.4	173.6	-58	173.3	0	0	0	108.1	G564	G564-I566 PolarHBondContact O-N 2.9Å
567	K	48.2	Very low	62.6	Low	194 Å²	194	97.9 Å²	97.9	84%	0.843	56%	0.558	S	S	*	*			trans	-87.9	121.6	170	-72	-174.7	175.1	-175.5	0	109.5	P565	P565-K567 PolarHBondContact O-N 2.65Å
568	K	47	Very low	60.4	Low	146 Å²	146	98.6 Å²	98.6	64%	0.635	58%	0.583	S	S	*	*			trans	-85.4	156.7	163.1	-73.9	-173.6	178	177.2	0	110.4	D570 G571	K568-D570 PolarHBondContact O-N 3.4Å; K568-G571 PolarHBondContact O-N 3.09Å
569	E	52.1	Low	57.8	Low	213 Å²	213	101.7 Å²	101.7	100%	0.995	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-2.6	-176.8	-80.4	-177.2	155.6	0	0	115.8
570	D	51.7	Low	55.3	Low	143 Å²	143	104.2 Å²	104.2	77%	0.765	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	25.4	179.4	-163.3	24.8	0	0	0	113.9	K568 S572	K568-D570 PolarHBondContact O-N 3.4Å; D570-S572 PolarHBondContact O-N 3.45Å
571	G	51.3	Low	52.8	Low	82 Å²	82	108.2 Å²	108.2	85%	0.845	64%	0.643	S	S	*	*	S	Bend	trans	66.4	5.6	166.6	0	0	0	0	0	117.5	K568	K568-G571 PolarHBondContact O-N 3.09Å
572	S	48.6	Very low	50.4	Low	73 Å²	73	111.9 Å²	111.9	51%	0.51	67%	0.665	S	S	.	*			trans	-106.4	131.5	177.2	46.9	0	0	0	0	112.5	D570	D570-S572 PolarHBondContact O-N 3.45Å
573	E	44.3	Very low	48.4	Very low	161 Å²	161	115 Å²	115	75%	0.752	70%	0.699	S	S	*	*			trans	-91.1	114.6	178.1	-67.7	-174.3	163.3	0	0	110.7
574	V	41.7	Very low	47.1	Very low	126 Å²	126	114.1 Å²	114.1	76%	0.764	71%	0.711	S	S	*	*			trans	-147	136	161.6	-165.1	0	0	0	0	110.1
575	G	41.8	Very low	46.9	Very low	65 Å²	65	117.9 Å²	117.9	67%	0.67	73%	0.729	S	S	*	*			trans	-80	174.3	-172.6	0	0	0	0	0	117.2
576	V	41.4	Very low	47.6	Very low	127 Å²	127	117.9 Å²	117.9	77%	0.77	73%	0.728	S	S	*	*			trans	69.9	125.1	163.5	-161.9	0	0	0	0	117.1	E608	V576-E608 WeakPolarHBondContact CG1-OE2 3.32Å
577	G	39.5	Very low	49	Very low	65 Å²	65	114.9 Å²	114.9	67%	0.67	71%	0.708	S	S	*	*	S	Bend	trans	120.5	108.8	165.3	0	0	0	0	0	112.9
578	G	47	Very low	50.9	Low	87 Å²	87	112.4 Å²	112.4	90%	0.897	70%	0.697	S	S	*	*			trans	-35.8	127.5	-172.1	0	0	0	0	0	117.6
579	A	36.9	Very low	53	Low	96 Å²	96	106.3 Å²	106.3	79%	0.793	67%	0.671	S	S	*	*			trans	-160.5	155.7	153.1	0	0	0	0	0	110.4
580	Q	40	Very low	54.9	Low	196 Å²	196	97.7 Å²	97.7	92%	0.916	63%	0.631	S	S	*	*			trans	-53.1	135.7	-161.2	-73.9	167.6	-46.5	0	0	116.9	T582	Q580-T582 PolarHBondContact O-N 3.19Å
581	V	40.8	Very low	56.9	Low	102 Å²	102	91 Å²	91	62%	0.618	60%	0.595	S	S	*	*			trans	-70.4	112.4	173.4	-179	0	0	0	0	110.3	Y563	Y563-V581 HydrophobicContact CD1-CG1 4.44Å; Y563-V581 HydrophobicContact CD1-CG2 4.37Å
582	T	40.1	Very low	58.7	Low	133 Å²	133	90 Å²	90	82%	0.816	57%	0.568	S	S	*	*			trans	-86.8	121.5	161	50	0	0	0	0	108.8	Q580 S584	Q580-T582 PolarHBondContact O-N 3.19Å; T582-S584 VanDerWaalsContact C-N 3.34Å; T582-S584 PolarHBondContact O-N 2.95Å
583	G	45.3	Very low	60.8	Low	71 Å²	71	86.7 Å²	86.7	73%	0.732	55%	0.545	S	S	*	.	S	Bend	trans	-74.8	48.5	-155.9	0	0	0	0	0	118.7
584	S	54.6	Low	62.9	Low	106 Å²	106	80.2 Å²	80.2	74%	0.741	52%	0.518	S	S	*	.	S	Bend	trans	-114.1	1.6	-176.1	-171.7	0	0	0	0	117.1	T582	T582-S584 VanDerWaalsContact C-N 3.34Å; T582-S584 PolarHBondContact O-N 2.95Å
585	N	61.7	Low	65.2	Low	85 Å²	85	75 Å²	75	46%	0.455	49%	0.487	S	S	.	.	S	Bend	trans	-140.3	19.2	179.3	-102.9	-14.1	0	0	0	115.7	R587	N585-R587 PolarHBondContact O-N 3.2Å
586	T	72.4	Confident	67.6	Low	60 Å²	60	72.4 Å²	72.4	37%	0.368	46%	0.457	S	S	.	.			trans	-75	120.9	175.9	22.6	0	0	0	0	111.8	T561 F562 Y563	T561-T586 HydrophobicContact CG2-CG2 3.92Å; F562-T586 CarbonylContact O-C 3.38Å; F562-T586 VanDerWaalsContact O-CA 3.31Å; F562-T586 WeakPolarHBondContact O-CA 2.98Å; Y563-T586 HydrophobicContact CD1-CG2 3.32Å; Y563-T586 HydrophobicContact CE1-CG2 3.59Å; Y563-T586 HydrophobicContact CG-CG2 4.13Å
587	R	83.1	Confident	70	Confident	81 Å²	81	66.3 Å²	66.3	31%	0.306	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.4	178	-61.6	174.9	-173.2	151	1.3	109.6	T561 F562 N585 F664	T561-R587 WeakPolarHBondContact CA-O 3.28Å; F562-R587 HydrophobicContact CB-CB 4.49Å; F562-R587 PolarHBondContact N-O 2.84Å; F562-R587 PolarHBondContact O-N 3.11Å; N585-R587 PolarHBondContact O-N 3.2Å; R587-F664 PolarHBondContact NH1-O 3.46Å
588	K	88.4	Confident	72.6	Confident	143 Å²	143	63.9 Å²	63.9	62%	0.622	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.3	179.6	-63.9	-177.4	-179.8	-179.9	0	110.1	A560 T561	A560-K588 WeakPolarHBondContact O-CA 3.22Å; T561-K588 HydrophobicContact CG2-CG 4.36Å
589	H	90.4	Very high	74.8	Confident	18 Å²	18	59.9 Å²	59.9	8%	0.083	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.4	176.6	-68.7	-74.8	0	0	0	110.5	A560 L591 F664 L668 H669	A560-H589 PolarHBondContact N-O 3.43Å; A560-H589 PolarHBondContact O-N 3.03Å; H589-L591 HydrophobicContact CB-CD2 4.21Å; H589-F664 AromaticContact CD2-CE1 3.82Å; H589-L668 PolarHBondContact ND1-O 2.93Å; H589-H669 WeakPolarHBondContact CA-O 3.41Å
590	I	92.3	Very high	77.5	Confident	31 Å²	31	55.3 Å²	55.3	16%	0.159	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	112	166.9	-58.3	177.4	0	0	0	107.7	D557 L558 H669 R670 V671	D557-I590 HydrophobicContact CB-CG2 4.01Å; L558-I590 CarbonylContact O-C 3.57Å; L558-I590 WeakPolarHBondContact O-CA 3.38Å; I590-H669 PolarHBondContact N-O 3.32Å; I590-R670 HydrophobicContact CB-CB 4.38Å; I590-R670 HydrophobicContact CB-CG 4.11Å; I590-R670 HydrophobicContact CG2-CG 4.13Å; I590-R670 CarbonylContact O-C 3.46Å; I590-R670 WeakPolarHBondContact O-CA 3.44Å; I590-V671 PolarHBondContact O-N 3.34Å
591	L	92.6	Very high	80.1	Confident	3 Å²	3	47 Å²	47	2%	0.016	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	117.4	178.6	-53.9	-178.5	0	0	0	109.6	D557 L558 A560 H589 V593 L601 V642 V671 I673	D557-L591 CarbonylContact C-O 3.58Å; D557-L591 WeakPolarHBondContact CA-O 3.16Å; L558-L591 HydrophobicContact CB-CB 4.45Å; L558-L591 PolarHBondContact N-O 3.44Å; L558-L591 PolarHBondContact O-N 3.49Å; A560-L591 HydrophobicContact CB-CD1 3.62Å; A560-L591 HydrophobicContact CB-CG 3.77Å; H589-L591 HydrophobicContact CB-CD2 4.21Å; L591-V593 HydrophobicContact CB-CG1 4.13Å; L591-L601 HydrophobicContact CD1-CD1 4.21Å; L591-V642 HydrophobicContact CD1-CG1 4.03Å; L591-V642 HydrophobicContact CD1-CG2 4.05Å; L591-V642 HydrophobicContact CD2-CG2 4.3Å; L591-V671 CarbonylContact C-O 3.5Å; L591-V671 WeakPolarHBondContact CA-O 3.46Å; L591-V671 HydrophobicContact CD2-CB 4.1Å; L591-I673 HydrophobicContact CB-CD1 4.38Å; L591-I673 HydrophobicContact CD1-CD1 4.28Å; L591-I673 HydrophobicContact CD2-CD1 4.33Å
592	Q	90.7	Very high	82.6	Confident	60 Å²	60	45 Å²	45	28%	0.28	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.1	170	-45.7	-161.9	-68.8	0	0	108.8	D557 R670 V671 K672 I673	D557-Q592 WeakPolarHBondContact OD1-CB 3.45Å; D557-Q592 VanDerWaalsContact OD1-CG 3.23Å; D557-Q592 WeakPolarHBondContact OD1-CG 3.3Å; D557-Q592 PolarHBondContact OD1-NE2 3.48Å; D557-Q592 PolarHBondContact OD2-NE2 3.36Å; Q592-R670 HydrophobicContact CG-CG 3.75Å; Q592-V671 PolarHBondContact N-O 2.94Å; Q592-K672 HydrophobicContact CB-CB 4.42Å; Q592-K672 HydrophobicContact CB-CG 4.34Å; Q592-I673 PolarHBondContact O-N 3Å
593	V	91.1	Very high	85	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.024	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	159.9	-170	-68.7	0	0	0	0	111.1	S555 A556 L558 L591 Q597 M598 L601 I673	S555-V593 CarbonylContact C-O 3.55Å; S555-V593 VanDerWaalsContact CA-O 3.23Å; S555-V593 WeakPolarHBondContact CA-O 3.35Å; S555-V593 WeakPolarHBondContact CB-O 3.31Å; A556-V593 HydrophobicContact CB-CG2 4.41Å; A556-V593 PolarHBondContact N-O 2.83Å; A556-V593 WeakPolarHBondContact O-CG2 3.26Å; A556-V593 PolarHBondContact O-N 2.99Å; L558-V593 HydrophobicContact CD1-CG2 3.81Å; L558-V593 HydrophobicContact CG-CG2 4.01Å; L591-V593 HydrophobicContact CB-CG1 4.13Å; V593-Q597 HydrophobicContact CB-CB 3.77Å; V593-Q597 HydrophobicContact CG1-CB 4.19Å; V593-M598 HydrophobicContact CG2-CB 3.98Å; V593-L601 HydrophobicContact CG1-CD1 4.13Å; V593-I673 HydrophobicContact CG1-CB 4.09Å; V593-I673 HydrophobicContact CG1-CD1 3.79Å; V593-I673 HydrophobicContact CG1-CG1 4.15Å
594	S	90.1	Very high	87.3	Confident	26 Å²	26	37.4 Å²	37.4	18%	0.182	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	162.2	165.4	62.1	0	0	0	0	111.4	F596 Q597 M598	S594-F596 VanDerWaalsContact C-N 3.27Å; S594-F596 PolarHBondContact O-N 3.46Å; S594-Q597 PolarHBondContact O-N 3.23Å; S594-Q597 VanDerWaalsContact OG-CD 3.26Å; S594-Q597 VanDerWaalsContact OG-CG 3.3Å; S594-Q597 WeakPolarHBondContact OG-CG 3.24Å; S594-Q597 PolarHBondContact OG-N 3.44Å; S594-Q597 PolarHBondContact OG-OE1 2.85Å; S594-M598 PolarHBondContact O-N 3.28Å
595	T	89.4	Confident	89	Confident	17 Å²	17	37.9 Å²	37.9	10%	0.104	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-36.4	176.5	-57.8	0	0	0	0	113.1	H551 G554 M598 T599	H551-T595 HydrophobicContact CB-CG2 4.41Å; H551-T595 VanDerWaalsContact O-CB 3.23Å; H551-T595 WeakPolarHBondContact O-CB 3.49Å; H551-T595 PolarHBondContact O-OG1 2.87Å; G554-T595 VanDerWaalsContact CA-OG1 3.27Å; G554-T595 WeakPolarHBondContact CA-OG1 3.42Å; G554-T595 PolarHBondContact O-N 3.44Å; G554-T595 PolarHBondContact O-OG1 3.06Å; T595-M598 HydrophobicContact CG2-CE 4.15Å; T595-M598 PolarHBondContact O-N 3.46Å; T595-T599 WeakPolarHBondContact O-CB 3.35Å; T595-T599 PolarHBondContact O-N 3.16Å; T595-T599 PolarHBondContact O-OG1 3.15Å
596	F	91.4	Very high	90.2	Very high	9 Å²	9	41 Å²	41	4%	0.039	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-48.1	175.8	-64.4	-33.9	0	0	0	111.8	P519 C521 H551 H552 S594 M598 T599 I600 I621 E625 A629	P519-F596 HydrophobicContact CB-CE1 4.42Å; P519-F596 HydrophobicContact CB-CZ 3.82Å; P519-F596 HydrophobicContact CG-CZ 4.2Å; C521-F596 HydrophobicContact CB-CD1 4.39Å; C521-F596 HydrophobicContact CB-CE1 4.04Å; H551-F596 HydrophobicContact CB-CD1 4.49Å; H551-F596 HydrophobicContact CB-CE1 3.71Å; H551-F596 HydrophobicContact CB-CZ 4.25Å; H552-F596 HydrophobicContact CB-CE2 3.91Å; H552-F596 HydrophobicContact CB-CZ 3.94Å; S594-F596 VanDerWaalsContact C-N 3.27Å; S594-F596 PolarHBondContact O-N 3.46Å; F596-M598 VanDerWaalsContact C-N 3.32Å; F596-M598 PolarHBondContact O-N 3.46Å; F596-T599 PolarHBondContact O-N 2.85Å; F596-T599 VanDerWaalsContact O-N 3.16Å; F596-I600 WeakPolarHBondContact O-CG1 3.4Å; F596-I600 PolarHBondContact O-N 3.33Å; F596-I621 HydrophobicContact CB-CD1 4Å; F596-I621 HydrophobicContact CD1-CD1 3.89Å; F596-I621 HydrophobicContact CD1-CG1 3.96Å; F596-I621 HydrophobicContact CD1-CG2 4.16Å; F596-I621 HydrophobicContact CE1-CG1 4.43Å; F596-I621 HydrophobicContact CE1-CG2 4.38Å; F596-I621 HydrophobicContact CG-CD1 4.23Å; F596-I621 HydrophobicContact CG-CG2 4.32Å; F596-E625 HydrophobicContact CD2-CB 4.13Å; F596-E625 HydrophobicContact CE2-CB 3.82Å; F596-E625 HydrophobicContact CE2-CG 4.08Å; F596-A629 HydrophobicContact CB-CB 4.24Å
597	Q	92.3	Very high	90.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.3	-41.2	175.9	-73.9	165	-31.7	0	0	111.8	V593 S594 T599 I600 L601 A629 S632 L633 T675	V593-Q597 HydrophobicContact CB-CB 3.77Å; V593-Q597 HydrophobicContact CG1-CB 4.19Å; S594-Q597 PolarHBondContact O-N 3.23Å; S594-Q597 VanDerWaalsContact OG-CD 3.26Å; S594-Q597 VanDerWaalsContact OG-CG 3.3Å; S594-Q597 WeakPolarHBondContact OG-CG 3.24Å; S594-Q597 PolarHBondContact OG-N 3.44Å; S594-Q597 PolarHBondContact OG-OE1 2.85Å; Q597-T599 PolarHBondContact O-N 3.27Å; Q597-I600 PolarHBondContact O-N 2.85Å; Q597-L601 WeakPolarHBondContact O-CB 3.47Å; Q597-L601 VanDerWaalsContact O-CG 3.29Å; Q597-L601 WeakPolarHBondContact O-CG 3.3Å; Q597-L601 PolarHBondContact O-N 3.03Å; Q597-A629 HydrophobicContact CG-CB 4.15Å; Q597-S632 PolarHBondContact NE2-OG 2.95Å; Q597-L633 HydrophobicContact CB-CD1 4.19Å; Q597-L633 HydrophobicContact CB-CD2 4.35Å; Q597-L633 HydrophobicContact CG-CD1 4.05Å; Q597-L633 HydrophobicContact CG-CD2 4.21Å; Q597-L633 HydrophobicContact CG-CG 4.06Å; Q597-T675 PolarHBondContact NE2-OG1 2.81Å
598	M	93.9	Very high	91	Very high	14 Å²	14	45 Å²	45	7%	0.069	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-48.5	173.4	169.8	-171.1	77.9	0	0	111.5	I523 P527 A556 L558 V593 S594 T595 F596 I600 L601 M602	I523-M598 HydrophobicContact CG2-CE 4.41Å; P527-M598 HydrophobicContact CB-CE 4.45Å; P527-M598 HydrophobicContact CG-CE 4.28Å; P527-M598 HydrophobicContact CG-SD 4.21Å; A556-M598 HydrophobicContact CB-CB 4.14Å; A556-M598 HydrophobicContact CB-CG 4.2Å; A556-M598 HydrophobicContact CB-SD 3.46Å; A556-M598 WeakPolarHBondContact CB-SD 3.02Å; L558-M598 HydrophobicContact CD1-CB 4.13Å; L558-M598 HydrophobicContact CD1-CG 4.09Å; L558-M598 HydrophobicContact CD2-CG 3.96Å; L558-M598 HydrophobicContact CD2-SD 4.41Å; L558-M598 HydrophobicContact CG-CG 4.45Å; V593-M598 HydrophobicContact CG2-CB 3.98Å; S594-M598 PolarHBondContact O-N 3.28Å; T595-M598 HydrophobicContact CG2-CE 4.15Å; T595-M598 PolarHBondContact O-N 3.46Å; F596-M598 VanDerWaalsContact C-N 3.32Å; F596-M598 PolarHBondContact O-N 3.46Å; M598-I600 VanDerWaalsContact C-N 3.27Å; M598-I600 PolarHBondContact O-N 2.8Å; M598-L601 PolarHBondContact O-N 3.4Å; M598-M602 HydrophobicContact CG-CG 4.21Å; M598-M602 WeakPolarHBondContact O-CB 2.98Å; M598-M602 VanDerWaalsContact O-CG 3.22Å; M598-M602 WeakPolarHBondContact O-CG 3.32Å; M598-M602 PolarHBondContact O-N 3.09Å
599	T	93.5	Very high	91.1	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-40.8	-177.5	-56.8	0	0	0	0	111	N522 T595 F596 Q597 T619	N522-T599 WeakPolarHBondContact O-CG2 3.29Å; T595-T599 WeakPolarHBondContact O-CB 3.35Å; T595-T599 PolarHBondContact O-N 3.16Å; T595-T599 PolarHBondContact O-OG1 3.15Å; F596-T599 PolarHBondContact O-N 2.85Å; F596-T599 VanDerWaalsContact O-N 3.16Å; Q597-T599 PolarHBondContact O-N 3.27Å; T599-T619 HydrophobicContact CG2-CG2 3.79Å
600	I	94.2	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-51.7	175.1	-64.1	161.7	0	0	0	111.3	F596 Q597 M598 M602 L603 F604 I615 I621 L626 A629 L630 L633 L643	F596-I600 WeakPolarHBondContact O-CG1 3.4Å; F596-I600 PolarHBondContact O-N 3.33Å; Q597-I600 PolarHBondContact O-N 2.85Å; M598-I600 VanDerWaalsContact C-N 3.27Å; M598-I600 PolarHBondContact O-N 2.8Å; I600-M602 VanDerWaalsContact C-N 3.26Å; I600-M602 PolarHBondContact O-N 2.87Å; I600-L603 WeakPolarHBondContact O-CB 3.13Å; I600-L603 PolarHBondContact O-N 3.06Å; I600-L603 VanDerWaalsContact O-N 3.16Å; I600-F604 HydrophobicContact CG2-CE2 4.21Å; I600-F604 WeakPolarHBondContact O-CD2 3.28Å; I600-I615 HydrophobicContact CG1-CG2 4.05Å; I600-I615 HydrophobicContact CG2-CG2 4.31Å; I600-I621 HydrophobicContact CD1-CD1 4.48Å; I600-I621 HydrophobicContact CG1-CD1 4.25Å; I600-L626 HydrophobicContact CD1-CD1 3.69Å; I600-L626 HydrophobicContact CG1-CD1 4.11Å; I600-A629 HydrophobicContact CD1-CB 3.62Å; I600-L630 HydrophobicContact CD1-CD2 4.26Å; I600-L630 HydrophobicContact CD1-CG 4.23Å; I600-L630 HydrophobicContact CG2-CD2 3.81Å; I600-L633 HydrophobicContact CB-CD1 4.35Å; I600-L633 HydrophobicContact CD1-CD1 4.36Å; I600-L633 HydrophobicContact CG2-CD1 4.09Å; I600-L643 HydrophobicContact CG2-CD1 4.29Å
601	L	93.9	Very high	91.3	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.11	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-34.1	-175.7	-73	173.2	0	0	0	112.5	L558 L591 V593 Q597 M598 L603 F604 L633 V642 L643	L558-L601 HydrophobicContact CD1-CB 4.29Å; L558-L601 HydrophobicContact CD1-CD1 4.07Å; L591-L601 HydrophobicContact CD1-CD1 4.21Å; V593-L601 HydrophobicContact CG1-CD1 4.13Å; Q597-L601 WeakPolarHBondContact O-CB 3.47Å; Q597-L601 VanDerWaalsContact O-CG 3.29Å; Q597-L601 WeakPolarHBondContact O-CG 3.3Å; Q597-L601 PolarHBondContact O-N 3.03Å; M598-L601 PolarHBondContact O-N 3.4Å; L601-L603 PolarHBondContact O-N 3.36Å; L601-F604 PolarHBondContact O-N 3.26Å; L601-L633 HydrophobicContact CD1-CD2 4.03Å; L601-L633 HydrophobicContact CD2-CD1 4.47Å; L601-L633 HydrophobicContact CD2-CD2 4.21Å; L601-L633 HydrophobicContact CG-CD1 4.35Å; L601-L633 HydrophobicContact CG-CD2 4.23Å; L601-V642 HydrophobicContact CD2-CG1 3.79Å; L601-L643 HydrophobicContact CD2-CD1 4.44Å; L601-L643 HydrophobicContact CD2-CD2 4.11Å; L601-L643 HydrophobicContact CD2-CG 4.22Å
602	M	92.5	Very high	91.3	Very high	59 Å²	59	44.4 Å²	44.4	29%	0.291	22%	0.219	S	C	.	.	H	α-helix	trans	-66.5	-21.7	179.7	-72.1	-63.2	-66	0	0	113.7	P524 M598 I600 F604 N605	P524-M602 HydrophobicContact CB-CB 4.28Å; P524-M602 HydrophobicContact CB-CG 4.4Å; P524-M602 HydrophobicContact CG-CB 3.79Å; P524-M602 HydrophobicContact CG-CG 3.92Å; M598-M602 HydrophobicContact CG-CG 4.21Å; M598-M602 WeakPolarHBondContact O-CB 2.98Å; M598-M602 VanDerWaalsContact O-CG 3.22Å; M598-M602 WeakPolarHBondContact O-CG 3.32Å; M598-M602 PolarHBondContact O-N 3.09Å; I600-M602 VanDerWaalsContact C-N 3.26Å; I600-M602 PolarHBondContact O-N 2.87Å; M602-F604 VanDerWaalsContact C-N 3.28Å; M602-F604 PolarHBondContact O-N 3.5Å; M602-N605 PolarHBondContact O-N 3.26Å; M602-N605 PolarHBondContact O-ND2 2.84Å; M602-N605 PolarHBondContact SD-ND2 3.28Å
603	L	92.1	Very high	91.4	Very high	25 Å²	25	46 Å²	46	13%	0.131	23%	0.226	C	C	.	.	H	α-helix	trans	-64.5	-34.6	174.8	-61.9	-178.7	0	0	0	112.1	I600 L601 N605 N606 R607 I615 E618 T619	I600-L603 WeakPolarHBondContact O-CB 3.13Å; I600-L603 PolarHBondContact O-N 3.06Å; I600-L603 VanDerWaalsContact O-N 3.16Å; L601-L603 PolarHBondContact O-N 3.36Å; L603-N605 PolarHBondContact O-N 2.8Å; L603-N606 PolarHBondContact O-N 3.06Å; L603-N606 VanDerWaalsContact O-N 3.15Å; L603-R607 PolarHBondContact O-N 3.06Å; L603-I615 HydrophobicContact CD1-CB 4.48Å; L603-I615 HydrophobicContact CD1-CG1 4.26Å; L603-I615 HydrophobicContact CD1-CG2 4.23Å; L603-E618 HydrophobicContact CD2-CG 3.94Å; L603-T619 HydrophobicContact CD1-CG2 3.74Å; L603-T619 HydrophobicContact CG-CG2 4.45Å
604	F	92.8	Very high	91.5	Very high	21 Å²	21	50 Å²	50	9%	0.092	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-4.3	-176	-68.3	-81.7	0	0	0	114.2	I600 L601 M602 R607 I615 L643 F658 V660	I600-F604 HydrophobicContact CG2-CE2 4.21Å; I600-F604 WeakPolarHBondContact O-CD2 3.28Å; L601-F604 PolarHBondContact O-N 3.26Å; M602-F604 VanDerWaalsContact C-N 3.28Å; M602-F604 PolarHBondContact O-N 3.5Å; F604-R607 CarbonylContact C-O 3.59Å; F604-R607 VanDerWaalsContact CA-O 3.32Å; F604-R607 WeakPolarHBondContact CA-O 3.39Å; F604-I615 HydrophobicContact CZ-CD1 4.31Å; F604-L643 HydrophobicContact CD2-CD2 4.04Å; F604-L643 HydrophobicContact CE2-CD1 3.95Å; F604-L643 HydrophobicContact CE2-CD2 3.9Å; F604-L643 HydrophobicContact CG-CD2 4.46Å; F604-L643 HydrophobicContact CZ-CD1 4.38Å; F604-L643 HydrophobicContact CZ-CD2 4.19Å; F604-F658 WeakPolarHBondContact CE1-O 3.3Å; F604-F658 HydrophobicContact CZ-CB 3.89Å; F604-V660 HydrophobicContact CB-CG2 3.58Å; F604-V660 HydrophobicContact CD1-CG2 3.95Å; F604-V660 HydrophobicContact CG-CG2 3.88Å
605	N	90.2	Very high	91.6	Very high	116 Å²	116	48.7 Å²	48.7	62%	0.62	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-24.3	168.5	-67.8	-43.6	0	0	0	112.2	M602 L603	M602-N605 PolarHBondContact O-N 3.26Å; M602-N605 PolarHBondContact O-ND2 2.84Å; M602-N605 PolarHBondContact SD-ND2 3.28Å; L603-N605 PolarHBondContact O-N 2.8Å
606	N	87.7	Confident	91.8	Very high	151 Å²	151	50.5 Å²	50.5	81%	0.807	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-8.8	-177.4	-61.3	-25.6	0	0	0	112.9	L603	L603-N606 PolarHBondContact O-N 3.06Å; L603-N606 VanDerWaalsContact O-N 3.15Å
607	R	86.8	Confident	91.8	Very high	91 Å²	91	57.9 Å²	57.9	34%	0.343	28%	0.277	S	S	.	.			trans	-137.9	136.1	-177.5	-63.8	-171.3	-174.7	149.9	16.2	110.9	L603 F604 S610 E618	L603-R607 PolarHBondContact O-N 3.06Å; F604-R607 CarbonylContact C-O 3.59Å; F604-R607 VanDerWaalsContact CA-O 3.32Å; F604-R607 WeakPolarHBondContact CA-O 3.39Å; R607-S610 WeakPolarHBondContact CD-OG 3.37Å; R607-E618 IonicContact CZ-OE1 3.23Å; R607-E618 IonicContact CZ-OE2 2.68Å; R607-E618 IonicContact NH1-OE2 3.99Å; R607-E618 PolarHBondContact NH1-OE2 3.24Å; R607-E618 IonicContact NH2-OE1 3.34Å; R607-E618 PolarHBondContact NH2-OE1 3.46Å; R607-E618 IonicContact NH2-OE2 2.99Å; R607-E618 PolarHBondContact NH2-OE2 3.06Å
608	E	85	Confident	91.7	Very high	134 Å²	134	61.5 Å²	61.5	63%	0.626	29%	0.294	S	S	*	.	S	Bend	trans	-74.8	-34.4	175.1	-64.2	-177.5	169.4	0	0	112.4	V576	V576-E608 WeakPolarHBondContact CG1-OE2 3.32Å
609	K	90.9	Very high	91.7	Very high	146 Å²	146	60.9 Å²	60.9	64%	0.635	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	151.8	-179.7	66	-175.9	177.5	-179.4	0	111.8	V657 F658 T659	K609-V657 HydrophobicContact CB-CG1 4.02Å; K609-V657 HydrophobicContact CD-CG1 4.45Å; K609-F658 WeakPolarHBondContact CA-O 3.35Å; K609-T659 HydrophobicContact CB-CG2 3.55Å
610	S	92.1	Very high	91.6	Very high	2 Å²	2	64 Å²	64	1%	0.014	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	143.7	172.7	-64.2	0	0	0	0	111.2	R607 E614 F658	R607-S610 WeakPolarHBondContact CD-OG 3.37Å; S610-E614 WeakPolarHBondContact CA-OE2 2.91Å; S610-F658 PolarHBondContact N-O 3.08Å; S610-F658 PolarHBondContact O-N 3.02Å
611	T	94	Very high	91.4	Very high	32 Å²	32	64 Å²	64	20%	0.196	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	162.4	175.3	60.7	0	0	0	0	111.5	E613 E614 I615 H656 V657	T611-E613 VanDerWaalsContact C-N 3.29Å; T611-E613 PolarHBondContact O-N 3.16Å; T611-E614 PolarHBondContact N-OE2 2.79Å; T611-E614 PolarHBondContact O-N 2.82Å; T611-E614 WeakPolarHBondContact OG1-CB 2.84Å; T611-E614 WeakPolarHBondContact OG1-CG 3.17Å; T611-E614 PolarHBondContact OG1-N 3.27Å; T611-E614 PolarHBondContact OG1-OE2 3Å; T611-I615 VanDerWaalsContact O-CG1 3.27Å; T611-I615 WeakPolarHBondContact O-CG1 3.25Å; T611-I615 PolarHBondContact O-N 3.35Å; T611-H656 CarbonylContact C-O 3.48Å; T611-H656 VanDerWaalsContact CA-O 3.3Å; T611-H656 WeakPolarHBondContact CA-O 3.44Å; T611-V657 HydrophobicContact CG2-CG2 4.06Å
612	F	92.4	Very high	91.2	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.009	32%	0.319	C	S	.	.	H	α-helix	trans	-53.7	-45	174.1	179.8	-98.6	0	0	0	112.6	I615 Q616 E623 L626 V627 L630 I652 N654 H656 F658	F612-I615 PolarHBondContact O-N 3.43Å; F612-Q616 WeakPolarHBondContact O-CB 3.44Å; F612-Q616 PolarHBondContact O-N 3.32Å; F612-E623 HydrophobicContact CE1-CG 4.32Å; F612-E623 HydrophobicContact CZ-CG 3.96Å; F612-L626 HydrophobicContact CD2-CD2 4.27Å; F612-L626 HydrophobicContact CE2-CD2 3.7Å; F612-L626 HydrophobicContact CE2-CG 3.81Å; F612-L626 HydrophobicContact CZ-CD2 3.86Å; F612-L626 HydrophobicContact CZ-CG 4.29Å; F612-V627 HydrophobicContact CE2-CG2 3.86Å; F612-V627 HydrophobicContact CZ-CG2 3.92Å; F612-L630 HydrophobicContact CD2-CD1 3.65Å; F612-L630 HydrophobicContact CE2-CD1 3.95Å; F612-I652 HydrophobicContact CD2-CG2 3.46Å; F612-I652 VanDerWaalsContact CD2-CG2 3.46Å; F612-I652 HydrophobicContact CE2-CG2 3.64Å; F612-I652 HydrophobicContact CG-CG2 4.33Å; F612-N654 VanDerWaalsContact CD1-OD1 3.27Å; F612-N654 WeakPolarHBondContact CD1-OD1 3.09Å; F612-N654 WeakPolarHBondContact CE1-OD1 3.36Å; F612-H656 PolarHBondContact N-O 3.34Å; F612-F658 HydrophobicContact CB-CE2 4.17Å; F612-F658 HydrophobicContact CD2-CE2 4.5Å
613	E	93.1	Very high	91	Very high	92 Å²	92	68.1 Å²	68.1	43%	0.43	33%	0.33	S	S	.	.	H	α-helix	trans	-66.5	-43	-178.5	-70.2	147	-145.2	0	0	112.1	T611 I615 Q616 Q617 N654 G655	T611-E613 VanDerWaalsContact C-N 3.29Å; T611-E613 PolarHBondContact O-N 3.16Å; E613-I615 PolarHBondContact O-N 2.88Å; E613-Q616 PolarHBondContact O-N 3.18Å; E613-Q617 WeakPolarHBondContact O-CB 3.43Å; E613-Q617 PolarHBondContact O-N 3.41Å; E613-N654 WeakPolarHBondContact OE1-CA 3.47Å; E613-N654 VanDerWaalsContact OE1-CB 3.25Å; E613-N654 WeakPolarHBondContact OE1-CB 3.33Å; E613-G655 PolarHBondContact OE1-N 2.93Å
614	E	92.3	Very high	90.6	Very high	88 Å²	88	74.7 Å²	74.7	41%	0.411	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-43.9	176.2	-73.5	166.3	155.5	0	0	111.2	S610 T611 Q616 E618	S610-E614 WeakPolarHBondContact CA-OE2 2.91Å; T611-E614 PolarHBondContact N-OE2 2.79Å; T611-E614 PolarHBondContact O-N 2.82Å; T611-E614 WeakPolarHBondContact OG1-CB 2.84Å; T611-E614 WeakPolarHBondContact OG1-CG 3.17Å; T611-E614 PolarHBondContact OG1-N 3.27Å; T611-E614 PolarHBondContact OG1-OE2 3Å; E614-Q616 VanDerWaalsContact C-N 3.34Å; E614-E618 VanDerWaalsContact O-CB 3.29Å; E614-E618 WeakPolarHBondContact O-CB 3.09Å; E614-E618 PolarHBondContact O-N 3.03Å
615	I	93.4	Very high	90.2	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-43.9	176.1	-63.4	167.8	0	0	0	109.6	I600 L603 F604 T611 F612 E613 T619 L626 L630 F658	I600-I615 HydrophobicContact CG1-CG2 4.05Å; I600-I615 HydrophobicContact CG2-CG2 4.31Å; L603-I615 HydrophobicContact CD1-CB 4.48Å; L603-I615 HydrophobicContact CD1-CG1 4.26Å; L603-I615 HydrophobicContact CD1-CG2 4.23Å; F604-I615 HydrophobicContact CZ-CD1 4.31Å; T611-I615 VanDerWaalsContact O-CG1 3.27Å; T611-I615 WeakPolarHBondContact O-CG1 3.25Å; T611-I615 PolarHBondContact O-N 3.35Å; F612-I615 PolarHBondContact O-N 3.43Å; E613-I615 PolarHBondContact O-N 2.88Å; I615-T619 HydrophobicContact CG2-CG2 4.06Å; I615-T619 VanDerWaalsContact O-CB 3.28Å; I615-T619 WeakPolarHBondContact O-CB 3.35Å; I615-T619 VanDerWaalsContact O-CG2 3.25Å; I615-T619 WeakPolarHBondContact O-CG2 3.3Å; I615-T619 PolarHBondContact O-N 3.47Å; I615-T619 PolarHBondContact O-OG1 3.31Å; I615-L626 HydrophobicContact CG2-CD1 3.8Å; I615-L630 HydrophobicContact CD1-CD2 4.25Å; I615-F658 HydrophobicContact CD1-CB 4.27Å; I615-F658 HydrophobicContact CD1-CD2 3.85Å; I615-F658 HydrophobicContact CD1-CG 4.29Å
616	Q	92.8	Very high	90.1	Very high	55 Å²	55	70.1 Å²	70.1	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-62.2	-47.7	179.4	-170.1	176.1	20	0	0	112.1	F612 E613 E614 D620 L626	F612-Q616 WeakPolarHBondContact O-CB 3.44Å; F612-Q616 PolarHBondContact O-N 3.32Å; E613-Q616 PolarHBondContact O-N 3.18Å; E614-Q616 VanDerWaalsContact C-N 3.34Å; Q616-D620 VanDerWaalsContact O-CA 3.31Å; Q616-D620 WeakPolarHBondContact O-CA 3.32Å; Q616-D620 PolarHBondContact O-N 3.29Å; Q616-L626 HydrophobicContact CB-CD2 3.48Å; Q616-L626 VanDerWaalsContact CB-CD2 3.48Å; Q616-L626 HydrophobicContact CG-CD2 3.81Å
617	Q	91.8	Very high	90.1	Very high	163 Å²	163	64.3 Å²	64.3	76%	0.762	30%	0.298	S	S	*	.	H	α-helix	trans	-64.9	-41.3	-178.3	-172.8	179.6	5.7	0	0	111.9	E613	E613-Q617 WeakPolarHBondContact O-CB 3.43Å; E613-Q617 PolarHBondContact O-N 3.41Å
618	E	91.2	Very high	90	Very high	77 Å²	77	62.2 Å²	62.2	36%	0.36	29%	0.291	S	S	.	.	H	α-helix	trans	-78.6	-38.8	-176.3	-168.4	167	-158.1	0	0	112.4	N522 L603 R607 E614	N522-E618 WeakPolarHBondContact CB-O 3.34Å; N522-E618 PolarHBondContact ND2-O 3.4Å; L603-E618 HydrophobicContact CD2-CG 3.94Å; R607-E618 IonicContact CZ-OE1 3.23Å; R607-E618 IonicContact CZ-OE2 2.68Å; R607-E618 IonicContact NH1-OE2 3.99Å; R607-E618 PolarHBondContact NH1-OE2 3.24Å; R607-E618 IonicContact NH2-OE1 3.34Å; R607-E618 PolarHBondContact NH2-OE1 3.46Å; R607-E618 IonicContact NH2-OE2 2.99Å; R607-E618 PolarHBondContact NH2-OE2 3.06Å; E614-E618 VanDerWaalsContact O-CB 3.29Å; E614-E618 WeakPolarHBondContact O-CB 3.09Å; E614-E618 PolarHBondContact O-N 3.03Å
619	T	92	Very high	90.1	Very high	1 Å²	1	56 Å²	56	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-83	-20.1	178.7	66.6	0	0	0	0	113.5	C521 N522 T599 L603 I615 I621	C521-T619 CarbonylContact C-O 3.5Å; C521-T619 WeakPolarHBondContact CA-O 3.39Å; N522-T619 PolarHBondContact N-O 3.41Å; T599-T619 HydrophobicContact CG2-CG2 3.79Å; L603-T619 HydrophobicContact CD1-CG2 3.74Å; L603-T619 HydrophobicContact CG-CG2 4.45Å; I615-T619 HydrophobicContact CG2-CG2 4.06Å; I615-T619 VanDerWaalsContact O-CB 3.28Å; I615-T619 WeakPolarHBondContact O-CB 3.35Å; I615-T619 VanDerWaalsContact O-CG2 3.25Å; I615-T619 WeakPolarHBondContact O-CG2 3.3Å; I615-T619 PolarHBondContact O-N 3.47Å; I615-T619 PolarHBondContact O-OG1 3.31Å; T619-I621 HydrophobicContact CG2-CD1 4.31Å; T619-I621 PolarHBondContact O-N 2.92Å; T619-I621 VanDerWaalsContact O-N 3.15Å; T619-I621 WeakPolarHBondContact OG1-CG1 3.42Å
620	D	92.6	Very high	90.1	Very high	67 Å²	67	49 Å²	49	36%	0.358	23%	0.231	S	C	.	.			trans	52.3	27.8	-173.7	-163.2	30.2	0	0	0	113.2	K520 Q616	K520-D620 CarbonylContact C-O 3.56Å; K520-D620 VanDerWaalsContact CB-O 3.31Å; K520-D620 WeakPolarHBondContact CB-O 3.49Å; K520-D620 WeakPolarHBondContact CB-OD2 3.24Å; K520-D620 WeakPolarHBondContact CD-OD2 3.4Å; Q616-D620 VanDerWaalsContact O-CA 3.31Å; Q616-D620 WeakPolarHBondContact O-CA 3.32Å; Q616-D620 PolarHBondContact O-N 3.29Å
621	I	90.7	Very high	89.9	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	25%	0.247	C	C	.	.			trans	-80	133.1	177.9	-63.4	169.1	0	0	0	108.9	C521 F596 I600 T619 E623 E625 L626	C521-I621 HydrophobicContact CB-CG1 4.43Å; F596-I621 HydrophobicContact CB-CD1 4Å; F596-I621 HydrophobicContact CD1-CD1 3.89Å; F596-I621 HydrophobicContact CD1-CG1 3.96Å; F596-I621 HydrophobicContact CD1-CG2 4.16Å; F596-I621 HydrophobicContact CE1-CG1 4.43Å; F596-I621 HydrophobicContact CE1-CG2 4.38Å; F596-I621 HydrophobicContact CG-CD1 4.23Å; F596-I621 HydrophobicContact CG-CG2 4.32Å; I600-I621 HydrophobicContact CD1-CD1 4.48Å; I600-I621 HydrophobicContact CG1-CD1 4.25Å; T619-I621 HydrophobicContact CG2-CD1 4.31Å; T619-I621 PolarHBondContact O-N 2.92Å; T619-I621 VanDerWaalsContact O-N 3.15Å; T619-I621 WeakPolarHBondContact OG1-CG1 3.42Å; I621-E623 PolarHBondContact O-N 3.49Å; I621-E625 HydrophobicContact CG2-CB 4.04Å; I621-L626 HydrophobicContact CB-CB 4.27Å; I621-L626 HydrophobicContact CG2-CB 3.88Å
622	P	89.1	Confident	89.5	Confident	53 Å²	53	51.2 Å²	51.2	34%	0.344	24%	0.24	S	C	.	.			trans	-56.4	138.2	175.2	-26.8	35.4	0	0	0	112.4	P519 K520 R624 E625 L626	P519-P622 HydrophobicContact CB-CG 4.02Å; K520-P622 WeakPolarHBondContact O-CD 3.4Å; P622-R624 VanDerWaalsContact C-N 3.28Å; P622-R624 PolarHBondContact O-N 3.49Å; P622-R624 VanDerWaalsContact O-N 3.11Å; P622-E625 PolarHBondContact O-N 3.24Å; P622-L626 PolarHBondContact O-N 2.92Å
623	E	87.3	Confident	89.3	Confident	112 Å²	112	51.1 Å²	51.1	52%	0.523	24%	0.24	S	C	.	.	H	α-helix	trans	-48.4	-47.1	-172.1	-166.7	-174	152.6	0	0	113.2	F612 I621 E625 L626 V627	F612-E623 HydrophobicContact CE1-CG 4.32Å; F612-E623 HydrophobicContact CZ-CG 3.96Å; I621-E623 PolarHBondContact O-N 3.49Å; E623-E625 VanDerWaalsContact C-N 3.33Å; E623-E625 PolarHBondContact O-N 3.01Å; E623-L626 PolarHBondContact O-N 3.28Å; E623-V627 WeakPolarHBondContact O-CB 3.43Å; E623-V627 VanDerWaalsContact O-CG2 3.32Å; E623-V627 WeakPolarHBondContact O-CG2 3.15Å; E623-V627 PolarHBondContact O-N 3.38Å
624	R	84.1	Confident	89	Confident	163 Å²	163	47 Å²	47	62%	0.615	22%	0.221	S	C	*	.	H	α-helix	trans	-57	-43.7	178.9	-176.8	-177.8	178.8	-170.5	-0.6	112.8	P622 R628	P622-R624 VanDerWaalsContact C-N 3.28Å; P622-R624 PolarHBondContact O-N 3.49Å; P622-R624 VanDerWaalsContact O-N 3.11Å; R624-R628 VanDerWaalsContact NH2-NH2 3.18Å; R624-R628 WeakPolarHBondContact O-CG 3.43Å; R624-R628 PolarHBondContact O-N 2.85Å
625	E	83.5	Confident	88.5	Confident	42 Å²	42	44.6 Å²	44.6	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-78.7	-34.3	-178.8	-64.7	-55.7	131.2	0	0	111.3	F596 I621 P622 E623 R628 A629	F596-E625 HydrophobicContact CD2-CB 4.13Å; F596-E625 HydrophobicContact CE2-CB 3.82Å; F596-E625 HydrophobicContact CE2-CG 4.08Å; I621-E625 HydrophobicContact CG2-CB 4.04Å; P622-E625 PolarHBondContact O-N 3.24Å; E623-E625 VanDerWaalsContact C-N 3.33Å; E623-E625 PolarHBondContact O-N 3.01Å; E625-R628 PolarHBondContact O-N 3.37Å; E625-R628 IonicContact OE1-CZ 3.41Å; E625-R628 IonicContact OE1-NH1 2.69Å; E625-R628 PolarHBondContact OE1-NH1 3.4Å; E625-R628 IonicContact OE2-NH1 3Å; E625-A629 WeakPolarHBondContact O-CB 3.37Å; E625-A629 PolarHBondContact O-N 2.88Å
626	L	88.6	Confident	87.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-46.6	175.1	179.6	58.4	0	0	0	111.7	I600 F612 I615 Q616 I621 P622 E623 R628 A629 L630	I600-L626 HydrophobicContact CD1-CD1 3.69Å; I600-L626 HydrophobicContact CG1-CD1 4.11Å; F612-L626 HydrophobicContact CD2-CD2 4.27Å; F612-L626 HydrophobicContact CE2-CD2 3.7Å; F612-L626 HydrophobicContact CE2-CG 3.81Å; F612-L626 HydrophobicContact CZ-CD2 3.86Å; F612-L626 HydrophobicContact CZ-CG 4.29Å; I615-L626 HydrophobicContact CG2-CD1 3.8Å; Q616-L626 HydrophobicContact CB-CD2 3.48Å; Q616-L626 VanDerWaalsContact CB-CD2 3.48Å; Q616-L626 HydrophobicContact CG-CD2 3.81Å; I621-L626 HydrophobicContact CB-CB 4.27Å; I621-L626 HydrophobicContact CG2-CB 3.88Å; P622-L626 PolarHBondContact O-N 2.92Å; E623-L626 PolarHBondContact O-N 3.28Å; L626-R628 VanDerWaalsContact C-N 3.33Å; L626-R628 PolarHBondContact O-N 3.27Å; L626-A629 PolarHBondContact O-N 2.94Å; L626-L630 HydrophobicContact CD1-CD1 3.77Å; L626-L630 HydrophobicContact CD1-CG 4.02Å; L626-L630 HydrophobicContact CG-CD1 3.87Å; L626-L630 WeakPolarHBondContact O-CB 3.4Å; L626-L630 WeakPolarHBondContact O-CG 3.46Å; L626-L630 PolarHBondContact O-N 3.46Å
627	V	88.5	Confident	86.8	Confident	28 Å²	28	47.4 Å²	47.4	17%	0.17	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-46.7	175.5	167.9	0	0	0	0	110.6	F612 E623 A629 L630 Q631 I652	F612-V627 HydrophobicContact CE2-CG2 3.86Å; F612-V627 HydrophobicContact CZ-CG2 3.92Å; E623-V627 WeakPolarHBondContact O-CB 3.43Å; E623-V627 VanDerWaalsContact O-CG2 3.32Å; E623-V627 WeakPolarHBondContact O-CG2 3.15Å; E623-V627 PolarHBondContact O-N 3.38Å; V627-A629 PolarHBondContact O-N 3.37Å; V627-L630 PolarHBondContact O-N 2.98Å; V627-Q631 HydrophobicContact CG1-CG 4.25Å; V627-Q631 VanDerWaalsContact O-CB 3.28Å; V627-Q631 WeakPolarHBondContact O-CB 3.25Å; V627-Q631 WeakPolarHBondContact O-CG 3.04Å; V627-Q631 PolarHBondContact O-N 3.12Å; V627-I652 HydrophobicContact CG1-CB 4.26Å; V627-I652 HydrophobicContact CG2-CB 4.4Å; V627-I652 HydrophobicContact CG2-CG2 4.3Å
628	R	84.5	Confident	86.1	Confident	48 Å²	48	44.4 Å²	44.4	18%	0.181	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-45.3	177.7	-74.4	170	167.2	-178.8	-13.3	112.2	R624 E625 L626 Q631 S632 T675	R624-R628 VanDerWaalsContact NH2-NH2 3.18Å; R624-R628 WeakPolarHBondContact O-CG 3.43Å; R624-R628 PolarHBondContact O-N 2.85Å; E625-R628 PolarHBondContact O-N 3.37Å; E625-R628 IonicContact OE1-CZ 3.41Å; E625-R628 IonicContact OE1-NH1 2.69Å; E625-R628 PolarHBondContact OE1-NH1 3.4Å; E625-R628 IonicContact OE2-NH1 3Å; L626-R628 VanDerWaalsContact C-N 3.33Å; L626-R628 PolarHBondContact O-N 3.27Å; R628-Q631 PolarHBondContact O-N 3.11Å; R628-S632 PolarHBondContact O-N 3.33Å; R628-S632 PolarHBondContact O-OG 3.46Å; R628-T675 HydrophobicContact CB-CG2 4.02Å
629	A	87.6	Confident	85.4	Confident	2 Å²	2	43.9 Å²	43.9	2%	0.017	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-48.7	178.2	0	0	0	0	0	111.3	F596 Q597 I600 E625 L626 V627 Q631 S632 L633	F596-A629 HydrophobicContact CB-CB 4.24Å; Q597-A629 HydrophobicContact CG-CB 4.15Å; I600-A629 HydrophobicContact CD1-CB 3.62Å; E625-A629 WeakPolarHBondContact O-CB 3.37Å; E625-A629 PolarHBondContact O-N 2.88Å; L626-A629 PolarHBondContact O-N 2.94Å; V627-A629 PolarHBondContact O-N 3.37Å; A629-Q631 PolarHBondContact O-N 3.46Å; A629-S632 PolarHBondContact O-N 2.87Å; A629-S632 PolarHBondContact O-OG 3.06Å; A629-L633 WeakPolarHBondContact O-CG 3.44Å; A629-L633 PolarHBondContact O-N 2.78Å; A629-L633 VanDerWaalsContact O-N 3.15Å
630	L	90.2	Very high	84.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-35.1	178.7	-72	170.1	0	0	0	112.8	I600 F612 I615 L626 V627 S632 L633 A634 L643 I652 F658	I600-L630 HydrophobicContact CD1-CD2 4.26Å; I600-L630 HydrophobicContact CD1-CG 4.23Å; I600-L630 HydrophobicContact CG2-CD2 3.81Å; F612-L630 HydrophobicContact CD2-CD1 3.65Å; F612-L630 HydrophobicContact CE2-CD1 3.95Å; I615-L630 HydrophobicContact CD1-CD2 4.25Å; L626-L630 HydrophobicContact CD1-CD1 3.77Å; L626-L630 HydrophobicContact CD1-CG 4.02Å; L626-L630 HydrophobicContact CG-CD1 3.87Å; L626-L630 WeakPolarHBondContact O-CB 3.4Å; L626-L630 WeakPolarHBondContact O-CG 3.46Å; L626-L630 PolarHBondContact O-N 3.46Å; V627-L630 PolarHBondContact O-N 2.98Å; L630-S632 VanDerWaalsContact C-N 3.32Å; L630-S632 PolarHBondContact O-N 2.75Å; L630-L633 PolarHBondContact O-N 3.41Å; L630-A634 WeakPolarHBondContact O-CB 3.27Å; L630-A634 PolarHBondContact O-N 2.69Å; L630-L643 HydrophobicContact CD2-CD1 4.29Å; L630-I652 HydrophobicContact CB-CD1 3.39Å; L630-F658 HydrophobicContact CB-CE1 4.14Å; L630-F658 HydrophobicContact CB-CZ 4.22Å; L630-F658 HydrophobicContact CD1-CE1 4.41Å; L630-F658 HydrophobicContact CD1-CE2 3.92Å; L630-F658 HydrophobicContact CD1-CZ 3.83Å; L630-F658 HydrophobicContact CD2-CD1 4.12Å; L630-F658 HydrophobicContact CD2-CE1 4.09Å; L630-F658 HydrophobicContact CD2-CE2 4.5Å; L630-F658 HydrophobicContact CD2-CG 4.32Å; L630-F658 HydrophobicContact CD2-CZ 4.29Å; L630-F658 HydrophobicContact CG-CE1 4.46Å; L630-F658 HydrophobicContact CG-CZ 4.36Å
631	Q	87.4	Confident	84.6	Confident	72 Å²	72	46.7 Å²	46.7	34%	0.336	24%	0.235	S	C	.	.	I	π-helix	trans	-59.2	-45.3	174.1	-82.4	175.4	-19	0	0	110.9	V627 R628 A629 L633 C635 G636 I652	V627-Q631 HydrophobicContact CG1-CG 4.25Å; V627-Q631 VanDerWaalsContact O-CB 3.28Å; V627-Q631 WeakPolarHBondContact O-CB 3.25Å; V627-Q631 WeakPolarHBondContact O-CG 3.04Å; V627-Q631 PolarHBondContact O-N 3.12Å; R628-Q631 PolarHBondContact O-N 3.11Å; A629-Q631 PolarHBondContact O-N 3.46Å; Q631-L633 VanDerWaalsContact C-N 3.32Å; Q631-L633 PolarHBondContact O-N 2.98Å; Q631-C635 CarbonylContact O-C 3.58Å; Q631-C635 VanDerWaalsContact O-CA 3.29Å; Q631-C635 WeakPolarHBondContact O-CA 3.45Å; Q631-C635 WeakPolarHBondContact O-CB 3.44Å; Q631-C635 PolarHBondContact O-N 3.34Å; Q631-G636 PolarHBondContact O-N 3.28Å; Q631-I652 HydrophobicContact CB-CD1 4.31Å; Q631-I652 HydrophobicContact CG-CD1 3.6Å; Q631-I652 HydrophobicContact CG-CG1 3.97Å
632	S	85.6	Confident	84.5	Confident	8 Å²	8	46.8 Å²	46.8	6%	0.056	24%	0.236	C	C	.	.	I	π-helix	trans	-66.8	-31.8	177.9	66.4	0	0	0	0	113.6	Q597 R628 A629 L630 Q674	Q597-S632 PolarHBondContact NE2-OG 2.95Å; R628-S632 PolarHBondContact O-N 3.33Å; R628-S632 PolarHBondContact O-OG 3.46Å; A629-S632 PolarHBondContact O-N 2.87Å; A629-S632 PolarHBondContact O-OG 3.06Å; L630-S632 VanDerWaalsContact C-N 3.32Å; L630-S632 PolarHBondContact O-N 2.75Å; S632-Q674 WeakPolarHBondContact CB-O 3.32Å
633	L	89	Confident	84.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	I	π-helix	trans	-82	-35.4	-179.4	-68.1	169.9	0	0	0	113.4	Q597 I600 L601 A629 L630 Q631 R641 V642 L643 I673	Q597-L633 HydrophobicContact CB-CD1 4.19Å; Q597-L633 HydrophobicContact CB-CD2 4.35Å; Q597-L633 HydrophobicContact CG-CD1 4.05Å; Q597-L633 HydrophobicContact CG-CD2 4.21Å; Q597-L633 HydrophobicContact CG-CG 4.06Å; I600-L633 HydrophobicContact CB-CD1 4.35Å; I600-L633 HydrophobicContact CD1-CD1 4.36Å; I600-L633 HydrophobicContact CG2-CD1 4.09Å; L601-L633 HydrophobicContact CD1-CD2 4.03Å; L601-L633 HydrophobicContact CD2-CD1 4.47Å; L601-L633 HydrophobicContact CD2-CD2 4.21Å; L601-L633 HydrophobicContact CG-CD1 4.35Å; L601-L633 HydrophobicContact CG-CD2 4.23Å; A629-L633 WeakPolarHBondContact O-CG 3.44Å; A629-L633 PolarHBondContact O-N 2.78Å; A629-L633 VanDerWaalsContact O-N 3.15Å; L630-L633 PolarHBondContact O-N 3.41Å; Q631-L633 VanDerWaalsContact C-N 3.32Å; Q631-L633 PolarHBondContact O-N 2.98Å; L633-R641 CarbonylContact O-C 3.54Å; L633-R641 WeakPolarHBondContact O-CA 3.49Å; L633-V642 PolarHBondContact O-N 3.29Å; L633-L643 HydrophobicContact CB-CB 4.48Å; L633-L643 HydrophobicContact CB-CD1 3.93Å; L633-L643 HydrophobicContact CB-CG 4.19Å; L633-L643 HydrophobicContact CD1-CD1 4.11Å; L633-L643 PolarHBondContact O-N 3.35Å; L633-I673 HydrophobicContact CD2-CD1 3.93Å; L633-I673 HydrophobicContact CD2-CG2 4.1Å
634	A	87.4	Confident	84.7	Confident	5 Å²	5	41 Å²	41	4%	0.041	21%	0.207	C	C	.	.	I	π-helix	trans	-114.4	-32	-170.8	0	0	0	0	0	114.6	L630 R641 L643 K645 F658	L630-A634 WeakPolarHBondContact O-CB 3.27Å; L630-A634 PolarHBondContact O-N 2.69Å; A634-R641 WeakPolarHBondContact O-CD 3.33Å; A634-R641 WeakPolarHBondContact O-CG 3.33Å; A634-R641 PolarHBondContact O-NE 2.87Å; A634-R641 VanDerWaalsContact O-NE 3.16Å; A634-L643 WeakPolarHBondContact CA-O 3.14Å; A634-L643 HydrophobicContact CB-CB 4.04Å; A634-K645 HydrophobicContact CB-CB 4.22Å; A634-F658 HydrophobicContact CB-CD1 4.01Å; A634-F658 HydrophobicContact CB-CE1 3.98Å
635	C	81.3	Confident	85.1	Confident	38 Å²	38	33.8 Å²	33.8	26%	0.257	18%	0.18	S	C	.	.	I	π-helix	trans	-107.4	-1.4	-174.6	-57.7	0	0	0	0	113.1	Q631	Q631-C635 CarbonylContact O-C 3.58Å; Q631-C635 VanDerWaalsContact O-CA 3.29Å; Q631-C635 WeakPolarHBondContact O-CA 3.45Å; Q631-C635 WeakPolarHBondContact O-CB 3.44Å; Q631-C635 PolarHBondContact O-N 3.34Å
636	G	73.7	Confident	85.3	Confident	21 Å²	21	37.6 Å²	37.6	22%	0.216	20%	0.198	C	C	.	.	S	Bend	trans	-70	-170.1	179.7	0	0	0	0	0	114.6	Q631 R641	Q631-G636 PolarHBondContact O-N 3.28Å; G636-R641 PolarHBondContact O-NH2 3.27Å
637	K	76.5	Confident	85.2	Confident	93 Å²	93	41.7 Å²	41.7	40%	0.404	22%	0.224	S	C	.	.			trans	-57.1	148.1	175.6	-65.7	180	-177.8	177.6	0	110.1	T639 Q640 R641	K637-T639 PolarHBondContact O-N 3.22Å; K637-Q640 CarbonylContact O-C 3.52Å; K637-Q640 PolarHBondContact O-N 2.75Å; K637-R641 PolarHBondContact O-N 2.66Å
638	P	76.9	Confident	84.9	Confident	101 Å²	101	49.7 Å²	49.7	66%	0.656	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-51.7	-34.2	176.4	-28.2	35.5	0	0	0	113.6	Q640	P638-Q640 PolarHBondContact O-N 2.93Å
639	T	77.1	Confident	84.8	Confident	65 Å²	65	49.8 Å²	49.8	40%	0.399	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-74.7	-3.1	177.1	53.5	0	0	0	0	115	K637 F664	K637-T639 PolarHBondContact O-N 3.22Å; T639-F664 VanDerWaalsContact O-CE2 3.3Å; T639-F664 WeakPolarHBondContact O-CE2 3.28Å; T639-F664 WeakPolarHBondContact O-CZ 3.35Å
640	Q	81	Confident	84.2	Confident	35 Å²	35	58 Å²	58	16%	0.164	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-127.9	-3.5	178.6	-68.2	177.3	-23.6	0	0	112.8	K637 P638 V642 K672	K637-Q640 CarbonylContact O-C 3.52Å; K637-Q640 PolarHBondContact O-N 2.75Å; P638-Q640 PolarHBondContact O-N 2.93Å; Q640-V642 PolarHBondContact O-N 2.97Å; Q640-K672 PolarHBondContact NE2-O 3.05Å; Q640-K672 VanDerWaalsContact NE2-O 3.08Å
641	R	85.6	Confident	83.8	Confident	92 Å²	92	63.8 Å²	63.8	35%	0.347	33%	0.327	S	S	.	.			trans	-80.1	85.6	-175.7	-174.7	179.6	-57.8	174.2	1.6	110.9	L633 A634 G636 K637 L643 N661 F664	L633-R641 CarbonylContact O-C 3.54Å; L633-R641 WeakPolarHBondContact O-CA 3.49Å; A634-R641 WeakPolarHBondContact O-CD 3.33Å; A634-R641 WeakPolarHBondContact O-CG 3.33Å; A634-R641 PolarHBondContact O-NE 2.87Å; A634-R641 VanDerWaalsContact O-NE 3.16Å; G636-R641 PolarHBondContact O-NH2 3.27Å; K637-R641 PolarHBondContact O-N 2.66Å; R641-L643 WeakPolarHBondContact CG-O 3.47Å; R641-N661 PolarHBondContact O-ND2 3.27Å; R641-F664 WeakPolarHBondContact O-CD2 3.36Å
642	V	89.2	Confident	83.6	Confident	5 Å²	5	61.2 Å²	61.2	3%	0.03	32%	0.316	C	S	.	.			trans	-82.5	-22.7	179.4	176.4	0	0	0	0	112.1	F562 L591 L601 L633 Q640 N661 F664 I673	F562-V642 HydrophobicContact CE1-CG1 3.97Å; F562-V642 HydrophobicContact CZ-CG1 3.84Å; F562-V642 HydrophobicContact CZ-CG2 4.43Å; L591-V642 HydrophobicContact CD1-CG1 4.03Å; L591-V642 HydrophobicContact CD1-CG2 4.05Å; L591-V642 HydrophobicContact CD2-CG2 4.3Å; L601-V642 HydrophobicContact CD2-CG1 3.79Å; L633-V642 PolarHBondContact O-N 3.29Å; Q640-V642 PolarHBondContact O-N 2.97Å; V642-N661 WeakPolarHBondContact O-CB 3.39Å; V642-N661 PolarHBondContact O-N 3.49Å; V642-F664 HydrophobicContact CG2-CD2 4.33Å; V642-F664 HydrophobicContact CG2-CE2 4.19Å; V642-F664 HydrophobicContact CG2-CZ 4.39Å; V642-I673 HydrophobicContact CB-CD1 4.35Å; V642-I673 HydrophobicContact CG2-CD1 3.51Å
643	L	91.3	Very high	83.7	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	153	175.3	-61.3	178.9	0	0	0	111.4	I600 L601 F604 L630 L633 A634 R641 T659 V660	I600-L643 HydrophobicContact CG2-CD1 4.29Å; L601-L643 HydrophobicContact CD2-CD1 4.44Å; L601-L643 HydrophobicContact CD2-CD2 4.11Å; L601-L643 HydrophobicContact CD2-CG 4.22Å; F604-L643 HydrophobicContact CD2-CD2 4.04Å; F604-L643 HydrophobicContact CE2-CD1 3.95Å; F604-L643 HydrophobicContact CE2-CD2 3.9Å; F604-L643 HydrophobicContact CG-CD2 4.46Å; F604-L643 HydrophobicContact CZ-CD1 4.38Å; F604-L643 HydrophobicContact CZ-CD2 4.19Å; L630-L643 HydrophobicContact CD2-CD1 4.29Å; L633-L643 HydrophobicContact CB-CB 4.48Å; L633-L643 HydrophobicContact CB-CD1 3.93Å; L633-L643 HydrophobicContact CB-CG 4.19Å; L633-L643 HydrophobicContact CD1-CD1 4.11Å; L633-L643 PolarHBondContact O-N 3.35Å; A634-L643 WeakPolarHBondContact CA-O 3.14Å; A634-L643 HydrophobicContact CB-CB 4.04Å; R641-L643 WeakPolarHBondContact CG-O 3.47Å; L643-T659 CarbonylContact C-O 3.26Å; L643-T659 VanDerWaalsContact CA-O 3.25Å; L643-T659 WeakPolarHBondContact CA-O 3.23Å; L643-T659 WeakPolarHBondContact CD2-O 3.2Å; L643-V660 HydrophobicContact CD2-CG2 4.39Å
644	T	89.5	Confident	83.4	Confident	43 Å²	43	70.7 Å²	70.7	26%	0.264	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	149.1	166.4	32.9	0	0	0	0	110.1	F658 T659 N661	T644-F658 VanDerWaalsContact O-CA 3.28Å; T644-F658 WeakPolarHBondContact O-CA 3.48Å; T644-T659 PolarHBondContact N-O 3.26Å; T644-T659 PolarHBondContact O-N 3.34Å; T644-T659 PolarHBondContact OG1-O 2.85Å; T644-T659 PolarHBondContact OG1-OG1 3.3Å; T644-N661 HydrophobicContact CG2-CB 4.04Å
645	K	91.9	Very high	83.3	Confident	11 Å²	11	72.5 Å²	72.5	5%	0.048	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.7	-179.4	-172.5	179.1	80.8	72.1	0	110.8	A634 P647 S649 E651 I652 H656 V657 F658	A634-K645 HydrophobicContact CB-CB 4.22Å; K645-P647 PolarHBondContact NZ-O 3.01Å; K645-P647 CarbonylContact O-C 3.49Å; K645-S649 WeakPolarHBondContact CE-O 3.49Å; K645-S649 PolarHBondContact NZ-O 2.81Å; K645-S649 PolarHBondContact NZ-OG 3.15Å; K645-E651 WeakPolarHBondContact CE-O 3.25Å; K645-E651 PolarHBondContact NZ-O 2.64Å; K645-I652 HydrophobicContact CD-CG1 4.27Å; K645-H656 HydrophobicContact CD-CB 4.35Å; K645-H656 HydrophobicContact CG-CB 4.31Å; K645-H656 PolarHBondContact NZ-CE1 3.28Å; K645-H656 PolarHBondContact NZ-ND1 2.7Å; K645-H656 VanDerWaalsContact NZ-ND1 3.18Å; K645-V657 CarbonylContact C-O 3.53Å; K645-V657 WeakPolarHBondContact CA-O 3.38Å; K645-F658 HydrophobicContact CB-CD1 4.14Å; K645-F658 HydrophobicContact CB-CE1 4.01Å; K645-F658 HydrophobicContact CD-CE1 3.66Å; K645-F658 HydrophobicContact CD-CZ 3.82Å; K645-F658 HydrophobicContact CG-CD1 4.16Å; K645-F658 HydrophobicContact CG-CE1 3.71Å; K645-F658 HydrophobicContact CG-CZ 4.05Å
646	E	88.8	Confident	83.8	Confident	123 Å²	123	71.2 Å²	71.2	58%	0.575	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.2	172.6	-65.4	-174.2	170.2	0	0	110.4	V657	E646-V657 PolarHBondContact N-O 2.98Å; E646-V657 PolarHBondContact O-N 3.01Å
647	P	85.6	Confident	84.7	Confident	85 Å²	85	72 Å²	72	55%	0.552	37%	0.372	S	S	*	.	S	Bend	cis	-67.1	156.2	-7	28.6	-36	0	0	0	113.2	K645 S649	K645-P647 PolarHBondContact NZ-O 3.01Å; K645-P647 CarbonylContact O-C 3.49Å; P647-S649 PolarHBondContact O-N 2.9Å
648	K	81.9	Confident	85.5	Confident	196 Å²	196	67.6 Å²	67.6	85%	0.852	35%	0.353	S	S	*	.			trans	-73.4	94.1	178.2	-67.8	178.6	-176.5	172.4	0	110.5
649	S	82.6	Confident	86.3	Confident	51 Å²	51	64.5 Å²	64.5	36%	0.357	33%	0.332	S	S	.	.			trans	-140.1	166.6	174.2	70.3	0	0	0	0	110.6	K645 P647 E651	K645-S649 WeakPolarHBondContact CE-O 3.49Å; K645-S649 PolarHBondContact NZ-O 2.81Å; K645-S649 PolarHBondContact NZ-OG 3.15Å; P647-S649 PolarHBondContact O-N 2.9Å; S649-E651 VanDerWaalsContact C-N 3.33Å; S649-E651 PolarHBondContact OG-O 2.77Å
650	K	75	Confident	87	Confident	173 Å²	173	63.8 Å²	63.8	75%	0.752	33%	0.328	S	S	*	.	S	Bend	trans	-79.8	-18.5	175.9	-69	-176.1	-179.8	174.7	0	113
651	E	81.8	Confident	87.4	Confident	122 Å²	122	63.1 Å²	63.1	57%	0.57	33%	0.326	S	S	*	.	S	Bend	trans	-92	148.5	-177.4	-64.9	180	167.1	0	0	109.9	K645 S649 H656	K645-E651 WeakPolarHBondContact CE-O 3.25Å; K645-E651 PolarHBondContact NZ-O 2.64Å; S649-E651 VanDerWaalsContact C-N 3.33Å; S649-E651 PolarHBondContact OG-O 2.77Å; E651-H656 PolarHBondContact O-CE1 2.79Å; E651-H656 PolarHBondContact O-ND1 3.01Å
652	I	84.9	Confident	87.4	Confident	19 Å²	19	61.5 Å²	61.5	10%	0.097	32%	0.324	C	S	.	.			trans	-116	122.2	177.3	-60.4	-169.3	0	0	0	106.8	F612 V627 L630 Q631 K645 F658	F612-I652 HydrophobicContact CD2-CG2 3.46Å; F612-I652 VanDerWaalsContact CD2-CG2 3.46Å; F612-I652 HydrophobicContact CE2-CG2 3.64Å; F612-I652 HydrophobicContact CG-CG2 4.33Å; V627-I652 HydrophobicContact CG1-CB 4.26Å; V627-I652 HydrophobicContact CG2-CB 4.4Å; V627-I652 HydrophobicContact CG2-CG2 4.3Å; L630-I652 HydrophobicContact CB-CD1 3.39Å; Q631-I652 HydrophobicContact CB-CD1 4.31Å; Q631-I652 HydrophobicContact CG-CD1 3.6Å; Q631-I652 HydrophobicContact CG-CG1 3.97Å; K645-I652 HydrophobicContact CD-CG1 4.27Å; I652-F658 HydrophobicContact CD1-CE1 4.34Å; I652-F658 HydrophobicContact CD1-CZ 4.15Å; I652-F658 HydrophobicContact CG2-CZ 4.02Å
653	E	86.7	Confident	87	Confident	106 Å²	106	67.9 Å²	67.9	50%	0.495	35%	0.353	S	S	.	.			trans	-133.3	166.6	-176.1	-61.5	-179.8	-173.2	0	0	108.6	H656	E653-H656 PolarHBondContact N-CE1 3.48Å; E653-H656 VanDerWaalsContact N-CE1 3.26Å; E653-H656 PolarHBondContact N-ND1 2.81Å; E653-H656 WeakPolarHBondContact O-CB 3.5Å; E653-H656 PolarHBondContact O-N 3.18Å
654	N	83.3	Confident	86.6	Confident	101 Å²	101	68 Å²	68	54%	0.54	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	144.7	171.4	-70	-8.6	0	0	0	110.5	F612 E613 H656	F612-N654 VanDerWaalsContact CD1-OD1 3.27Å; F612-N654 WeakPolarHBondContact CD1-OD1 3.09Å; F612-N654 WeakPolarHBondContact CE1-OD1 3.36Å; E613-N654 WeakPolarHBondContact OE1-CA 3.47Å; E613-N654 VanDerWaalsContact OE1-CB 3.25Å; E613-N654 WeakPolarHBondContact OE1-CB 3.33Å; N654-H656 VanDerWaalsContact C-N 3.28Å; N654-H656 PolarHBondContact O-N 3.26Å
655	G	84.8	Confident	86.1	Confident	43 Å²	43	69.8 Å²	69.8	44%	0.443	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-8.8	-173.7	0	0	0	0	0	117.5	E613 V657	E613-G655 PolarHBondContact OE1-N 2.93Å; G655-V657 PolarHBondContact O-N 3.45Å
656	H	92.4	Very high	85.6	Confident	11 Å²	11	70.6 Å²	70.6	5%	0.051	37%	0.372	C	S	.	.			trans	-64.5	133.4	174.8	-74.5	173.6	0	0	0	111.9	T611 F612 K645 E651 E653 N654 F658	T611-H656 CarbonylContact C-O 3.48Å; T611-H656 VanDerWaalsContact CA-O 3.3Å; T611-H656 WeakPolarHBondContact CA-O 3.44Å; F612-H656 PolarHBondContact N-O 3.34Å; K645-H656 HydrophobicContact CD-CB 4.35Å; K645-H656 HydrophobicContact CG-CB 4.31Å; K645-H656 PolarHBondContact NZ-CE1 3.28Å; K645-H656 PolarHBondContact NZ-ND1 2.7Å; K645-H656 VanDerWaalsContact NZ-ND1 3.18Å; E651-H656 PolarHBondContact O-CE1 2.79Å; E651-H656 PolarHBondContact O-ND1 3.01Å; E653-H656 PolarHBondContact N-CE1 3.48Å; E653-H656 VanDerWaalsContact N-CE1 3.26Å; E653-H656 PolarHBondContact N-ND1 2.81Å; E653-H656 WeakPolarHBondContact O-CB 3.5Å; E653-H656 PolarHBondContact O-N 3.18Å; N654-H656 VanDerWaalsContact C-N 3.28Å; N654-H656 PolarHBondContact O-N 3.26Å; H656-F658 HydrophobicContact CB-CE2 4.1Å; H656-F658 HydrophobicContact CB-CZ 4.32Å
657	V	92.3	Very high	85.3	Confident	37 Å²	37	73.9 Å²	73.9	22%	0.224	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.2	-178.6	-176.6	0	0	0	0	110.3	K609 T611 K645 E646 G655	K609-V657 HydrophobicContact CB-CG1 4.02Å; K609-V657 HydrophobicContact CD-CG1 4.45Å; T611-V657 HydrophobicContact CG2-CG2 4.06Å; K645-V657 CarbonylContact C-O 3.53Å; K645-V657 WeakPolarHBondContact CA-O 3.38Å; E646-V657 PolarHBondContact N-O 2.98Å; E646-V657 PolarHBondContact O-N 3.01Å; G655-V657 PolarHBondContact O-N 3.45Å
658	F	94.1	Very high	85.2	Confident	0 Å²	0	75 Å²	75	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.5	177.8	-60.5	-90.5	0	0	0	110.8	F604 K609 S610 F612 I615 L630 A634 T644 K645 I652 H656	F604-F658 WeakPolarHBondContact CE1-O 3.3Å; F604-F658 HydrophobicContact CZ-CB 3.89Å; K609-F658 WeakPolarHBondContact CA-O 3.35Å; S610-F658 PolarHBondContact N-O 3.08Å; S610-F658 PolarHBondContact O-N 3.02Å; F612-F658 HydrophobicContact CB-CE2 4.17Å; F612-F658 HydrophobicContact CD2-CE2 4.5Å; I615-F658 HydrophobicContact CD1-CB 4.27Å; I615-F658 HydrophobicContact CD1-CD2 3.85Å; I615-F658 HydrophobicContact CD1-CG 4.29Å; L630-F658 HydrophobicContact CB-CE1 4.14Å; L630-F658 HydrophobicContact CB-CZ 4.22Å; L630-F658 HydrophobicContact CD1-CE1 4.41Å; L630-F658 HydrophobicContact CD1-CE2 3.92Å; L630-F658 HydrophobicContact CD1-CZ 3.83Å; L630-F658 HydrophobicContact CD2-CD1 4.12Å; L630-F658 HydrophobicContact CD2-CE1 4.09Å; L630-F658 HydrophobicContact CD2-CE2 4.5Å; L630-F658 HydrophobicContact CD2-CG 4.32Å; L630-F658 HydrophobicContact CD2-CZ 4.29Å; L630-F658 HydrophobicContact CG-CE1 4.46Å; L630-F658 HydrophobicContact CG-CZ 4.36Å; A634-F658 HydrophobicContact CB-CD1 4.01Å; A634-F658 HydrophobicContact CB-CE1 3.98Å; T644-F658 VanDerWaalsContact O-CA 3.28Å; T644-F658 WeakPolarHBondContact O-CA 3.48Å; K645-F658 HydrophobicContact CB-CD1 4.14Å; K645-F658 HydrophobicContact CB-CE1 4.01Å; K645-F658 HydrophobicContact CD-CE1 3.66Å; K645-F658 HydrophobicContact CD-CZ 3.82Å; K645-F658 HydrophobicContact CG-CD1 4.16Å; K645-F658 HydrophobicContact CG-CE1 3.71Å; K645-F658 HydrophobicContact CG-CZ 4.05Å; I652-F658 HydrophobicContact CD1-CE1 4.34Å; I652-F658 HydrophobicContact CD1-CZ 4.15Å; I652-F658 HydrophobicContact CG2-CZ 4.02Å; H656-F658 HydrophobicContact CB-CE2 4.1Å; H656-F658 HydrophobicContact CB-CZ 4.32Å
659	T	92.3	Very high	85.4	Confident	36 Å²	36	71.3 Å²	71.3	22%	0.221	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.8	178.7	46.3	0	0	0	0	110.6	K609 L643 T644	K609-T659 HydrophobicContact CB-CG2 3.55Å; L643-T659 CarbonylContact C-O 3.26Å; L643-T659 VanDerWaalsContact CA-O 3.25Å; L643-T659 WeakPolarHBondContact CA-O 3.23Å; L643-T659 WeakPolarHBondContact CD2-O 3.2Å; T644-T659 PolarHBondContact N-O 3.26Å; T644-T659 PolarHBondContact O-N 3.34Å; T644-T659 PolarHBondContact OG1-O 2.85Å; T644-T659 PolarHBondContact OG1-OG1 3.3Å
660	V	91.7	Very high	85.6	Confident	50 Å²	50	75.2 Å²	75.2	30%	0.303	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	132.7	175.5	178.8	0	0	0	0	110.2	F562 F604 L643 D662	F562-V660 HydrophobicContact CD1-CG1 4.23Å; F562-V660 HydrophobicContact CE1-CG1 4.2Å; F604-V660 HydrophobicContact CB-CG2 3.58Å; F604-V660 HydrophobicContact CD1-CG2 3.95Å; F604-V660 HydrophobicContact CG-CG2 3.88Å; L643-V660 HydrophobicContact CD2-CG2 4.39Å; V660-D662 PolarHBondContact O-N 3.46Å
661	N	89.8	Confident	86.2	Confident	22 Å²	22	67.3 Å²	67.3	12%	0.118	34%	0.344	C	S	.	.			trans	-86	84.4	175.7	-176.7	15.6	0	0	0	110.9	R641 V642 T644 Q663 F664	R641-N661 PolarHBondContact O-ND2 3.27Å; V642-N661 WeakPolarHBondContact O-CB 3.39Å; V642-N661 PolarHBondContact O-N 3.49Å; T644-N661 HydrophobicContact CG2-CB 4.04Å; N661-Q663 PolarHBondContact O-N 3.42Å; N661-Q663 VanDerWaalsContact O-N 3.08Å; N661-Q663 WeakPolarHBondContact OD1-CB 3.16Å; N661-Q663 PolarHBondContact OD1-N 3Å; N661-F664 WeakPolarHBondContact O-CB 3.47Å; N661-F664 PolarHBondContact O-N 3.39Å
662	D	85.5	Confident	86.4	Confident	58 Å²	58	66.5 Å²	66.5	31%	0.31	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-12.4	176.5	-84.2	-53	0	0	0	114.2	Y563 G564 V660 F664	Y563-D662 PolarHBondContact N-OD1 3.34Å; G564-D662 WeakPolarHBondContact CA-O 3.4Å; V660-D662 PolarHBondContact O-N 3.46Å; D662-F664 VanDerWaalsContact C-N 3.28Å
663	Q	81.3	Confident	86.4	Confident	138 Å²	138	65.9 Å²	65.9	65%	0.645	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.6	173.5	-58.2	-177.3	-3.7	0	0	113.2	N661 T665	N661-Q663 PolarHBondContact O-N 3.42Å; N661-Q663 VanDerWaalsContact O-N 3.08Å; N661-Q663 WeakPolarHBondContact OD1-CB 3.16Å; N661-Q663 PolarHBondContact OD1-N 3Å; Q663-T665 PolarHBondContact O-N 3.01Å
664	F	83.6	Confident	85.7	Confident	2 Å²	2	64 Å²	64	1%	0.009	33%	0.326	C	S	.	.			trans	-53.3	134.9	-179.8	177.2	-102.8	0	0	0	112.3	F562 R587 H589 T639 R641 V642 N661 D662 V671	F562-F664 HydrophobicContact CD1-CB 4.18Å; F562-F664 HydrophobicContact CD2-CD1 4.08Å; F562-F664 HydrophobicContact CE1-CB 4.05Å; F562-F664 HydrophobicContact CE1-CD1 4.31Å; F562-F664 HydrophobicContact CE1-CG 4.42Å; F562-F664 AromaticContact CE2-CD1 3.61Å; F562-F664 HydrophobicContact CE2-CD1 3.61Å; F562-F664 HydrophobicContact CE2-CE1 4.18Å; F562-F664 HydrophobicContact CE2-CG 4.48Å; F562-F664 HydrophobicContact CZ-CB 4.32Å; F562-F664 AromaticContact CZ-CD1 3.73Å; F562-F664 HydrophobicContact CZ-CD1 3.73Å; F562-F664 HydrophobicContact CZ-CE1 4.41Å; F562-F664 HydrophobicContact CZ-CG 4.21Å; R587-F664 PolarHBondContact NH1-O 3.46Å; H589-F664 AromaticContact CD2-CE1 3.82Å; T639-F664 VanDerWaalsContact O-CE2 3.3Å; T639-F664 WeakPolarHBondContact O-CE2 3.28Å; T639-F664 WeakPolarHBondContact O-CZ 3.35Å; R641-F664 WeakPolarHBondContact O-CD2 3.36Å; V642-F664 HydrophobicContact CG2-CD2 4.33Å; V642-F664 HydrophobicContact CG2-CE2 4.19Å; V642-F664 HydrophobicContact CG2-CZ 4.39Å; N661-F664 WeakPolarHBondContact O-CB 3.47Å; N661-F664 PolarHBondContact O-N 3.39Å; D662-F664 VanDerWaalsContact C-N 3.28Å; F664-V671 HydrophobicContact CE1-CG2 4.48Å; F664-V671 HydrophobicContact CZ-CG1 4.21Å; F664-V671 HydrophobicContact CZ-CG2 4.27Å
665	T	78.5	Confident	84.8	Confident	81 Å²	81	60.7 Å²	60.7	50%	0.497	31%	0.309	S	S	.	.			trans	-140.4	141.4	175	53.4	0	0	0	0	110.8	Q663	Q663-T665 PolarHBondContact O-N 3.01Å
666	S	81.5	Confident	83.1	Confident	28 Å²	28	64.3 Å²	64.3	20%	0.196	32%	0.319	C	S	.	.			trans	-141.5	145	171.6	176.5	0	0	0	0	110	L668 V671	S666-L668 PolarHBondContact O-N 3.26Å; S666-L668 PolarHBondContact OG-N 2.91Å; S666-L668 VanDerWaalsContact OG-N 3.08Å; S666-L668 PolarHBondContact OG-O 3.05Å; S666-V671 WeakPolarHBondContact OG-CG2 3.36Å
667	K	82.7	Confident	80.5	Confident	193 Å²	193	69.7 Å²	69.7	84%	0.839	35%	0.347	S	S	*	.	S	Bend	trans	-69.1	-20.6	170.8	-64.4	-175.7	179.7	-178.1	0	112.2
668	L	83.4	Confident	77.7	Confident	107 Å²	107	72.4 Å²	72.4	56%	0.56	36%	0.359	S	S	*	.			trans	-100.4	133.7	-178.6	-58.5	177.2	0	0	0	110.5	H589 S666 R670 V671	H589-L668 PolarHBondContact ND1-O 2.93Å; S666-L668 PolarHBondContact O-N 3.26Å; S666-L668 PolarHBondContact OG-N 2.91Å; S666-L668 VanDerWaalsContact OG-N 3.08Å; S666-L668 PolarHBondContact OG-O 3.05Å; L668-R670 WeakPolarHBondContact CB-O 3.34Å; L668-V671 VanDerWaalsContact O-CG2 3.31Å; L668-V671 WeakPolarHBondContact O-CG2 3.31Å
669	H	84.9	Confident	74.8	Confident	119 Å²	119	75 Å²	75	55%	0.551	39%	0.386	S	S	*	.	S	Bend	trans	-66.3	-41.5	173.1	-179.6	-99.5	0	0	0	111.8	H589 I590	H589-H669 WeakPolarHBondContact CA-O 3.41Å; I590-H669 PolarHBondContact N-O 3.32Å
670	R	87.4	Confident	71.8	Confident	133 Å²	133	83.2 Å²	83.2	50%	0.502	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.9	172.1	-168.7	176.5	-126.4	139.7	-1.8	109.1	D557 I590 Q592 L668	D557-R670 IonicContact OD2-CZ 2.97Å; D557-R670 IonicContact OD2-NE 3.7Å; D557-R670 PolarHBondContact OD2-NE 3.16Å; D557-R670 IonicContact OD2-NH2 2.61Å; D557-R670 PolarHBondContact OD2-NH2 3.48Å; I590-R670 HydrophobicContact CB-CB 4.38Å; I590-R670 HydrophobicContact CB-CG 4.11Å; I590-R670 HydrophobicContact CG2-CG 4.13Å; I590-R670 CarbonylContact O-C 3.46Å; I590-R670 WeakPolarHBondContact O-CA 3.44Å; Q592-R670 HydrophobicContact CG-CG 3.75Å; L668-R670 WeakPolarHBondContact CB-O 3.34Å
671	V	87.3	Confident	69	Low	7 Å²	7	84.1 Å²	84.1	4%	0.042	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.1	-175.7	-174.7	0	0	0	0	109.2	I590 L591 Q592 F664 S666 L668	I590-V671 PolarHBondContact O-N 3.34Å; L591-V671 CarbonylContact C-O 3.5Å; L591-V671 WeakPolarHBondContact CA-O 3.46Å; L591-V671 HydrophobicContact CD2-CB 4.1Å; Q592-V671 PolarHBondContact N-O 2.94Å; F664-V671 HydrophobicContact CE1-CG2 4.48Å; F664-V671 HydrophobicContact CZ-CG1 4.21Å; F664-V671 HydrophobicContact CZ-CG2 4.27Å; S666-V671 WeakPolarHBondContact OG-CG2 3.36Å; L668-V671 VanDerWaalsContact O-CG2 3.31Å; L668-V671 WeakPolarHBondContact O-CG2 3.31Å
672	K	86.8	Confident	66.1	Low	106 Å²	106	87.3 Å²	87.3	46%	0.461	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.2	174.1	-172.8	172.8	-175.6	173.6	0	110.4	Q592 Q640 Q674	Q592-K672 HydrophobicContact CB-CB 4.42Å; Q592-K672 HydrophobicContact CB-CG 4.34Å; Q640-K672 PolarHBondContact NE2-O 3.05Å; Q640-K672 VanDerWaalsContact NE2-O 3.08Å; K672-Q674 HydrophobicContact CD-CG 4.33Å; K672-Q674 HydrophobicContact CG-CG 4.08Å
673	I	84.7	Confident	63.7	Low	5 Å²	5	88.5 Å²	88.5	3%	0.026	45%	0.449	C	S	.	.			trans	-93.4	106.8	175.3	-51.6	-177.2	0	0	0	107.3	L591 Q592 V593 L633 V642	L591-I673 HydrophobicContact CB-CD1 4.38Å; L591-I673 HydrophobicContact CD1-CD1 4.28Å; L591-I673 HydrophobicContact CD2-CD1 4.33Å; Q592-I673 PolarHBondContact O-N 3Å; V593-I673 HydrophobicContact CG1-CB 4.09Å; V593-I673 HydrophobicContact CG1-CD1 3.79Å; V593-I673 HydrophobicContact CG1-CG1 4.15Å; L633-I673 HydrophobicContact CD2-CD1 3.93Å; L633-I673 HydrophobicContact CD2-CG2 4.1Å; V642-I673 HydrophobicContact CB-CD1 4.35Å; V642-I673 HydrophobicContact CG2-CD1 3.51Å
674	Q	72.4	Confident	61.5	Low	68 Å²	68	85.2 Å²	85.2	32%	0.318	44%	0.441	S	S	.	.			trans	-89.5	126.8	-179.7	-64.2	-175.5	13.5	0	0	109.4	S632 K672 D676 F708	S632-Q674 WeakPolarHBondContact CB-O 3.32Å; K672-Q674 HydrophobicContact CD-CG 4.33Å; K672-Q674 HydrophobicContact CG-CG 4.08Å; Q674-D676 PolarHBondContact O-N 2.87Å; Q674-F708 VanDerWaalsContact NE2-CE2 3.31Å
675	T	63.8	Low	59.3	Low	30 Å²	30	87.6 Å²	87.6	18%	0.184	46%	0.458	C	S	.	.			trans	-70.1	122.7	163.9	-39.6	0	0	0	0	107.4	Q597 R628 L677	Q597-T675 PolarHBondContact NE2-OG1 2.81Å; R628-T675 HydrophobicContact CB-CG2 4.02Å; T675-L677 VanDerWaalsContact C-N 3.31Å; T675-L677 PolarHBondContact O-N 3.15Å
676	D	48.5	Very low	57.3	Low	119 Å²	119	91.2 Å²	91.2	64%	0.636	46%	0.462	S	S	*	.			trans	-62.8	95.9	170.8	-84.3	-23.1	0	0	0	108.1	Q674 I678	Q674-D676 PolarHBondContact O-N 2.87Å; D676-I678 PolarHBondContact O-N 3.01Å
677	L	37.5	Very low	55.3	Low	124 Å²	124	98.9 Å²	98.9	65%	0.649	49%	0.487	S	S	*	.			trans	-85.3	11.4	-174.5	-111.7	152.2	0	0	0	113.2	T675	T675-L677 VanDerWaalsContact C-N 3.31Å; T675-L677 PolarHBondContact O-N 3.15Å
678	I	33.6	Very low	53.3	Low	94 Å²	94	95.1 Å²	95.1	48%	0.482	48%	0.476	S	S	.	.	S	Bend	trans	-129.1	129.3	-170.1	-54.7	178.5	0	0	0	110.3	D676 A711	D676-I678 PolarHBondContact O-N 3.01Å; I678-A711 HydrophobicContact CD1-CB 4.36Å; I678-A711 WeakPolarHBondContact CD1-O 3.33Å
679	G	32.7	Very low	51.3	Low	55 Å²	55	92.6 Å²	92.6	57%	0.567	46%	0.462	S	S	*	.			trans	-51.4	151.5	172.4	0	0	0	0	0	112.7	M681	G679-M681 PolarHBondContact O-N 3.15Å
680	K	30.2	Very low	49.1	Very low	208 Å²	208	91.9 Å²	91.9	90%	0.904	46%	0.462	S	S	*	.			trans	-42.9	128.7	-172.8	-66.8	175.2	176.3	176.5	0	113.9
681	M	32.6	Very low	47.2	Very low	70 Å²	70	93.6 Å²	93.6	35%	0.345	47%	0.469	S	S	.	.			trans	-69.2	135	161.3	-150.6	172.6	173	0	0	109.9	G679 I689	G679-M681 PolarHBondContact O-N 3.15Å; M681-I689 HydrophobicContact CE-CD1 3.19Å
682	N	29.9	Very low	44.8	Very low	88 Å²	88	100 Å²	100	47%	0.471	50%	0.496	S	S	.	.			trans	-59.9	134.7	178.1	-174	-18.2	0	0	0	111.1	S684 S685 R686	N682-S684 PolarHBondContact O-N 2.89Å; N682-S684 VanDerWaalsContact O-N 3.08Å; N682-S684 PolarHBondContact OD1-N 3.03Å; N682-S685 PolarHBondContact O-N 3.47Å; N682-S685 VanDerWaalsContact O-N 3.1Å; N682-R686 PolarHBondContact O-N 3.13Å
683	P	34.2	Very low	42.8	Very low	83 Å²	83	98.9 Å²	98.9	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-49.5	-30.9	176.3	-26.2	27	0	0	0	115.4	R686 R687	P683-R686 PolarHBondContact O-N 3.24Å; P683-R687 PolarHBondContact O-N 3.4Å
684	S	35.6	Very low	40.9	Very low	70 Å²	70	104.2 Å²	104.2	49%	0.49	53%	0.527	S	S	.	.	H	α-helix	trans	-68.8	-39.9	179.7	-52.4	0	0	0	0	112.4	N682 R686 R687 L688	N682-S684 PolarHBondContact O-N 2.89Å; N682-S684 VanDerWaalsContact O-N 3.08Å; N682-S684 PolarHBondContact OD1-N 3.03Å; S684-R686 VanDerWaalsContact C-N 3.32Å; S684-R686 PolarHBondContact O-N 2.95Å; S684-R687 PolarHBondContact O-N 2.65Å; S684-L688 PolarHBondContact O-N 3.32Å
685	S	36.3	Very low	39.4	Very low	51 Å²	51	107 Å²	107	36%	0.357	55%	0.545	S	S	.	.	H	α-helix	trans	-69.7	-30.2	176.7	-46.6	0	0	0	0	112.1	N682 I689	N682-S685 PolarHBondContact O-N 3.47Å; N682-S685 VanDerWaalsContact O-N 3.1Å; S685-I689 WeakPolarHBondContact O-CG1 3.43Å; S685-I689 PolarHBondContact O-N 3.2Å
686	R	37.8	Very low	38.2	Very low	157 Å²	157	113.9 Å²	113.9	59%	0.592	57%	0.572	S	S	*	*	H	α-helix	trans	-67.2	-34.1	173.1	-93.5	-178	172.9	176.2	-0.1	113.1	N682 P683 S684 N690	N682-R686 PolarHBondContact O-N 3.13Å; P683-R686 PolarHBondContact O-N 3.24Å; S684-R686 VanDerWaalsContact C-N 3.32Å; S684-R686 PolarHBondContact O-N 2.95Å; R686-N690 WeakPolarHBondContact O-CB 3.29Å; R686-N690 PolarHBondContact O-N 3.36Å
687	R	38.7	Very low	37.6	Very low	190 Å²	190	113.6 Å²	113.6	72%	0.717	58%	0.578	S	S	*	*	H	α-helix	trans	-70.4	-41	177.4	-70.7	-173.6	-141.9	-178.9	5.4	112.1	P683 S684 I689 N690 W691	P683-R687 PolarHBondContact O-N 3.4Å; S684-R687 PolarHBondContact O-N 2.65Å; R687-I689 VanDerWaalsContact C-N 3.33Å; R687-I689 PolarHBondContact O-N 3Å; R687-N690 PolarHBondContact O-N 3.5Å; R687-W691 VanDerWaalsContact O-CB 3.28Å; R687-W691 WeakPolarHBondContact O-CB 3.25Å; R687-W691 PolarHBondContact O-N 2.9Å
688	L	40.6	Very low	37.6	Very low	114 Å²	114	114.6 Å²	114.6	60%	0.597	58%	0.584	S	S	*	*	H	α-helix	trans	-62.6	-39.2	175.8	-97.3	153.1	0	0	0	112.3	S684 W691 F692	S684-L688 PolarHBondContact O-N 3.32Å; L688-W691 PolarHBondContact O-N 3.29Å; L688-F692 WeakPolarHBondContact O-CB 3.31Å; L688-F692 PolarHBondContact O-N 3.03Å
689	I	42	Very low	37.9	Very low	53 Å²	53	120.2 Å²	120.2	27%	0.272	60%	0.6	S	S	.	*	H	α-helix	trans	-73.1	-42.2	177.7	-68.6	168.6	0	0	0	111.5	M681 S685 R687 W691 F692 I693 M710	M681-I689 HydrophobicContact CE-CD1 3.19Å; S685-I689 WeakPolarHBondContact O-CG1 3.43Å; S685-I689 PolarHBondContact O-N 3.2Å; R687-I689 VanDerWaalsContact C-N 3.33Å; R687-I689 PolarHBondContact O-N 3Å; I689-W691 VanDerWaalsContact C-N 3.29Å; I689-W691 PolarHBondContact O-N 3.43Å; I689-F692 PolarHBondContact O-N 3.34Å; I689-I693 HydrophobicContact CG2-CD1 3.5Å; I689-I693 VanDerWaalsContact CG2-CD1 3.5Å; I689-I693 HydrophobicContact CG2-CG1 4.22Å; I689-I693 WeakPolarHBondContact O-CB 3.35Å; I689-I693 WeakPolarHBondContact O-CG1 3.42Å; I689-I693 PolarHBondContact O-N 3.49Å; I689-M710 HydrophobicContact CD1-SD 4.39Å
690	N	38.4	Very low	38.2	Very low	104 Å²	104	124.5 Å²	124.5	56%	0.556	61%	0.609	S	S	*	*	H	α-helix	trans	-63.6	-37.5	173.6	-84	-8.9	0	0	0	111.3	R686 R687 I693 T694	R686-N690 WeakPolarHBondContact O-CB 3.29Å; R686-N690 PolarHBondContact O-N 3.36Å; R687-N690 PolarHBondContact O-N 3.5Å; N690-I693 PolarHBondContact O-N 2.85Å; N690-T694 WeakPolarHBondContact O-CB 3.28Å; N690-T694 PolarHBondContact O-N 3.39Å; N690-T694 VanDerWaalsContact O-N 3.09Å; N690-T694 PolarHBondContact O-OG1 3.41Å
691	W	47.8	Very low	38.6	Very low	169 Å²	169	121.7 Å²	121.7	64%	0.64	60%	0.603	S	S	*	*	H	α-helix	trans	-63	-45	173.9	-173.3	79.4	0	0	0	111.7	R687 L688 I689 I693 T694	R687-W691 VanDerWaalsContact O-CB 3.28Å; R687-W691 WeakPolarHBondContact O-CB 3.25Å; R687-W691 PolarHBondContact O-N 2.9Å; L688-W691 PolarHBondContact O-N 3.29Å; I689-W691 VanDerWaalsContact C-N 3.29Å; I689-W691 PolarHBondContact O-N 3.43Å; W691-I693 PolarHBondContact O-N 3.36Å; W691-T694 PolarHBondContact O-N 3.04Å
692	F	37.7	Very low	38.8	Very low	142 Å²	142	124.7 Å²	124.7	62%	0.623	62%	0.618	S	S	*	*	H	α-helix	trans	-65.9	-35.2	176.6	-119.4	-89.9	0	0	0	114.2	L688 I689	L688-F692 WeakPolarHBondContact O-CB 3.31Å; L688-F692 PolarHBondContact O-N 3.03Å; I689-F692 PolarHBondContact O-N 3.34Å
693	I	43.9	Very low	39	Very low	82 Å²	82	125.8 Å²	125.8	42%	0.421	62%	0.624	S	S	.	*	H	α-helix	trans	-75.5	-29.5	-179.7	-70.1	170.9	0	0	0	111.5	I689 N690 W691	I689-I693 HydrophobicContact CG2-CD1 3.5Å; I689-I693 VanDerWaalsContact CG2-CD1 3.5Å; I689-I693 HydrophobicContact CG2-CG1 4.22Å; I689-I693 WeakPolarHBondContact O-CB 3.35Å; I689-I693 WeakPolarHBondContact O-CG1 3.42Å; I689-I693 PolarHBondContact O-N 3.49Å; N690-I693 PolarHBondContact O-N 2.85Å; W691-I693 PolarHBondContact O-N 3.36Å
694	T	44.8	Very low	39	Very low	117 Å²	117	127.9 Å²	127.9	72%	0.718	63%	0.626	S	S	*	*	H	α-helix	trans	-78.8	-23.8	-175.4	-43.9	0	0	0	0	112.5	N690 W691	N690-T694 WeakPolarHBondContact O-CB 3.28Å; N690-T694 PolarHBondContact O-N 3.39Å; N690-T694 VanDerWaalsContact O-N 3.09Å; N690-T694 PolarHBondContact O-OG1 3.41Å; W691-T694 PolarHBondContact O-N 3.04Å
695	D	41	Very low	38.8	Very low	128 Å²	128	129.8 Å²	129.8	68%	0.684	63%	0.63	S	S	*	*	H	α-helix	trans	-107.8	-10	-167.5	-140.1	47	0	0	0	115.8
696	F	38.9	Very low	38.6	Very low	173 Å²	173	129.7 Å²	129.7	76%	0.759	63%	0.632	S	S	*	*	H	α-helix	trans	-134.2	-4.2	-169.8	-145.9	-102.5	0	0	0	120.3
697	C	35	Very low	38.3	Very low	113 Å²	113	127.2 Å²	127.2	76%	0.764	63%	0.626	S	S	*	*			trans	-148	119.8	-178.9	-86.5	0	0	0	0	115.2
698	D	38.5	Very low	38	Very low	145 Å²	145	123 Å²	123	78%	0.775	61%	0.613	S	S	*	*			trans	-79.6	139.7	170.6	-144.8	-0.6	0	0	0	111.3
699	R	40	Very low	37.5	Very low	212 Å²	212	121 Å²	121	80%	0.8	61%	0.606	S	S	*	*	S	Bend	trans	59.6	104.7	163	-65.3	-178.5	-167.9	-150.5	0.8	121.4	L701	R699-L701 PolarHBondContact O-N 2.91Å
700	L	38.1	Very low	36.9	Very low	146 Å²	146	123.5 Å²	123.5	76%	0.764	62%	0.617	S	S	*	*	S	Bend		77.8	-4.7	120.6	-96.3	149.1	0	0	0	123.5
701	L	39.7	Very low	36.5	Very low	149 Å²	149	120.2 Å²	120.2	78%	0.78	61%	0.605	S	S	*	*	S	Bend	trans	-133.5	-5.6	176	-101.3	152.6	0	0	0	117	R699	R699-L701 PolarHBondContact O-N 2.91Å
702	M	36.7	Very low	35.8	Very low	133 Å²	133	115 Å²	115	66%	0.655	60%	0.597	S	S	*	*	S	Bend	trans	-100.9	-16	-173	-77.4	-66.4	-159.2	0	0	115.9	E704 L705 A706	M702-E704 VanDerWaalsContact C-N 3.29Å; M702-E704 PolarHBondContact O-N 3.47Å; M702-L705 PolarHBondContact O-N 3.23Å; M702-L705 HydrophobicContact SD-CB 4.36Å; M702-A706 WeakPolarHBondContact O-CB 3.45Å; M702-A706 PolarHBondContact O-N 3.38Å
703	N	33.8	Very low	35.9	Very low	111 Å²	111	112.2 Å²	112.2	59%	0.594	59%	0.585	S	S	*	*	H	α-helix	trans	-67.7	-27.4	-179.5	-83	-20.5	0	0	0	113.3	F707	N703-F707 WeakPolarHBondContact O-CB 3.23Å
704	E	33.2	Very low	36.2	Very low	126 Å²	126	114.2 Å²	114.2	59%	0.589	59%	0.593	S	S	*	*	H	α-helix	trans	-79.7	-35.3	175.1	-70	-167.3	152.2	0	0	112.3	M702 F708	M702-E704 VanDerWaalsContact C-N 3.29Å; M702-E704 PolarHBondContact O-N 3.47Å; E704-F708 WeakPolarHBondContact O-CB 3.24Å; E704-F708 PolarHBondContact O-N 3.3Å; E704-F708 VanDerWaalsContact O-N 3.15Å
705	L	32.7	Very low	36.9	Very low	111 Å²	111	109.7 Å²	109.7	58%	0.581	57%	0.57	S	S	*	*	H	α-helix	trans	-73.1	-43.5	178.5	-124	90.1	0	0	0	112.2	M702 F707 F708 V709	M702-L705 PolarHBondContact O-N 3.23Å; M702-L705 HydrophobicContact SD-CB 4.36Å; L705-F707 PolarHBondContact O-N 3.16Å; L705-F708 PolarHBondContact O-N 3.21Å; L705-V709 WeakPolarHBondContact O-CB 3.4Å; L705-V709 WeakPolarHBondContact O-CG2 3.39Å; L705-V709 PolarHBondContact O-N 2.92Å
706	A	31.3	Very low	38.3	Very low	48 Å²	48	104.7 Å²	104.7	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-65.2	-39.2	-179.4	0	0	0	0	0	112.1	M702 M710	M702-A706 WeakPolarHBondContact O-CB 3.45Å; M702-A706 PolarHBondContact O-N 3.38Å; A706-M710 WeakPolarHBondContact O-CG 3.35Å; A706-M710 PolarHBondContact O-N 2.64Å; A706-M710 VanDerWaalsContact O-N 3.1Å
707	F	32.1	Very low	39.6	Very low	106 Å²	106	98.6 Å²	98.6	47%	0.465	52%	0.521	S	S	.	.	H	α-helix	trans	-70.6	-38.3	175.8	-166.2	-96.9	0	0	0	112.2	N703 L705 M710 A711	N703-F707 WeakPolarHBondContact O-CB 3.23Å; L705-F707 PolarHBondContact O-N 3.16Å; F707-M710 PolarHBondContact O-N 3.41Å; F707-A711 WeakPolarHBondContact O-CB 3.32Å; F707-A711 PolarHBondContact O-N 3.12Å
708	F	30.8	Very low	41.3	Very low	102 Å²	102	97.3 Å²	97.3	45%	0.447	51%	0.506	S	S	.	.	H	α-helix	trans	-65.2	-39.7	174.8	-114	-88.5	0	0	0	112.9	Q674 E704 L705 M710 A712	Q674-F708 VanDerWaalsContact NE2-CE2 3.31Å; E704-F708 WeakPolarHBondContact O-CB 3.24Å; E704-F708 PolarHBondContact O-N 3.3Å; E704-F708 VanDerWaalsContact O-N 3.15Å; L705-F708 PolarHBondContact O-N 3.21Å; F708-M710 VanDerWaalsContact C-N 3.33Å; F708-A712 VanDerWaalsContact O-CB 3.3Å; F708-A712 WeakPolarHBondContact O-CB 3.34Å; F708-A712 PolarHBondContact O-N 2.99Å
709	V	31.2	Very low	43	Very low	72 Å²	72	94.8 Å²	94.8	44%	0.436	50%	0.498	S	S	.	.	H	α-helix	trans	-70	-31.2	178.1	172	0	0	0	0	111	L705 K713	L705-V709 WeakPolarHBondContact O-CB 3.4Å; L705-V709 WeakPolarHBondContact O-CG2 3.39Å; L705-V709 PolarHBondContact O-N 2.92Å; V709-K713 HydrophobicContact CG1-CD 4.27Å; V709-K713 WeakPolarHBondContact O-CB 3.46Å; V709-K713 VanDerWaalsContact O-CD 3.24Å; V709-K713 WeakPolarHBondContact O-CD 3.32Å; V709-K713 WeakPolarHBondContact O-CG 3.42Å
710	M	28.7	Very low	44.6	Very low	105 Å²	105	88.2 Å²	88.2	52%	0.517	48%	0.476	S	S	.	.	H	α-helix	trans	-85.1	-40.7	178.9	-70.1	-161.7	-156.1	0	0	113.9	I689 A706 F707 F708 A712 K713	I689-M710 HydrophobicContact CD1-SD 4.39Å; A706-M710 WeakPolarHBondContact O-CG 3.35Å; A706-M710 PolarHBondContact O-N 2.64Å; A706-M710 VanDerWaalsContact O-N 3.1Å; F707-M710 PolarHBondContact O-N 3.41Å; F708-M710 VanDerWaalsContact C-N 3.33Å; M710-A712 VanDerWaalsContact C-N 3.3Å; M710-A712 PolarHBondContact O-N 3.34Å; M710-K713 PolarHBondContact O-N 3.03Å
711	A	30.5	Very low	46.6	Very low	35 Å²	35	83.1 Å²	83.1	29%	0.289	45%	0.447	S	S	.	.	H	α-helix	trans	-70.4	-25.7	-179.5	0	0	0	0	0	113.1	I678 F707	I678-A711 HydrophobicContact CD1-CB 4.36Å; I678-A711 WeakPolarHBondContact CD1-O 3.33Å; F707-A711 WeakPolarHBondContact O-CB 3.32Å; F707-A711 PolarHBondContact O-N 3.12Å
712	A	33	Very low	48.7	Very low	59 Å²	59	83.7 Å²	83.7	49%	0.488	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.7	175.6	0	0	0	0	0	114.3	F708 M710	F708-A712 VanDerWaalsContact O-CB 3.3Å; F708-A712 WeakPolarHBondContact O-CB 3.34Å; F708-A712 PolarHBondContact O-N 2.99Å; M710-A712 VanDerWaalsContact C-N 3.3Å; M710-A712 PolarHBondContact O-N 3.34Å
713	K	40.6	Very low	51	Low	83 Å²	83	82.3 Å²	82.3	36%	0.361	44%	0.435	S	S	.	.	S	Bend	trans	-104.3	-7.7	-175.5	-83.3	-175	179.9	-171.2	0	114.7	V709 M710	V709-K713 HydrophobicContact CG1-CD 4.27Å; V709-K713 WeakPolarHBondContact O-CB 3.46Å; V709-K713 VanDerWaalsContact O-CD 3.24Å; V709-K713 WeakPolarHBondContact O-CD 3.32Å; V709-K713 WeakPolarHBondContact O-CG 3.42Å; M710-K713 PolarHBondContact O-N 3.03Å
714	Q	50.4	Low	53.4	Low	124 Å²	124	77.6 Å²	77.6	58%	0.579	41%	0.41	S	S	*	.			trans	-88.7	125.4	176.3	-75	-177.2	-18.9	0	0	110
715	G	59.5	Low	56	Low	23 Å²	23	75.3 Å²	75.3	24%	0.237	40%	0.396	C	S	.	.			trans	-63	-174.6	171.4	0	0	0	0	0	112.4	E385	E385-G715 VanDerWaalsContact OE1-CA 3.27Å; E385-G715 WeakPolarHBondContact OE1-CA 3.47Å
716	E	68.8	Low	58.7	Low	23 Å²	23	74.7 Å²	74.7	11%	0.107	39%	0.39	C	S	.	.			trans	-56.7	151.2	-178.8	-68.6	-164.5	155.9	0	0	111.6	E385 Y430 Q433 E720 R721 T724	E385-E716 PolarHBondContact OE1-N 2.95Å; Y430-E716 HydrophobicContact CE1-CG 4.15Å; Y430-E716 WeakPolarHBondContact CE1-OE2 3.3Å; Q433-E716 VanDerWaalsContact CD-OE1 3.29Å; Q433-E716 PolarHBondContact NE2-OE1 3.25Å; Q433-E716 PolarHBondContact OE1-OE1 3.28Å; E716-E720 HydrophobicContact CB-CB 4.03Å; E716-R721 HydrophobicContact CB-CG 3.72Å; E716-R721 PolarHBondContact O-NE 3.23Å; E716-R721 PolarHBondContact O-NH1 2.99Å; E716-R721 PolarHBondContact O-NH2 3.26Å; E716-T724 WeakPolarHBondContact OE2-CB 3.44Å; E716-T724 PolarHBondContact OE2-OG1 3.3Å
717	S	67.1	Low	61.4	Low	44 Å²	44	75.6 Å²	75.6	31%	0.308	39%	0.385	S	S	.	.			trans	-67.5	153.5	171	64.2	0	0	0	0	110.2	P719 E720 R721	S717-P719 VanDerWaalsContact C-CD 3.43Å; S717-P719 VanDerWaalsContact C-N 3.34Å; S717-E720 WeakPolarHBondContact CB-OE2 3.4Å; S717-E720 PolarHBondContact N-OE2 3.4Å; S717-E720 WeakPolarHBondContact O-CA 3.38Å; S717-E720 WeakPolarHBondContact O-CB 3.38Å; S717-E720 PolarHBondContact O-N 2.94Å; S717-E720 VanDerWaalsContact OG-CG 3.31Å; S717-E720 WeakPolarHBondContact OG-CG 3.49Å; S717-E720 PolarHBondContact OG-OE2 3.47Å; S717-R721 PolarHBondContact O-N 2.95Å
718	D	71.4	Confident	64.2	Low	87 Å²	87	70.8 Å²	70.8	47%	0.465	37%	0.365	S	S	.	.	H	α-helix	trans	-52.9	-38.3	-179.9	-67.3	-22.4	0	0	0	115.6	R382 R721 K722	R382-D718 IonicContact NH2-OD1 3.68Å; D718-R721 IonicContact OD1-NH1 3.92Å; D718-R721 PolarHBondContact OD1-NH1 3.29Å; D718-K722 WeakPolarHBondContact O-CG 3.47Å; D718-K722 PolarHBondContact O-N 3.28Å; D718-K722 VanDerWaalsContact O-N 3.14Å
719	P	73.4	Confident	67	Low	92 Å²	92	68.6 Å²	68.6	60%	0.597	36%	0.358	S	S	*	.	H	α-helix	trans	-66.9	-38.2	172.9	24.6	-33.4	0	0	0	113	S717 K722 E723	S717-P719 VanDerWaalsContact C-CD 3.43Å; S717-P719 VanDerWaalsContact C-N 3.34Å; P719-K722 PolarHBondContact O-N 3.21Å; P719-E723 PolarHBondContact O-N 2.92Å; P719-E723 VanDerWaalsContact O-N 3.08Å
720	E	73.6	Confident	69.8	Low	73 Å²	73	67.7 Å²	67.7	34%	0.341	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-43	176.4	-71.5	165	160.5	0	0	110.9	E716 S717 K722 E723 T724	E716-E720 HydrophobicContact CB-CB 4.03Å; S717-E720 WeakPolarHBondContact CB-OE2 3.4Å; S717-E720 PolarHBondContact N-OE2 3.4Å; S717-E720 WeakPolarHBondContact O-CA 3.38Å; S717-E720 WeakPolarHBondContact O-CB 3.38Å; S717-E720 PolarHBondContact O-N 2.94Å; S717-E720 VanDerWaalsContact OG-CG 3.31Å; S717-E720 WeakPolarHBondContact OG-CG 3.49Å; S717-E720 PolarHBondContact OG-OE2 3.47Å; E720-K722 VanDerWaalsContact C-N 3.3Å; E720-K722 PolarHBondContact O-N 3.08Å; E720-E723 WeakPolarHBondContact O-CB 3.29Å; E720-E723 PolarHBondContact O-N 3.4Å; E720-E723 VanDerWaalsContact O-N 3.12Å; E720-T724 WeakPolarHBondContact O-CB 2.95Å; E720-T724 PolarHBondContact O-N 2.82Å; E720-T724 PolarHBondContact O-OG1 2.89Å
721	R	81.3	Confident	72.7	Confident	40 Å²	40	66.6 Å²	66.6	15%	0.151	35%	0.347	C	S	.	.	H	α-helix	trans	-56.6	-43.8	174.1	-72.1	-177.4	175	116	17.3	112.2	E385 E716 S717 D718 E723 T724 R725	E385-R721 IonicContact OE1-CZ 3.67Å; E385-R721 IonicContact OE1-NE 3.67Å; E385-R721 PolarHBondContact OE1-NE 2.91Å; E385-R721 IonicContact OE1-NH2 3.95Å; E385-R721 PolarHBondContact OE1-NH2 3.08Å; E385-R721 IonicContact OE2-CZ 3.12Å; E385-R721 IonicContact OE2-NE 2.63Å; E385-R721 PolarHBondContact OE2-NE 2.83Å; E385-R721 IonicContact OE2-NH2 2.73Å; E716-R721 HydrophobicContact CB-CG 3.72Å; E716-R721 PolarHBondContact O-NE 3.23Å; E716-R721 PolarHBondContact O-NH1 2.99Å; E716-R721 PolarHBondContact O-NH2 3.26Å; S717-R721 PolarHBondContact O-N 2.95Å; D718-R721 IonicContact OD1-NH1 3.92Å; D718-R721 PolarHBondContact OD1-NH1 3.29Å; R721-E723 VanDerWaalsContact C-N 3.35Å; R721-T724 PolarHBondContact O-N 3.35Å; R721-R725 VanDerWaalsContact O-CB 3.31Å; R721-R725 WeakPolarHBondContact O-CB 3.24Å; R721-R725 PolarHBondContact O-N 3.43Å
722	K	82.8	Confident	75.8	Confident	160 Å²	160	66.2 Å²	66.2	70%	0.696	34%	0.338	S	S	*	.	H	α-helix	trans	-63.1	-42.2	177.5	-75.7	178.8	-177.8	-178.2	0	111.4	D718 P719 E720 R725 Q726	D718-K722 WeakPolarHBondContact O-CG 3.47Å; D718-K722 PolarHBondContact O-N 3.28Å; D718-K722 VanDerWaalsContact O-N 3.14Å; P719-K722 PolarHBondContact O-N 3.21Å; E720-K722 VanDerWaalsContact C-N 3.3Å; E720-K722 PolarHBondContact O-N 3.08Å; K722-R725 PolarHBondContact O-N 3.42Å; K722-Q726 WeakPolarHBondContact O-CB 3.43Å; K722-Q726 PolarHBondContact O-N 3.21Å
723	E	84.3	Confident	78.6	Confident	105 Å²	105	67.2 Å²	67.2	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-45.8	175.6	-171.9	-173.6	163.7	0	0	111.6	P719 E720 R721 R725 Q726 K727	P719-E723 PolarHBondContact O-N 2.92Å; P719-E723 VanDerWaalsContact O-N 3.08Å; E720-E723 WeakPolarHBondContact O-CB 3.29Å; E720-E723 PolarHBondContact O-N 3.4Å; E720-E723 VanDerWaalsContact O-N 3.12Å; R721-E723 VanDerWaalsContact C-N 3.35Å; E723-R725 VanDerWaalsContact C-N 3.31Å; E723-R725 PolarHBondContact O-N 3.47Å; E723-Q726 PolarHBondContact O-N 3.23Å; E723-K727 HydrophobicContact CG-CD 4.48Å; E723-K727 WeakPolarHBondContact O-CG 3.19Å; E723-K727 PolarHBondContact O-N 3.45Å; E723-K727 WeakPolarHBondContact OE1-CE 3.31Å; E723-K727 IonicContact OE1-NZ 3.99Å; E723-K727 PolarHBondContact OE1-NZ 2.91Å
724	T	84.9	Confident	81.1	Confident	12 Å²	12	69.3 Å²	69.3	7%	0.074	34%	0.342	C	S	.	.	H	α-helix	trans	-57.1	-46.5	175.6	-67.2	0	0	0	0	110.6	R429 Y430 E716 E720 R721 K727 V728	R429-T724 HydrophobicContact CG-CG2 4.09Å; Y430-T724 HydrophobicContact CD1-CG2 4.47Å; Y430-T724 HydrophobicContact CE1-CG2 3.85Å; Y430-T724 HydrophobicContact CE2-CG2 4.46Å; E716-T724 WeakPolarHBondContact OE2-CB 3.44Å; E716-T724 PolarHBondContact OE2-OG1 3.3Å; E720-T724 WeakPolarHBondContact O-CB 2.95Å; E720-T724 PolarHBondContact O-N 2.82Å; E720-T724 PolarHBondContact O-OG1 2.89Å; R721-T724 PolarHBondContact O-N 3.35Å; T724-K727 PolarHBondContact O-N 3.1Å; T724-V728 WeakPolarHBondContact O-CG2 3.32Å; T724-V728 PolarHBondContact O-N 2.78Å; T724-V728 VanDerWaalsContact O-N 3.12Å
725	R	87.7	Confident	83.1	Confident	77 Å²	77	65.4 Å²	65.4	29%	0.291	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-47.6	177.4	-172.7	66.3	174.8	-142.6	6.6	112.3	E423 R721 K722 E723 K727 V728 D729	E423-R725 VanDerWaalsContact CD-NH2 3.27Å; E423-R725 IonicContact OE1-CZ 2.66Å; E423-R725 IonicContact OE1-NH1 2.9Å; E423-R725 IonicContact OE1-NH2 3.9Å; E423-R725 PolarHBondContact OE1-NH2 2.78Å; E423-R725 IonicContact OE2-CZ 2.72Å; E423-R725 VanDerWaalsContact OE2-CZ 3.27Å; E423-R725 IonicContact OE2-NH1 2.75Å; E423-R725 PolarHBondContact OE2-NH1 2.75Å; E423-R725 IonicContact OE2-NH2 2.8Å; E423-R725 PolarHBondContact OE2-NH2 3.48Å; R721-R725 VanDerWaalsContact O-CB 3.31Å; R721-R725 WeakPolarHBondContact O-CB 3.24Å; R721-R725 PolarHBondContact O-N 3.43Å; K722-R725 PolarHBondContact O-N 3.42Å; E723-R725 VanDerWaalsContact C-N 3.31Å; E723-R725 PolarHBondContact O-N 3.47Å; R725-K727 VanDerWaalsContact C-N 3.28Å; R725-K727 PolarHBondContact O-N 3.31Å; R725-V728 WeakPolarHBondContact O-CB 3.33Å; R725-V728 PolarHBondContact O-N 3.22Å; R725-V728 VanDerWaalsContact O-N 3.09Å; R725-D729 PolarHBondContact O-N 3.47Å
726	Q	88.6	Confident	84.9	Confident	98 Å²	98	64.4 Å²	64.4	46%	0.458	31%	0.313	S	S	.	.	H	α-helix	trans	-57	-44.3	178.9	-179.1	56.9	52.2	0	0	111.3	K722 E723 V728 D729 D730	K722-Q726 WeakPolarHBondContact O-CB 3.43Å; K722-Q726 PolarHBondContact O-N 3.21Å; E723-Q726 PolarHBondContact O-N 3.23Å; Q726-V728 PolarHBondContact O-N 3.09Å; Q726-D729 PolarHBondContact O-N 3.16Å; Q726-D730 PolarHBondContact NE2-OD1 3.46Å; Q726-D730 PolarHBondContact NE2-OD2 2.9Å; Q726-D730 VanDerWaalsContact O-CG 3.31Å; Q726-D730 PolarHBondContact O-N 3.43Å
727	K	87.9	Confident	86.1	Confident	67 Å²	67	64.4 Å²	64.4	29%	0.291	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-37.1	177.8	-68	175.3	-175.6	167.4	0	112.3	R429 E723 T724 R725 D730 D731	R429-K727 VanDerWaalsContact NH2-CB 3.25Å; E723-K727 HydrophobicContact CG-CD 4.48Å; E723-K727 WeakPolarHBondContact O-CG 3.19Å; E723-K727 PolarHBondContact O-N 3.45Å; E723-K727 WeakPolarHBondContact OE1-CE 3.31Å; E723-K727 IonicContact OE1-NZ 3.99Å; E723-K727 PolarHBondContact OE1-NZ 2.91Å; T724-K727 PolarHBondContact O-N 3.1Å; R725-K727 VanDerWaalsContact C-N 3.28Å; R725-K727 PolarHBondContact O-N 3.31Å; K727-D730 PolarHBondContact O-N 3.31Å; K727-D731 VanDerWaalsContact O-CG 3.27Å; K727-D731 PolarHBondContact O-N 2.78Å
728	V	91	Very high	87.4	Confident	6 Å²	6	64.4 Å²	64.4	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-62.7	-45.2	172.4	175.5	0	0	0	0	110.6	D425 V426 R429 T724 R725 Q726 D730 D731 R732	D425-V728 WeakPolarHBondContact OD2-CG1 3.4Å; V426-V728 HydrophobicContact CG2-CG1 3.93Å; R429-V728 HydrophobicContact CB-CG2 4.28Å; R429-V728 HydrophobicContact CG-CG2 4.44Å; T724-V728 WeakPolarHBondContact O-CG2 3.32Å; T724-V728 PolarHBondContact O-N 2.78Å; T724-V728 VanDerWaalsContact O-N 3.12Å; R725-V728 WeakPolarHBondContact O-CB 3.33Å; R725-V728 PolarHBondContact O-N 3.22Å; R725-V728 VanDerWaalsContact O-N 3.09Å; Q726-V728 PolarHBondContact O-N 3.09Å; V728-D730 VanDerWaalsContact C-N 3.26Å; V728-D730 PolarHBondContact O-N 3.01Å; V728-D731 PolarHBondContact O-N 3.35Å; V728-D731 VanDerWaalsContact O-N 3.15Å; V728-R732 HydrophobicContact CG1-CG 4.3Å; V728-R732 VanDerWaalsContact O-CG 3.32Å; V728-R732 WeakPolarHBondContact O-CG 3.27Å; V728-R732 PolarHBondContact O-N 2.84Å
729	D	90.1	Very high	88.5	Confident	55 Å²	55	60.2 Å²	60.2	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-65.5	-30.9	179.7	-70.3	-30.1	0	0	0	112.4	R725 Q726 R732 K733	R725-D729 PolarHBondContact O-N 3.47Å; Q726-D729 PolarHBondContact O-N 3.16Å; D729-R732 IonicContact OD1-CZ 3.72Å; D729-R732 IonicContact OD1-NH1 2.79Å; D729-R732 PolarHBondContact OD1-NH1 2.99Å; D729-K733 WeakPolarHBondContact O-CG 3.41Å; D729-K733 PolarHBondContact O-N 3.43Å
730	D	90.6	Very high	89.6	Confident	53 Å²	53	55.9 Å²	55.9	28%	0.283	27%	0.265	S	S	.	.	H	α-helix	trans	-69.3	-42.2	171.1	-68.9	-33.2	0	0	0	112.1	Q726 K727 V728 K733 H734	Q726-D730 PolarHBondContact NE2-OD1 3.46Å; Q726-D730 PolarHBondContact NE2-OD2 2.9Å; Q726-D730 VanDerWaalsContact O-CG 3.31Å; Q726-D730 PolarHBondContact O-N 3.43Å; K727-D730 PolarHBondContact O-N 3.31Å; V728-D730 VanDerWaalsContact C-N 3.26Å; V728-D730 PolarHBondContact O-N 3.01Å; D730-K733 WeakPolarHBondContact O-CB 3.48Å; D730-K733 PolarHBondContact O-N 3.02Å; D730-K733 IonicContact OD1-NZ 3.88Å; D730-K733 PolarHBondContact OD1-NZ 3.32Å; D730-H734 PolarHBondContact O-CE1 3.46Å; D730-H734 PolarHBondContact O-ND1 3.46Å
731	D	90	Very high	90.7	Very high	83 Å²	83	53.9 Å²	53.9	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-43.8	174.7	-69	-29	0	0	0	111	R429 K727 V728 K733 H734 E735	R429-D731 IonicContact NH1-OD2 3.79Å; R429-D731 PolarHBondContact NH1-OD2 3.44Å; K727-D731 VanDerWaalsContact O-CG 3.27Å; K727-D731 PolarHBondContact O-N 2.78Å; V728-D731 PolarHBondContact O-N 3.35Å; V728-D731 VanDerWaalsContact O-N 3.15Å; D731-K733 PolarHBondContact O-N 3.5Å; D731-H734 PolarHBondContact O-N 3.22Å; D731-H734 VanDerWaalsContact O-N 3.1Å; D731-E735 PolarHBondContact O-N 3.21Å; D731-E735 VanDerWaalsContact O-N 3.14Å
732	R	94.3	Very high	91.3	Very high	26 Å²	26	57.9 Å²	57.9	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-55.4	-35.9	177.3	-74.4	174.6	173.8	177	-6.9	113.1	E423 D425 V728 D729 H734 E735 I736 F767	E423-R732 IonicContact OE1-CZ 3.7Å; E423-R732 IonicContact OE1-NH1 2.76Å; E423-R732 PolarHBondContact OE1-NH1 2.99Å; E423-R732 IonicContact OE1-NH2 3.64Å; E423-R732 PolarHBondContact OE1-NH2 3.27Å; D425-R732 IonicContact OD1-CZ 2.9Å; D425-R732 IonicContact OD1-NE 2.72Å; D425-R732 IonicContact OD1-NH2 3.9Å; D425-R732 PolarHBondContact OD1-NH2 2.81Å; D425-R732 WeakPolarHBondContact OD2-CG 3.48Å; D425-R732 IonicContact OD2-CZ 3.74Å; D425-R732 IonicContact OD2-NE 2.76Å; D425-R732 PolarHBondContact OD2-NE 3.49Å; D425-R732 IonicContact OD2-NH2 2.68Å; D425-R732 PolarHBondContact OD2-NH2 2.98Å; V728-R732 HydrophobicContact CG1-CG 4.3Å; V728-R732 VanDerWaalsContact O-CG 3.32Å; V728-R732 WeakPolarHBondContact O-CG 3.27Å; V728-R732 PolarHBondContact O-N 2.84Å; D729-R732 IonicContact OD1-CZ 3.72Å; D729-R732 IonicContact OD1-NH1 2.79Å; D729-R732 PolarHBondContact OD1-NH1 2.99Å; R732-H734 VanDerWaalsContact C-N 3.34Å; R732-H734 PolarHBondContact O-N 2.73Å; R732-E735 PolarHBondContact O-N 3.16Å; R732-I736 VanDerWaalsContact O-CG1 3.22Å; R732-I736 WeakPolarHBondContact O-CG1 3.46Å; R732-I736 PolarHBondContact O-N 3.28Å; R732-F767 HydrophobicContact CB-CE1 4.43Å; R732-F767 HydrophobicContact CB-CE2 4.15Å; R732-F767 HydrophobicContact CB-CZ 3.89Å; R732-F767 HydrophobicContact CG-CD1 4.17Å; R732-F767 HydrophobicContact CG-CD2 4.2Å; R732-F767 HydrophobicContact CG-CE1 3.87Å; R732-F767 HydrophobicContact CG-CE2 3.87Å; R732-F767 HydrophobicContact CG-CG 4.35Å; R732-F767 HydrophobicContact CG-CZ 3.7Å
733	K	93.4	Very high	91.9	Very high	80 Å²	80	51 Å²	51	35%	0.348	24%	0.243	S	C	.	.	H	α-helix	trans	-58.5	-47.9	178	-68.2	165.8	-169.1	167.1	0	110.9	D729 D730 D731 E737	D729-K733 WeakPolarHBondContact O-CG 3.41Å; D729-K733 PolarHBondContact O-N 3.43Å; D730-K733 WeakPolarHBondContact O-CB 3.48Å; D730-K733 PolarHBondContact O-N 3.02Å; D730-K733 IonicContact OD1-NZ 3.88Å; D730-K733 PolarHBondContact OD1-NZ 3.32Å; D731-K733 PolarHBondContact O-N 3.5Å; K733-E737 VanDerWaalsContact O-CG 3.31Å; K733-E737 WeakPolarHBondContact O-CG 3.2Å; K733-E737 PolarHBondContact O-N 3.3Å; K733-E737 VanDerWaalsContact O-N 3.08Å
734	H	92.7	Very high	92.5	Very high	127 Å²	127	46 Å²	46	59%	0.588	22%	0.22	S	C	*	.	H	α-helix	trans	-67.9	-38.4	-179.4	-56.5	95.5	0	0	0	111.3	D730 D731 R732 E737 A738	D730-H734 PolarHBondContact O-CE1 3.46Å; D730-H734 PolarHBondContact O-ND1 3.46Å; D731-H734 PolarHBondContact O-N 3.22Å; D731-H734 VanDerWaalsContact O-N 3.1Å; R732-H734 VanDerWaalsContact C-N 3.34Å; R732-H734 PolarHBondContact O-N 2.73Å; H734-E737 PolarHBondContact O-N 2.8Å; H734-A738 WeakPolarHBondContact O-CB 3.32Å; H734-A738 PolarHBondContact O-N 2.8Å
735	E	92.5	Very high	93	Very high	43 Å²	43	51.3 Å²	51.3	20%	0.201	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-41.3	177.9	-65.9	-171.1	-173.6	0	0	112.9	D731 R732 A738 A739 R766 F767	D731-E735 PolarHBondContact O-N 3.21Å; D731-E735 VanDerWaalsContact O-N 3.14Å; R732-E735 PolarHBondContact O-N 3.16Å; E735-A738 PolarHBondContact O-N 3.23Å; E735-A739 WeakPolarHBondContact O-CB 3.44Å; E735-A739 PolarHBondContact O-N 2.68Å; E735-R766 IonicContact OE1-CZ 3.65Å; E735-R766 VanDerWaalsContact OE1-CZ 3.26Å; E735-R766 IonicContact OE1-NH1 3.57Å; E735-R766 PolarHBondContact OE1-NH1 3.43Å; E735-R766 IonicContact OE1-NH2 3.51Å; E735-R766 PolarHBondContact OE1-NH2 3.15Å; E735-R766 IonicContact OE2-CZ 3.62Å; E735-R766 IonicContact OE2-NE 2.75Å; E735-R766 IonicContact OE2-NH1 2.87Å; E735-R766 PolarHBondContact OE2-NH1 3.14Å; E735-F767 HydrophobicContact CB-CE1 4.48Å
736	I	95.7	Very high	93.3	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-46.3	174.9	-66.1	166.2	0	0	0	110.4	R732 A738 A739 I740 V759 L763 F767 P769 V773 I774 R777	R732-I736 VanDerWaalsContact O-CG1 3.22Å; R732-I736 WeakPolarHBondContact O-CG1 3.46Å; R732-I736 PolarHBondContact O-N 3.28Å; I736-A738 PolarHBondContact O-N 3.42Å; I736-A739 PolarHBondContact O-N 3.19Å; I736-I740 HydrophobicContact CG2-CD1 3.72Å; I736-I740 HydrophobicContact CG2-CG1 4.37Å; I736-I740 VanDerWaalsContact O-CG1 3.27Å; I736-I740 WeakPolarHBondContact O-CG1 3.22Å; I736-I740 PolarHBondContact O-N 2.88Å; I736-V759 HydrophobicContact CG2-CG1 4.4Å; I736-L763 HydrophobicContact CB-CD1 4.33Å; I736-L763 HydrophobicContact CG1-CD1 3.65Å; I736-F767 HydrophobicContact CD1-CE2 4.1Å; I736-F767 HydrophobicContact CD1-CZ 4.26Å; I736-F767 HydrophobicContact CG1-CE2 4.18Å; I736-F767 HydrophobicContact CG1-CZ 3.92Å; I736-P769 HydrophobicContact CD1-CB 4.05Å; I736-P769 HydrophobicContact CG1-CB 4.37Å; I736-V773 HydrophobicContact CD1-CG1 3.62Å; I736-I774 HydrophobicContact CG2-CG1 4.26Å; I736-R777 HydrophobicContact CB-CG 4.16Å; I736-R777 HydrophobicContact CG2-CB 3.88Å; I736-R777 HydrophobicContact CG2-CG 3.73Å
737	E	95.3	Very high	93.6	Very high	22 Å²	22	54.5 Å²	54.5	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-45.6	177.7	-72.5	174.9	-167.1	0	0	111.7	K733 H734 A739 I740 V741 R777 L781 R784	K733-E737 VanDerWaalsContact O-CG 3.31Å; K733-E737 WeakPolarHBondContact O-CG 3.2Å; K733-E737 PolarHBondContact O-N 3.3Å; K733-E737 VanDerWaalsContact O-N 3.08Å; H734-E737 PolarHBondContact O-N 2.8Å; E737-A739 VanDerWaalsContact C-N 3.34Å; E737-A739 PolarHBondContact O-N 2.85Å; E737-I740 PolarHBondContact O-N 2.85Å; E737-V741 WeakPolarHBondContact O-CG2 3.23Å; E737-V741 PolarHBondContact O-N 2.86Å; E737-R777 HydrophobicContact CG-CB 4.06Å; E737-R777 HydrophobicContact CG-CG 4.25Å; E737-R777 VanDerWaalsContact OE1-CD 3.3Å; E737-R777 WeakPolarHBondContact OE1-CD 3.27Å; E737-R777 IonicContact OE1-CZ 3.64Å; E737-R777 IonicContact OE1-NE 3.75Å; E737-R777 IonicContact OE1-NH1 3.79Å; E737-R777 PolarHBondContact OE1-NH1 3.25Å; E737-L781 HydrophobicContact CB-CD1 4.46Å; E737-L781 HydrophobicContact CB-CD2 4.5Å; E737-L781 HydrophobicContact CG-CD1 4.44Å; E737-L781 HydrophobicContact CG-CG 4.41Å; E737-R784 IonicContact OE1-NH2 2.9Å; E737-R784 PolarHBondContact OE1-NH2 3.34Å; E737-R784 IonicContact OE2-CZ 2.89Å; E737-R784 IonicContact OE2-NH1 3.82Å; E737-R784 PolarHBondContact OE2-NH1 3.43Å; E737-R784 IonicContact OE2-NH2 2.72Å; E737-R784 PolarHBondContact OE2-NH2 2.94Å
738	A	93.9	Very high	93.9	Very high	44 Å²	44	56.9 Å²	56.9	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-38.2	176.7	0	0	0	0	0	112.5	H734 E735 I736 R742	H734-A738 WeakPolarHBondContact O-CB 3.32Å; H734-A738 PolarHBondContact O-N 2.8Å; E735-A738 PolarHBondContact O-N 3.23Å; I736-A738 PolarHBondContact O-N 3.42Å; A738-R742 WeakPolarHBondContact O-CB 3.37Å; A738-R742 VanDerWaalsContact O-CG 3.27Å; A738-R742 WeakPolarHBondContact O-CG 3.48Å; A738-R742 PolarHBondContact O-N 2.99Å; A738-R742 PolarHBondContact O-NE 3.22Å
739	A	95.1	Very high	94	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63	-50.2	174	0	0	0	0	0	111.6	E735 I736 E737 V741 R742 I743 V759 L763	E735-A739 WeakPolarHBondContact O-CB 3.44Å; E735-A739 PolarHBondContact O-N 2.68Å; I736-A739 PolarHBondContact O-N 3.19Å; E737-A739 VanDerWaalsContact C-N 3.34Å; E737-A739 PolarHBondContact O-N 2.85Å; A739-V741 PolarHBondContact O-N 3.42Å; A739-R742 PolarHBondContact O-N 2.65Å; A739-I743 WeakPolarHBondContact O-CG1 3.36Å; A739-I743 PolarHBondContact O-N 3.09Å; A739-V759 HydrophobicContact CB-CG1 4.46Å; A739-L763 HydrophobicContact CB-CD1 4.23Å; A739-L763 HydrophobicContact CB-CD2 4.19Å; A739-L763 HydrophobicContact CB-CG 4.21Å
740	I	96.2	Very high	94.3	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56	-50.5	177.4	-67.2	161.5	0	0	0	110.6	I736 E737 R742 I743 M744 L755 V759 I774 R777 I778 L781 L787	I736-I740 HydrophobicContact CG2-CD1 3.72Å; I736-I740 HydrophobicContact CG2-CG1 4.37Å; I736-I740 VanDerWaalsContact O-CG1 3.27Å; I736-I740 WeakPolarHBondContact O-CG1 3.22Å; I736-I740 PolarHBondContact O-N 2.88Å; E737-I740 PolarHBondContact O-N 2.85Å; I740-R742 PolarHBondContact O-N 2.95Å; I740-I743 PolarHBondContact O-N 2.93Å; I740-M744 HydrophobicContact CG2-CG 4.29Å; I740-M744 WeakPolarHBondContact O-CB 3.48Å; I740-M744 WeakPolarHBondContact O-CG 3.23Å; I740-M744 PolarHBondContact O-N 3.4Å; I740-L755 HydrophobicContact CG2-CD2 4.38Å; I740-V759 HydrophobicContact CG1-CG1 4.41Å; I740-V759 HydrophobicContact CG1-CG2 3.68Å; I740-I774 HydrophobicContact CD1-CG2 4.31Å; I740-R777 HydrophobicContact CD1-CB 3.86Å; I740-I778 HydrophobicContact CD1-CG1 3.84Å; I740-I778 HydrophobicContact CG1-CG1 4.49Å; I740-I778 HydrophobicContact CG2-CG1 4.45Å; I740-L781 HydrophobicContact CB-CD1 3.8Å; I740-L781 HydrophobicContact CD1-CD1 4.07Å; I740-L781 HydrophobicContact CG2-CD1 3.52Å; I740-L787 HydrophobicContact CG2-CD1 3.77Å
741	V	95.9	Very high	94.6	Very high	31 Å²	31	62.2 Å²	62.2	19%	0.188	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-43.2	-178.8	170.5	0	0	0	0	111.2	E737 A739 M744 K745 L781 Y786 Y799	E737-V741 WeakPolarHBondContact O-CG2 3.23Å; E737-V741 PolarHBondContact O-N 2.86Å; A739-V741 PolarHBondContact O-N 3.42Å; V741-M744 PolarHBondContact O-N 3.38Å; V741-K745 WeakPolarHBondContact O-CB 3.46Å; V741-K745 PolarHBondContact O-N 3.06Å; V741-L781 HydrophobicContact CG2-CD1 4.03Å; V741-L781 HydrophobicContact CG2-CD2 3.79Å; V741-Y786 HydrophobicContact CG2-CD1 4.33Å; V741-Y799 HydrophobicContact CG1-CE2 4.21Å
742	R	95.1	Very high	94.8	Very high	125 Å²	125	60 Å²	60	47%	0.472	28%	0.281	S	S	.	.	H	α-helix	trans	-61.3	-45.7	177.5	-77	-176.1	-60.5	-159	4	112.4	A738 A739 I740 S746	A738-R742 WeakPolarHBondContact O-CB 3.37Å; A738-R742 VanDerWaalsContact O-CG 3.27Å; A738-R742 WeakPolarHBondContact O-CG 3.48Å; A738-R742 PolarHBondContact O-N 2.99Å; A738-R742 PolarHBondContact O-NE 3.22Å; A739-R742 PolarHBondContact O-N 2.65Å; I740-R742 PolarHBondContact O-N 2.95Å; R742-S746 PolarHBondContact O-N 3.44Å
743	I	95.8	Very high	94.8	Very high	14 Å²	14	64.2 Å²	64.2	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-63.2	-52.1	178.6	-68.5	163.5	0	0	0	110	A739 I740 K745 S746 R747 M750 L755 E758 V759	A739-I743 WeakPolarHBondContact O-CG1 3.36Å; A739-I743 PolarHBondContact O-N 3.09Å; I740-I743 PolarHBondContact O-N 2.93Å; I743-K745 PolarHBondContact O-N 3.36Å; I743-S746 PolarHBondContact O-N 2.89Å; I743-R747 HydrophobicContact CG2-CG 4.37Å; I743-R747 WeakPolarHBondContact O-CB 3.49Å; I743-R747 WeakPolarHBondContact O-CG 3.32Å; I743-R747 PolarHBondContact O-N 2.95Å; I743-M750 HydrophobicContact CG2-CE 3.73Å; I743-M750 HydrophobicContact CG2-SD 3.96Å; I743-L755 HydrophobicContact CB-CD1 4.29Å; I743-L755 HydrophobicContact CG2-CD1 3.79Å; I743-E758 HydrophobicContact CD1-CB 4Å; I743-E758 HydrophobicContact CG2-CB 4.49Å; I743-E758 WeakPolarHBondContact CG2-OE2 3.44Å; I743-V759 HydrophobicContact CD1-CB 4.37Å; I743-V759 HydrophobicContact CD1-CG2 3.64Å
744	M	96.3	Very high	94.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-35.8	-177.2	-74.2	-59.1	-60.3	0	0	112.7	I740 V741 S746 R747 K748 M750 L755 L787 Y797 Y799	I740-M744 HydrophobicContact CG2-CG 4.29Å; I740-M744 WeakPolarHBondContact O-CB 3.48Å; I740-M744 WeakPolarHBondContact O-CG 3.23Å; I740-M744 PolarHBondContact O-N 3.4Å; V741-M744 PolarHBondContact O-N 3.38Å; M744-S746 VanDerWaalsContact C-N 3.29Å; M744-S746 PolarHBondContact O-N 3.25Å; M744-R747 PolarHBondContact O-N 2.85Å; M744-K748 VanDerWaalsContact O-CA 3.28Å; M744-K748 WeakPolarHBondContact O-CA 3.37Å; M744-K748 PolarHBondContact O-N 3.37Å; M744-M750 HydrophobicContact CE-CB 4.48Å; M744-M750 HydrophobicContact SD-CB 3.71Å; M744-L755 HydrophobicContact CG-CD1 4.03Å; M744-L755 HydrophobicContact CG-CD2 4.17Å; M744-L755 HydrophobicContact SD-CD1 4.07Å; M744-L755 HydrophobicContact SD-CD2 4.02Å; M744-L787 HydrophobicContact CB-CD2 3.6Å; M744-L787 HydrophobicContact CE-CD2 3.96Å; M744-L787 HydrophobicContact CG-CD1 4.46Å; M744-L787 HydrophobicContact CG-CD2 3.61Å; M744-Y797 WeakPolarHBondContact CE-O 3.39Å; M744-Y799 HydrophobicContact CB-CD2 3.9Å; M744-Y799 HydrophobicContact CB-CG 4.38Å; M744-Y799 WeakPolarHBondContact O-CB 3.48Å
745	K	95.4	Very high	95	Very high	124 Å²	124	57.3 Å²	57.3	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-38.3	174.8	-177.6	174.7	-177.5	175.6	0	112.4	V741 I743 K748 Y799	V741-K745 WeakPolarHBondContact O-CB 3.46Å; V741-K745 PolarHBondContact O-N 3.06Å; I743-K745 PolarHBondContact O-N 3.36Å; K745-K748 WeakPolarHBondContact O-CD 3.4Å; K745-K748 WeakPolarHBondContact O-CE 3.35Å; K745-K748 PolarHBondContact O-NZ 3.06Å; K745-Y799 HydrophobicContact CB-CD1 4.38Å; K745-Y799 HydrophobicContact CB-CD2 4.46Å; K745-Y799 HydrophobicContact CB-CE1 3.95Å; K745-Y799 HydrophobicContact CB-CE2 4.09Å; K745-Y799 HydrophobicContact CG-CE1 3.88Å
746	S	94.5	Very high	95.2	Very high	95 Å²	95	56.1 Å²	56.1	66%	0.664	27%	0.274	S	S	*	.	H	α-helix	trans	-76.5	-45.5	178.7	175.3	0	0	0	0	112.2	R742 I743 M744	R742-S746 PolarHBondContact O-N 3.44Å; I743-S746 PolarHBondContact O-N 2.89Å; M744-S746 VanDerWaalsContact C-N 3.29Å; M744-S746 PolarHBondContact O-N 3.25Å
747	R	93.9	Very high	95.2	Very high	148 Å²	148	58.9 Å²	58.9	56%	0.558	30%	0.297	S	S	*	.	H	α-helix	trans	-89.1	-19.5	-170.6	-61.8	-74.8	-157.1	179.2	5.9	114	I743 M744 K749 M750 E758	I743-R747 HydrophobicContact CG2-CG 4.37Å; I743-R747 WeakPolarHBondContact O-CB 3.49Å; I743-R747 WeakPolarHBondContact O-CG 3.32Å; I743-R747 PolarHBondContact O-N 2.95Å; M744-R747 PolarHBondContact O-N 2.85Å; R747-K749 PolarHBondContact O-N 3.4Å; R747-M750 HydrophobicContact CB-CE 3.73Å; R747-M750 HydrophobicContact CG-CE 3.5Å; R747-M750 VanDerWaalsContact CG-CE 3.5Å; R747-E758 IonicContact CZ-OE1 3.97Å; R747-E758 IonicContact NE-OE1 2.65Å; R747-E758 IonicContact NE-OE2 3.98Å; R747-E758 IonicContact NH2-OE1 3.82Å; R747-E758 PolarHBondContact NH2-OE1 2.79Å
748	K	93.8	Very high	95.2	Very high	117 Å²	117	60.5 Å²	60.5	51%	0.509	31%	0.305	S	S	.	.	S	Bend	trans	63.4	-40.2	-179.4	-55.5	-59.1	-172.9	-174.4	0	116.1	M744 K745 T798 Y799	M744-K748 VanDerWaalsContact O-CA 3.28Å; M744-K748 WeakPolarHBondContact O-CA 3.37Å; M744-K748 PolarHBondContact O-N 3.37Å; K745-K748 WeakPolarHBondContact O-CD 3.4Å; K745-K748 WeakPolarHBondContact O-CE 3.35Å; K745-K748 PolarHBondContact O-NZ 3.06Å; K748-T798 CarbonylContact O-C 3.52Å; K748-T798 VanDerWaalsContact O-CA 3.32Å; K748-T798 WeakPolarHBondContact O-CA 3.42Å; K748-Y799 HydrophobicContact CD-CD1 4.4Å; K748-Y799 PolarHBondContact O-N 3.31Å
749	K	94.6	Very high	95.3	Very high	121 Å²	121	58.4 Å²	58.4	53%	0.526	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	132.8	179	-175	172.1	177.2	168.2	0	109.9	R747 V796 Y797 T798	R747-K749 PolarHBondContact O-N 3.4Å; K749-V796 HydrophobicContact CD-CG1 4.21Å; K749-V796 VanDerWaalsContact CE-CG1 3.47Å; K749-V796 HydrophobicContact CG-CG1 3.67Å; K749-Y797 CarbonylContact C-O 3.57Å; K749-Y797 VanDerWaalsContact CA-O 3.29Å; K749-Y797 WeakPolarHBondContact CA-O 3.42Å; K749-T798 HydrophobicContact CB-CG2 4.29Å; K749-T798 HydrophobicContact CD-CG2 4.28Å; K749-T798 HydrophobicContact CG-CG2 4.04Å
750	M	95.1	Very high	95.2	Very high	15 Å²	15	59.9 Å²	59.9	7%	0.074	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	145.6	-178.4	-166.1	172.5	-79.2	0	0	112.8	I743 M744 R747 V754 L755 E758 Y797	I743-M750 HydrophobicContact CG2-CE 3.73Å; I743-M750 HydrophobicContact CG2-SD 3.96Å; M744-M750 HydrophobicContact CE-CB 4.48Å; M744-M750 HydrophobicContact SD-CB 3.71Å; R747-M750 HydrophobicContact CB-CE 3.73Å; R747-M750 HydrophobicContact CG-CE 3.5Å; R747-M750 VanDerWaalsContact CG-CE 3.5Å; M750-V754 HydrophobicContact CG-CB 4.07Å; M750-V754 HydrophobicContact CG-CG1 4.05Å; M750-V754 HydrophobicContact SD-CB 4.46Å; M750-V754 HydrophobicContact SD-CG1 4.08Å; M750-L755 HydrophobicContact CG-CB 4.04Å; M750-L755 WeakPolarHBondContact SD-CA 3.23Å; M750-L755 HydrophobicContact SD-CB 3.64Å; M750-L755 HydrophobicContact SD-CD1 3.81Å; M750-L755 HydrophobicContact SD-CG 4.33Å; M750-E758 WeakPolarHBondContact CE-OE2 3.32Å; M750-Y797 PolarHBondContact N-O 3.09Å; M750-Y797 PolarHBondContact O-N 2.88Å
751	Q	96.6	Very high	95	Very high	89 Å²	89	65.9 Å²	65.9	42%	0.416	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	146.8	173.2	-163.8	-170.7	28.6	0	0	111.2	N753 V754 L755 K795 V796	Q751-N753 PolarHBondContact O-N 3.47Å; Q751-V754 HydrophobicContact CB-CG2 4.18Å; Q751-V754 PolarHBondContact O-N 3.38Å; Q751-V754 VanDerWaalsContact O-N 3.16Å; Q751-L755 PolarHBondContact O-N 3.42Å; Q751-K795 CarbonylContact C-O 3.29Å; Q751-K795 WeakPolarHBondContact CA-O 3.39Å; Q751-V796 HydrophobicContact CG-CG2 4.45Å
752	H	94.8	Very high	94.8	Very high	38 Å²	38	68.4 Å²	68.4	18%	0.176	34%	0.335	C	S	.	.	H	α-helix	trans	-51.1	-52.5	-177.7	180	84.3	0	0	0	113.8	V754 L755 V756 K795 Y797	H752-V754 VanDerWaalsContact C-N 3.29Å; H752-V754 PolarHBondContact O-N 3.38Å; H752-L755 PolarHBondContact O-N 2.86Å; H752-V756 WeakPolarHBondContact O-CG2 3.36Å; H752-V756 PolarHBondContact O-N 3.06Å; H752-K795 PolarHBondContact N-O 3.48Å; H752-Y797 HydrophobicContact CB-CE2 3.68Å; H752-Y797 AromaticContact CG-CE2 3.98Å; H752-Y797 AromaticContact ND1-CE2 3.47Å; H752-Y797 WeakPolarHBondContact ND1-CE2 3.36Å; H752-Y797 AromaticContact ND1-CZ 3.64Å; H752-Y797 PolarHBondContact ND1-OH 2.93Å
753	N	95	Very high	94.6	Very high	114 Å²	114	62.8 Å²	62.8	61%	0.61	31%	0.314	S	S	*	.	H	α-helix	trans	-63.7	-37.2	-177.3	-68.8	-11.2	0	0	0	112	Q751 A757	Q751-N753 PolarHBondContact O-N 3.47Å; N753-A757 WeakPolarHBondContact O-CB 3.31Å; N753-A757 PolarHBondContact O-N 2.83Å
754	V	95.4	Very high	94.3	Very high	61 Å²	61	69 Å²	69	37%	0.37	34%	0.336	S	S	.	.	H	α-helix	trans	-68.3	-43.7	176.9	-177.7	0	0	0	0	110.3	M750 Q751 H752 A757 E758	M750-V754 HydrophobicContact CG-CB 4.07Å; M750-V754 HydrophobicContact CG-CG1 4.05Å; M750-V754 HydrophobicContact SD-CB 4.46Å; M750-V754 HydrophobicContact SD-CG1 4.08Å; Q751-V754 HydrophobicContact CB-CG2 4.18Å; Q751-V754 PolarHBondContact O-N 3.38Å; Q751-V754 VanDerWaalsContact O-N 3.16Å; H752-V754 VanDerWaalsContact C-N 3.29Å; H752-V754 PolarHBondContact O-N 3.38Å; V754-A757 PolarHBondContact O-N 3.44Å; V754-E758 PolarHBondContact O-N 2.96Å
755	L	95.4	Very high	93.8	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.4	-45.5	176.8	-179.9	59.8	0	0	0	111.8	I740 I743 M744 M750 Q751 H752 A757 E758 V759 I778 Y797	I740-L755 HydrophobicContact CG2-CD2 4.38Å; I743-L755 HydrophobicContact CB-CD1 4.29Å; I743-L755 HydrophobicContact CG2-CD1 3.79Å; M744-L755 HydrophobicContact CG-CD1 4.03Å; M744-L755 HydrophobicContact CG-CD2 4.17Å; M744-L755 HydrophobicContact SD-CD1 4.07Å; M744-L755 HydrophobicContact SD-CD2 4.02Å; M750-L755 HydrophobicContact CG-CB 4.04Å; M750-L755 WeakPolarHBondContact SD-CA 3.23Å; M750-L755 HydrophobicContact SD-CB 3.64Å; M750-L755 HydrophobicContact SD-CD1 3.81Å; M750-L755 HydrophobicContact SD-CG 4.33Å; Q751-L755 PolarHBondContact O-N 3.42Å; H752-L755 PolarHBondContact O-N 2.86Å; L755-A757 VanDerWaalsContact C-N 3.31Å; L755-A757 PolarHBondContact O-N 3.13Å; L755-E758 PolarHBondContact O-N 3.41Å; L755-V759 HydrophobicContact CD1-CG2 3.96Å; L755-V759 HydrophobicContact CG-CG2 4.34Å; L755-V759 WeakPolarHBondContact O-CB 3.12Å; L755-V759 WeakPolarHBondContact O-CG2 3.38Å; L755-V759 PolarHBondContact O-N 2.89Å; L755-I778 HydrophobicContact CD2-CD1 3.83Å; L755-I778 HydrophobicContact CD2-CG1 4.3Å; L755-I778 HydrophobicContact CG-CD1 4.45Å; L755-Y797 HydrophobicContact CD2-CD2 3.86Å; L755-Y797 HydrophobicContact CD2-CE2 4.35Å
756	V	95.9	Very high	93.5	Very high	18 Å²	18	68.1 Å²	68.1	11%	0.109	34%	0.341	C	S	.	.	H	α-helix	trans	-60.5	-42.6	176.6	171	0	0	0	0	110.7	H752 T760 P771 I774	H752-V756 WeakPolarHBondContact O-CG2 3.36Å; H752-V756 PolarHBondContact O-N 3.06Å; V756-T760 WeakPolarHBondContact O-CB 3.27Å; V756-T760 PolarHBondContact O-N 2.92Å; V756-T760 PolarHBondContact O-OG1 3.4Å; V756-P771 HydrophobicContact CG1-CB 4.15Å; V756-P771 HydrophobicContact CG1-CG 4.48Å; V756-I774 HydrophobicContact CG1-CD1 4.07Å; V756-I774 HydrophobicContact CG2-CG2 4.02Å
757	A	95.3	Very high	93.4	Very high	60 Å²	60	63.9 Å²	63.9	50%	0.496	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-46.5	176.9	0	0	0	0	0	112.3	N753 V754 L755 T760 Q761	N753-A757 WeakPolarHBondContact O-CB 3.31Å; N753-A757 PolarHBondContact O-N 2.83Å; V754-A757 PolarHBondContact O-N 3.44Å; L755-A757 VanDerWaalsContact C-N 3.31Å; L755-A757 PolarHBondContact O-N 3.13Å; A757-T760 PolarHBondContact O-N 3.25Å; A757-Q761 WeakPolarHBondContact O-CB 3.36Å; A757-Q761 PolarHBondContact O-N 2.72Å
758	E	95.4	Very high	93.2	Very high	56 Å²	56	61.1 Å²	61.1	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-42.5	177.9	-74.8	-161.9	-168.9	0	0	111.9	I743 R747 M750 V754 L755 Q761 Q762	I743-E758 HydrophobicContact CD1-CB 4Å; I743-E758 HydrophobicContact CG2-CB 4.49Å; I743-E758 WeakPolarHBondContact CG2-OE2 3.44Å; R747-E758 IonicContact CZ-OE1 3.97Å; R747-E758 IonicContact NE-OE1 2.65Å; R747-E758 IonicContact NE-OE2 3.98Å; R747-E758 IonicContact NH2-OE1 3.82Å; R747-E758 PolarHBondContact NH2-OE1 2.79Å; M750-E758 WeakPolarHBondContact CE-OE2 3.32Å; V754-E758 PolarHBondContact O-N 2.96Å; L755-E758 PolarHBondContact O-N 3.41Å; E758-Q761 PolarHBondContact O-N 2.83Å; E758-Q762 WeakPolarHBondContact O-CB 3.44Å; E758-Q762 PolarHBondContact O-N 3.5Å
759	V	95.5	Very high	93.1	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-44.9	176	171.5	0	0	0	0	110.9	I736 A739 I740 I743 L755 Q761 Q762 L763 I774	I736-V759 HydrophobicContact CG2-CG1 4.4Å; A739-V759 HydrophobicContact CB-CG1 4.46Å; I740-V759 HydrophobicContact CG1-CG1 4.41Å; I740-V759 HydrophobicContact CG1-CG2 3.68Å; I743-V759 HydrophobicContact CD1-CB 4.37Å; I743-V759 HydrophobicContact CD1-CG2 3.64Å; L755-V759 HydrophobicContact CD1-CG2 3.96Å; L755-V759 HydrophobicContact CG-CG2 4.34Å; L755-V759 WeakPolarHBondContact O-CB 3.12Å; L755-V759 WeakPolarHBondContact O-CG2 3.38Å; L755-V759 PolarHBondContact O-N 2.89Å; V759-Q761 VanDerWaalsContact C-N 3.34Å; V759-Q761 PolarHBondContact O-N 3.41Å; V759-Q762 PolarHBondContact O-N 3.46Å; V759-L763 HydrophobicContact CG1-CD1 3.89Å; V759-L763 WeakPolarHBondContact O-CG 3.18Å; V759-L763 PolarHBondContact O-N 3.36Å; V759-I774 HydrophobicContact CB-CD1 4.3Å; V759-I774 HydrophobicContact CG1-CD1 3.88Å; V759-I774 HydrophobicContact CG1-CG1 4.08Å; V759-I774 HydrophobicContact CG1-CG2 4.3Å
760	T	94.1	Very high	92.9	Very high	32 Å²	32	52.8 Å²	52.8	20%	0.196	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-44.9	177.6	-56.8	0	0	0	0	110.7	V756 A757 L763 R764 L768	V756-T760 WeakPolarHBondContact O-CB 3.27Å; V756-T760 PolarHBondContact O-N 2.92Å; V756-T760 PolarHBondContact O-OG1 3.4Å; A757-T760 PolarHBondContact O-N 3.25Å; T760-L763 PolarHBondContact O-N 3.48Å; T760-R764 WeakPolarHBondContact O-CB 3.23Å; T760-R764 PolarHBondContact O-N 3.26Å; T760-L768 HydrophobicContact CG2-CD1 3.67Å
761	Q	92.4	Very high	92.8	Very high	125 Å²	125	56 Å²	56	58%	0.584	30%	0.3	S	S	*	.	H	α-helix	trans	-64.6	-40.3	178.6	-178.2	59.3	29.3	0	0	112.1	A757 E758 V759	A757-Q761 WeakPolarHBondContact O-CB 3.36Å; A757-Q761 PolarHBondContact O-N 2.72Å; E758-Q761 PolarHBondContact O-N 2.83Å; V759-Q761 VanDerWaalsContact C-N 3.34Å; V759-Q761 PolarHBondContact O-N 3.41Å
762	Q	91.1	Very high	92.7	Very high	84 Å²	84	57.3 Å²	57.3	39%	0.393	31%	0.313	S	S	.	.	H	α-helix	trans	-66.9	-36.1	178.5	-170.5	177.3	22.8	0	0	112.4	E758 V759	E758-Q762 WeakPolarHBondContact O-CB 3.44Å; E758-Q762 PolarHBondContact O-N 3.5Å; V759-Q762 PolarHBondContact O-N 3.46Å
763	L	91.6	Very high	92.6	Very high	8 Å²	8	58.2 Å²	58.2	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-89.4	-14.5	-176.9	-66.5	174.4	0	0	0	114.1	I736 A739 V759 T760 A765 R766 F767 P769	I736-L763 HydrophobicContact CB-CD1 4.33Å; I736-L763 HydrophobicContact CG1-CD1 3.65Å; A739-L763 HydrophobicContact CB-CD1 4.23Å; A739-L763 HydrophobicContact CB-CD2 4.19Å; A739-L763 HydrophobicContact CB-CG 4.21Å; V759-L763 HydrophobicContact CG1-CD1 3.89Å; V759-L763 WeakPolarHBondContact O-CG 3.18Å; V759-L763 PolarHBondContact O-N 3.36Å; T760-L763 PolarHBondContact O-N 3.48Å; L763-A765 PolarHBondContact O-N 3.37Å; L763-R766 PolarHBondContact O-N 3.5Å; L763-F767 CarbonylContact C-O 3.52Å; L763-F767 VanDerWaalsContact C-O 3.26Å; L763-F767 HydrophobicContact CD1-CZ 4.03Å; L763-F767 HydrophobicContact CD2-CE1 4.4Å; L763-F767 PolarHBondContact O-N 3.11Å; L763-P769 HydrophobicContact CB-CG 4.23Å; L763-P769 HydrophobicContact CD1-CG 4.07Å
764	R	88.1	Confident	92.6	Very high	143 Å²	143	52.8 Å²	52.8	54%	0.54	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-29.1	-177.2	-172.6	176.9	-179.9	-174.6	0	114.5	T760 R766	T760-R764 WeakPolarHBondContact O-CB 3.23Å; T760-R764 PolarHBondContact O-N 3.26Å; R764-R766 PolarHBondContact O-N 3.25Å
765	A	86.3	Confident	92.6	Very high	50 Å²	50	55.3 Å²	55.3	41%	0.413	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.4	176.6	0	0	0	0	0	113.6	K424 L763	K424-A765 WeakPolarHBondContact CD-O 3.45Å; L763-A765 PolarHBondContact O-N 3.37Å
766	R	88.4	Confident	92.6	Very high	57 Å²	57	62.2 Å²	62.2	22%	0.215	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-48.2	-178.8	-60.4	-170.6	73.9	-166.7	-0.6	113.1	K424 D425 E428 E735 L763 R764	K424-R766 WeakPolarHBondContact CA-O 3.44Å; K424-R766 WeakPolarHBondContact CB-O 3.28Å; K424-R766 PolarHBondContact N-O 3.24Å; D425-R766 PolarHBondContact N-O 2.89Å; E428-R766 IonicContact OE2-CZ 3.24Å; E428-R766 IonicContact OE2-NH2 2.94Å; E428-R766 PolarHBondContact OE2-NH2 3.34Å; E735-R766 IonicContact OE1-CZ 3.65Å; E735-R766 VanDerWaalsContact OE1-CZ 3.26Å; E735-R766 IonicContact OE1-NH1 3.57Å; E735-R766 PolarHBondContact OE1-NH1 3.43Å; E735-R766 IonicContact OE1-NH2 3.51Å; E735-R766 PolarHBondContact OE1-NH2 3.15Å; E735-R766 IonicContact OE2-CZ 3.62Å; E735-R766 IonicContact OE2-NE 2.75Å; E735-R766 IonicContact OE2-NH1 2.87Å; E735-R766 PolarHBondContact OE2-NH1 3.14Å; L763-R766 PolarHBondContact O-N 3.5Å; R764-R766 PolarHBondContact O-N 3.25Å
767	F	92.5	Very high	92.6	Very high	5 Å²	5	63.6 Å²	63.6	2%	0.022	33%	0.331	C	S	.	.			trans	-158.4	164	176.5	65.8	-83.8	0	0	0	111.4	Q422 D425 R732 E735 I736 L763 P769	Q422-F767 WeakPolarHBondContact O-CA 3.32Å; D425-F767 WeakPolarHBondContact OD2-CD1 3.38Å; R732-F767 HydrophobicContact CB-CE1 4.43Å; R732-F767 HydrophobicContact CB-CE2 4.15Å; R732-F767 HydrophobicContact CB-CZ 3.89Å; R732-F767 HydrophobicContact CG-CD1 4.17Å; R732-F767 HydrophobicContact CG-CD2 4.2Å; R732-F767 HydrophobicContact CG-CE1 3.87Å; R732-F767 HydrophobicContact CG-CE2 3.87Å; R732-F767 HydrophobicContact CG-CG 4.35Å; R732-F767 HydrophobicContact CG-CZ 3.7Å; E735-F767 HydrophobicContact CB-CE1 4.48Å; I736-F767 HydrophobicContact CD1-CE2 4.1Å; I736-F767 HydrophobicContact CD1-CZ 4.26Å; I736-F767 HydrophobicContact CG1-CE2 4.18Å; I736-F767 HydrophobicContact CG1-CZ 3.92Å; L763-F767 CarbonylContact C-O 3.52Å; L763-F767 VanDerWaalsContact C-O 3.26Å; L763-F767 HydrophobicContact CD1-CZ 4.03Å; L763-F767 HydrophobicContact CD2-CE1 4.4Å; L763-F767 PolarHBondContact O-N 3.11Å; F767-P769 HydrophobicContact CD2-CB 4.36Å; F767-P769 HydrophobicContact CE2-CB 3.87Å; F767-P769 HydrophobicContact CE2-CG 4.45Å; F767-P769 WeakPolarHBondContact O-CD 3.34Å
768	L	89.8	Confident	92.6	Very high	91 Å²	91	60.7 Å²	60.7	48%	0.476	31%	0.308	S	S	.	.			trans	-99.4	98.5	176.6	-167.8	68.6	0	0	0	110.3	T760	T760-L768 HydrophobicContact CG2-CD1 3.67Å
769	P	91.3	Very high	92.6	Very high	8 Å²	8	60.6 Å²	60.6	5%	0.052	31%	0.307	C	S	.	.			trans	-67.6	138.5	178.6	28.2	-36.5	0	0	0	111.3	I736 L763 F767 I774	I736-P769 HydrophobicContact CD1-CB 4.05Å; I736-P769 HydrophobicContact CG1-CB 4.37Å; L763-P769 HydrophobicContact CB-CG 4.23Å; L763-P769 HydrophobicContact CD1-CG 4.07Å; F767-P769 HydrophobicContact CD2-CB 4.36Å; F767-P769 HydrophobicContact CE2-CB 3.87Å; F767-P769 HydrophobicContact CE2-CG 4.45Å; F767-P769 WeakPolarHBondContact O-CD 3.34Å; P769-I774 HydrophobicContact CB-CD1 3.98Å; P769-I774 HydrophobicContact CB-CG1 3.96Å; P769-I774 HydrophobicContact CG-CD1 3.87Å; P769-I774 HydrophobicContact CG-CG1 4.35Å
770	S	91.4	Very high	92.5	Very high	54 Å²	54	61.1 Å²	61.1	38%	0.378	31%	0.313	S	S	.	.			trans	-73.7	142.7	172.7	77.7	0	0	0	0	110.8	V772 V773 I774	S770-V772 PolarHBondContact O-N 2.96Å; S770-V772 VanDerWaalsContact O-N 3.11Å; S770-V773 PolarHBondContact O-N 3.01Å; S770-V773 VanDerWaalsContact OG-CG2 3.23Å; S770-V773 WeakPolarHBondContact OG-CG2 3.45Å; S770-V773 PolarHBondContact OG-N 3.45Å; S770-I774 PolarHBondContact O-N 3.31Å; S770-I774 VanDerWaalsContact O-N 3.13Å
771	P	92.9	Very high	92.6	Very high	84 Å²	84	59.8 Å²	59.8	55%	0.545	30%	0.304	S	S	.	.	H	α-helix	trans	-54.8	-32.5	177.2	-29	36	0	0	0	113.5	V756 I774 K775	V756-P771 HydrophobicContact CG1-CB 4.15Å; V756-P771 HydrophobicContact CG1-CG 4.48Å; P771-I774 PolarHBondContact O-N 3.36Å; P771-K775 WeakPolarHBondContact O-CB 3.47Å; P771-K775 PolarHBondContact O-N 2.99Å
772	V	94.1	Very high	92.7	Very high	115 Å²	115	55.8 Å²	55.8	70%	0.697	29%	0.286	S	S	*	.	H	α-helix	trans	-64.8	-43.4	177.5	-179.3	0	0	0	0	111.4	S770 K775 K776	S770-V772 PolarHBondContact O-N 2.96Å; S770-V772 VanDerWaalsContact O-N 3.11Å; V772-K775 PolarHBondContact O-N 3.32Å; V772-K776 PolarHBondContact O-N 3.11Å
773	V	93.3	Very high	92.9	Very high	58 Å²	58	59.4 Å²	59.4	35%	0.352	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-43	178.4	174.1	0	0	0	0	110.4	I736 S770 K775 K776 R777	I736-V773 HydrophobicContact CD1-CG1 3.62Å; S770-V773 PolarHBondContact O-N 3.01Å; S770-V773 VanDerWaalsContact OG-CG2 3.23Å; S770-V773 WeakPolarHBondContact OG-CG2 3.45Å; S770-V773 PolarHBondContact OG-N 3.45Å; V773-K775 VanDerWaalsContact C-N 3.33Å; V773-K775 PolarHBondContact O-N 2.97Å; V773-K776 PolarHBondContact O-N 3.49Å; V773-R777 WeakPolarHBondContact O-CG 3.45Å; V773-R777 PolarHBondContact O-N 3.42Å
774	I	94.9	Very high	93.1	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.4	-48.2	175.8	-62.7	169.4	0	0	0	110.2	I736 I740 V756 V759 P769 S770 P771 K776 R777 I778	I736-I774 HydrophobicContact CG2-CG1 4.26Å; I740-I774 HydrophobicContact CD1-CG2 4.31Å; V756-I774 HydrophobicContact CG1-CD1 4.07Å; V756-I774 HydrophobicContact CG2-CG2 4.02Å; V759-I774 HydrophobicContact CB-CD1 4.3Å; V759-I774 HydrophobicContact CG1-CD1 3.88Å; V759-I774 HydrophobicContact CG1-CG1 4.08Å; V759-I774 HydrophobicContact CG1-CG2 4.3Å; P769-I774 HydrophobicContact CB-CD1 3.98Å; P769-I774 HydrophobicContact CB-CG1 3.96Å; P769-I774 HydrophobicContact CG-CD1 3.87Å; P769-I774 HydrophobicContact CG-CG1 4.35Å; S770-I774 PolarHBondContact O-N 3.31Å; S770-I774 VanDerWaalsContact O-N 3.13Å; P771-I774 PolarHBondContact O-N 3.36Å; I774-K776 VanDerWaalsContact C-N 3.34Å; I774-K776 PolarHBondContact O-N 2.88Å; I774-R777 PolarHBondContact O-N 2.99Å; I774-I778 HydrophobicContact CG2-CD1 3.98Å; I774-I778 HydrophobicContact CG2-CG1 4.4Å; I774-I778 WeakPolarHBondContact O-CG1 3.46Å; I774-I778 PolarHBondContact O-N 3.25Å
775	K	94.2	Very high	93.3	Very high	114 Å²	114	65.4 Å²	65.4	50%	0.496	33%	0.332	S	S	.	.	H	α-helix	trans	-55.7	-48.1	176.5	-176.2	-178.7	177.9	-176.3	0	111.6	P771 V772 V773 R777 I778 E779	P771-K775 WeakPolarHBondContact O-CB 3.47Å; P771-K775 PolarHBondContact O-N 2.99Å; V772-K775 PolarHBondContact O-N 3.32Å; V773-K775 VanDerWaalsContact C-N 3.33Å; V773-K775 PolarHBondContact O-N 2.97Å; K775-R777 PolarHBondContact O-N 3.43Å; K775-I778 PolarHBondContact O-N 3.48Å; K775-I778 VanDerWaalsContact O-N 3.15Å; K775-E779 WeakPolarHBondContact O-CG 3.46Å; K775-E779 PolarHBondContact O-N 3.5Å
776	K	95.6	Very high	93.6	Very high	144 Å²	144	67.7 Å²	67.7	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-59.7	-33.1	177.6	-171.2	178.9	-179.3	175.5	0	112.6	V772 V773 I774 G780	V772-K776 PolarHBondContact O-N 3.11Å; V773-K776 PolarHBondContact O-N 3.49Å; I774-K776 VanDerWaalsContact C-N 3.34Å; I774-K776 PolarHBondContact O-N 2.88Å; K776-G780 PolarHBondContact O-N 2.8Å
777	R	96.1	Very high	93.9	Very high	47 Å²	47	65.1 Å²	65.1	18%	0.177	32%	0.322	C	S	.	.	H	α-helix	trans	-75.3	-36.8	176.1	-64.5	-58	82.9	-167.8	-0.3	112.4	I736 E737 I740 V773 I774 K775 G780 L781	I736-R777 HydrophobicContact CB-CG 4.16Å; I736-R777 HydrophobicContact CG2-CB 3.88Å; I736-R777 HydrophobicContact CG2-CG 3.73Å; E737-R777 HydrophobicContact CG-CB 4.06Å; E737-R777 HydrophobicContact CG-CG 4.25Å; E737-R777 VanDerWaalsContact OE1-CD 3.3Å; E737-R777 WeakPolarHBondContact OE1-CD 3.27Å; E737-R777 IonicContact OE1-CZ 3.64Å; E737-R777 IonicContact OE1-NE 3.75Å; E737-R777 IonicContact OE1-NH1 3.79Å; E737-R777 PolarHBondContact OE1-NH1 3.25Å; I740-R777 HydrophobicContact CD1-CB 3.86Å; V773-R777 WeakPolarHBondContact O-CG 3.45Å; V773-R777 PolarHBondContact O-N 3.42Å; I774-R777 PolarHBondContact O-N 2.99Å; K775-R777 PolarHBondContact O-N 3.43Å; R777-G780 PolarHBondContact O-N 3.18Å; R777-L781 WeakPolarHBondContact O-CG 2.96Å; R777-L781 PolarHBondContact O-N 3.02Å
778	I	95.6	Very high	94	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.9	-47.4	172.6	-66.4	167.6	0	0	0	110.3	I740 L755 I774 K775 G780 L781 I782 L787 Y797	I740-I778 HydrophobicContact CD1-CG1 3.84Å; I740-I778 HydrophobicContact CG1-CG1 4.49Å; I740-I778 HydrophobicContact CG2-CG1 4.45Å; L755-I778 HydrophobicContact CD2-CD1 3.83Å; L755-I778 HydrophobicContact CD2-CG1 4.3Å; L755-I778 HydrophobicContact CG-CD1 4.45Å; I774-I778 HydrophobicContact CG2-CD1 3.98Å; I774-I778 HydrophobicContact CG2-CG1 4.4Å; I774-I778 WeakPolarHBondContact O-CG1 3.46Å; I774-I778 PolarHBondContact O-N 3.25Å; K775-I778 PolarHBondContact O-N 3.48Å; K775-I778 VanDerWaalsContact O-N 3.15Å; I778-G780 VanDerWaalsContact C-N 3.35Å; I778-G780 PolarHBondContact O-N 3.14Å; I778-L781 WeakPolarHBondContact O-CB 3.36Å; I778-L781 PolarHBondContact O-N 3.41Å; I778-I782 HydrophobicContact CG2-CD1 3.99Å; I778-I782 HydrophobicContact CG2-CG1 4.47Å; I778-I782 WeakPolarHBondContact O-CG1 3.41Å; I778-I782 PolarHBondContact O-N 2.94Å; I778-L787 HydrophobicContact CG2-CD1 4.26Å; I778-Y797 HydrophobicContact CD1-CE2 4.2Å; I778-Y797 HydrophobicContact CG2-CD1 4.27Å; I778-Y797 HydrophobicContact CG2-CE1 3.82Å; I778-Y797 HydrophobicContact CG2-CE2 4.1Å
779	E	94.8	Very high	94.2	Very high	54 Å²	54	67 Å²	67	25%	0.252	33%	0.329	S	S	.	.	H	α-helix	trans	-58.5	-45.8	178.1	-61.3	-57.1	139.8	0	0	111.6	K775 L781 I782 E783 R789	K775-E779 WeakPolarHBondContact O-CG 3.46Å; K775-E779 PolarHBondContact O-N 3.5Å; E779-L781 PolarHBondContact O-N 2.86Å; E779-I782 WeakPolarHBondContact O-CB 3.32Å; E779-I782 PolarHBondContact O-N 2.61Å; E779-E783 PolarHBondContact O-N 3.42Å; E779-R789 IonicContact OE1-CZ 3.16Å; E779-R789 IonicContact OE1-NH2 3.92Å; E779-R789 PolarHBondContact OE1-NH2 3.22Å; E779-R789 IonicContact OE2-CZ 2.62Å; E779-R789 IonicContact OE2-NH2 2.88Å; E779-R789 PolarHBondContact OE2-NH2 3.43Å
780	G	94.8	Very high	94.2	Very high	11 Å²	11	67 Å²	67	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-66.3	-21.3	176	0	0	0	0	0	114.5	K776 R777 I778 R784	K776-G780 PolarHBondContact O-N 2.8Å; R777-G780 PolarHBondContact O-N 3.18Å; I778-G780 VanDerWaalsContact C-N 3.35Å; I778-G780 PolarHBondContact O-N 3.14Å; G780-R784 WeakPolarHBondContact O-CG 3.41Å; G780-R784 PolarHBondContact O-N 3.26Å; G780-R784 PolarHBondContact O-NE 3.45Å
781	L	95.7	Very high	93.9	Very high	3 Å²	3	70.4 Å²	70.4	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-81.8	-27.6	171.6	-74.6	169.8	0	0	0	112.3	E737 I740 V741 R777 I778 E779 E785 Y786 L787	E737-L781 HydrophobicContact CB-CD1 4.46Å; E737-L781 HydrophobicContact CB-CD2 4.5Å; E737-L781 HydrophobicContact CG-CD1 4.44Å; E737-L781 HydrophobicContact CG-CG 4.41Å; I740-L781 HydrophobicContact CB-CD1 3.8Å; I740-L781 HydrophobicContact CD1-CD1 4.07Å; I740-L781 HydrophobicContact CG2-CD1 3.52Å; V741-L781 HydrophobicContact CG2-CD1 4.03Å; V741-L781 HydrophobicContact CG2-CD2 3.79Å; R777-L781 WeakPolarHBondContact O-CG 2.96Å; R777-L781 PolarHBondContact O-N 3.02Å; I778-L781 WeakPolarHBondContact O-CB 3.36Å; I778-L781 PolarHBondContact O-N 3.41Å; E779-L781 PolarHBondContact O-N 2.86Å; L781-E785 PolarHBondContact O-N 2.96Å; L781-Y786 HydrophobicContact CD2-CD2 4.08Å; L781-Y786 HydrophobicContact CD2-CG 4.11Å; L781-Y786 PolarHBondContact O-N 3.2Å; L781-L787 HydrophobicContact CB-CD1 3.99Å; L781-L787 HydrophobicContact CB-CG 4.22Å; L781-L787 HydrophobicContact CD1-CD1 4.25Å; L781-L787 PolarHBondContact O-N 2.97Å
782	I	94.9	Very high	93.7	Very high	41 Å²	41	73.7 Å²	73.7	21%	0.21	36%	0.358	C	S	.	.	H	α-helix	trans	-70.2	-45.3	171.7	-65.7	166.6	0	0	0	110.2	I778 E779 R784 E785 L787 R789 Y797	I778-I782 HydrophobicContact CG2-CD1 3.99Å; I778-I782 HydrophobicContact CG2-CG1 4.47Å; I778-I782 WeakPolarHBondContact O-CG1 3.41Å; I778-I782 PolarHBondContact O-N 2.94Å; E779-I782 WeakPolarHBondContact O-CB 3.32Å; E779-I782 PolarHBondContact O-N 2.61Å; I782-R784 PolarHBondContact O-N 2.95Å; I782-E785 PolarHBondContact O-N 3.18Å; I782-L787 WeakPolarHBondContact CA-O 3.34Å; I782-L787 HydrophobicContact CG1-CB 3.92Å; I782-R789 HydrophobicContact CD1-CG 4.26Å; I782-Y797 HydrophobicContact CD1-CD1 4.22Å; I782-Y797 HydrophobicContact CD1-CE1 3.97Å
783	E	94.8	Very high	93.6	Very high	161 Å²	161	71.2 Å²	71.2	75%	0.752	34%	0.341	S	S	*	.	H	α-helix	trans	-59	-30.9	176.1	-71.5	171.8	-176.1	0	0	112.8	E779 E785	E779-E783 PolarHBondContact O-N 3.42Å; E783-E785 VanDerWaalsContact C-N 3.33Å
784	R	95.2	Very high	93.3	Very high	118 Å²	118	77.9 Å²	77.9	45%	0.445	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	12.9	176	-68.8	179.7	-68.8	173.6	-1.6	113.4	E737 G780 I782 Y786	E737-R784 IonicContact OE1-NH2 2.9Å; E737-R784 PolarHBondContact OE1-NH2 3.34Å; E737-R784 IonicContact OE2-CZ 2.89Å; E737-R784 IonicContact OE2-NH1 3.82Å; E737-R784 PolarHBondContact OE2-NH1 3.43Å; E737-R784 IonicContact OE2-NH2 2.72Å; E737-R784 PolarHBondContact OE2-NH2 2.94Å; G780-R784 WeakPolarHBondContact O-CG 3.41Å; G780-R784 PolarHBondContact O-N 3.26Å; G780-R784 PolarHBondContact O-NE 3.45Å; I782-R784 PolarHBondContact O-N 2.95Å; R784-Y786 HydrophobicContact CB-CD2 3.75Å; R784-Y786 HydrophobicContact CB-CE2 4.01Å; R784-Y786 VanDerWaalsContact O-CD2 3.31Å; R784-Y786 WeakPolarHBondContact O-CD2 3.47Å; R784-Y786 PolarHBondContact O-N 2.96Å; R784-Y786 VanDerWaalsContact O-N 3.11Å
785	E	93.1	Very high	93.1	Very high	158 Å²	158	84.4 Å²	84.4	74%	0.738	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	20.1	175.2	-53.9	-175.2	158.5	0	0	115.6	L781 I782 E783	L781-E785 PolarHBondContact O-N 2.96Å; I782-E785 PolarHBondContact O-N 3.18Å; E783-E785 VanDerWaalsContact C-N 3.33Å
786	Y	92.9	Very high	93.1	Very high	99 Å²	99	80 Å²	80	39%	0.388	37%	0.37	S	S	.	.	S	Bend	trans	-76.8	-30.3	171.7	-76.2	-90.2	0	0	0	112.1	V741 L781 R784 Y799 V800 A801	V741-Y786 HydrophobicContact CG2-CD1 4.33Å; L781-Y786 HydrophobicContact CD2-CD2 4.08Å; L781-Y786 HydrophobicContact CD2-CG 4.11Å; L781-Y786 PolarHBondContact O-N 3.2Å; R784-Y786 HydrophobicContact CB-CD2 3.75Å; R784-Y786 HydrophobicContact CB-CE2 4.01Å; R784-Y786 VanDerWaalsContact O-CD2 3.31Å; R784-Y786 WeakPolarHBondContact O-CD2 3.47Å; R784-Y786 PolarHBondContact O-N 2.96Å; R784-Y786 VanDerWaalsContact O-N 3.11Å; Y786-Y799 WeakPolarHBondContact O-CD2 3.46Å; Y786-V800 PolarHBondContact O-N 3.15Å; Y786-A801 HydrophobicContact CD1-CB 3.86Å; Y786-A801 HydrophobicContact CE1-CB 4.34Å; Y786-A801 HydrophobicContact CG-CB 4.49Å
787	L	94.8	Very high	93.1	Very high	3 Å²	3	73.5 Å²	73.5	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.9	-178.1	-58.4	177.5	0	0	0	110.3	I740 M744 I778 L781 I782 T798 Y799	I740-L787 HydrophobicContact CG2-CD1 3.77Å; M744-L787 HydrophobicContact CB-CD2 3.6Å; M744-L787 HydrophobicContact CE-CD2 3.96Å; M744-L787 HydrophobicContact CG-CD1 4.46Å; M744-L787 HydrophobicContact CG-CD2 3.61Å; I778-L787 HydrophobicContact CG2-CD1 4.26Å; L781-L787 HydrophobicContact CB-CD1 3.99Å; L781-L787 HydrophobicContact CB-CG 4.22Å; L781-L787 HydrophobicContact CD1-CD1 4.25Å; L781-L787 PolarHBondContact O-N 2.97Å; I782-L787 WeakPolarHBondContact CA-O 3.34Å; I782-L787 HydrophobicContact CG1-CB 3.92Å; L787-T798 CarbonylContact C-O 3.59Å; L787-T798 WeakPolarHBondContact CA-O 3.43Å; L787-Y799 HydrophobicContact CD2-CD2 3.98Å
788	A	93.4	Very high	93.1	Very high	33 Å²	33	73.1 Å²	73.1	27%	0.273	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	158.2	168.5	0	0	0	0	0	110.6	Y797 T798 V800	A788-Y797 CarbonylContact O-C 3.59Å; A788-Y797 VanDerWaalsContact O-CA 3.26Å; A788-Y797 WeakPolarHBondContact O-CA 3.36Å; A788-T798 PolarHBondContact N-O 3.38Å; A788-T798 PolarHBondContact O-N 3.15Å; A788-T798 PolarHBondContact O-OG1 3.32Å; A788-V800 HydrophobicContact CB-CG2 3.51Å
789	R	94.4	Very high	93	Very high	101 Å²	101	74.8 Å²	74.8	38%	0.381	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	142.1	168.4	-67.2	180	-176.2	148.1	2.1	108.8	E779 I782 V796 Y797	E779-R789 IonicContact OE1-CZ 3.16Å; E779-R789 IonicContact OE1-NH2 3.92Å; E779-R789 PolarHBondContact OE1-NH2 3.22Å; E779-R789 IonicContact OE2-CZ 2.62Å; E779-R789 IonicContact OE2-NH2 2.88Å; E779-R789 PolarHBondContact OE2-NH2 3.43Å; I782-R789 HydrophobicContact CD1-CG 4.26Å; R789-V796 WeakPolarHBondContact CA-O 3.33Å; R789-Y797 HydrophobicContact CG-CD1 3.99Å; R789-Y797 HydrophobicContact CG-CE1 3.92Å
790	T	91.8	Very high	92.8	Very high	10 Å²	10	76.4 Å²	76.4	6%	0.061	37%	0.365	C	S	.	.			trans	-67.5	146.9	172.9	58.3	0	0	0	0	111.1	E792 D793 V796 T798	T790-E792 WeakPolarHBondContact CB-OE2 3.37Å; T790-E792 PolarHBondContact O-N 3.31Å; T790-D793 CarbonylContact O-C 3.19Å; T790-D793 PolarHBondContact OG1-N 2.67Å; T790-D793 PolarHBondContact OG1-O 3.39Å; T790-V796 HydrophobicContact CG2-CB 4.22Å; T790-V796 HydrophobicContact CG2-CG1 3.88Å; T790-V796 PolarHBondContact N-O 3.43Å; T790-T798 HydrophobicContact CG2-CG2 3.58Å
791	P	85.4	Confident	92.1	Very high	124 Å²	124	80.4 Å²	80.4	81%	0.805	40%	0.397	S	S	*	.	S	Bend	trans	-66.8	-26.6	178.2	22.1	-26.9	0	0	0	112.6
792	E	88.4	Confident	92	Very high	154 Å²	154	84.3 Å²	84.3	72%	0.72	42%	0.416	S	S	*	.	S	Bend	trans	-80.8	-38.5	-180	-53.1	78.4	-165.7	0	0	113.2	T790	T790-E792 WeakPolarHBondContact CB-OE2 3.37Å; T790-E792 PolarHBondContact O-N 3.31Å
793	D	91.1	Very high	91.8	Very high	63 Å²	63	86.6 Å²	86.6	34%	0.337	43%	0.427	S	S	.	.			trans	-140.5	119.7	-179.9	-173.3	-1.2	0	0	0	112.2	T790 K795 V796	T790-D793 CarbonylContact O-C 3.19Å; T790-D793 PolarHBondContact OG1-N 2.67Å; T790-D793 PolarHBondContact OG1-O 3.39Å; D793-K795 PolarHBondContact O-N 3.4Å; D793-K795 WeakPolarHBondContact OD1-CB 3.43Å; D793-K795 PolarHBondContact OD1-N 3.34Å; D793-V796 HydrophobicContact CB-CB 4.42Å; D793-V796 HydrophobicContact CB-CG2 4.02Å; D793-V796 PolarHBondContact O-N 2.91Å; D793-V796 VanDerWaalsContact O-N 3.11Å
794	R	87.6	Confident	91.6	Very high	197 Å²	197	82.4 Å²	82.4	74%	0.743	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.7	176.7	-69.7	-174.6	174.1	-171.9	-1	113.7	V796	R794-V796 VanDerWaalsContact C-N 3.3Å
795	K	91.4	Very high	91.4	Very high	137 Å²	137	80.4 Å²	80.4	60%	0.596	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	0.5	175	-60.7	178.5	-179	174.6	0	112.6	Q751 H752 D793	Q751-K795 CarbonylContact C-O 3.29Å; Q751-K795 WeakPolarHBondContact CA-O 3.39Å; H752-K795 PolarHBondContact N-O 3.48Å; D793-K795 PolarHBondContact O-N 3.4Å; D793-K795 WeakPolarHBondContact OD1-CB 3.43Å; D793-K795 PolarHBondContact OD1-N 3.34Å
796	V	94.3	Very high	91.3	Very high	21 Å²	21	75.5 Å²	75.5	13%	0.127	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.1	177.3	-178.4	0	0	0	0	109.6	K749 Q751 R789 T790 D793 R794	K749-V796 HydrophobicContact CD-CG1 4.21Å; K749-V796 VanDerWaalsContact CE-CG1 3.47Å; K749-V796 HydrophobicContact CG-CG1 3.67Å; Q751-V796 HydrophobicContact CG-CG2 4.45Å; R789-V796 WeakPolarHBondContact CA-O 3.33Å; T790-V796 HydrophobicContact CG2-CB 4.22Å; T790-V796 HydrophobicContact CG2-CG1 3.88Å; T790-V796 PolarHBondContact N-O 3.43Å; D793-V796 HydrophobicContact CB-CB 4.42Å; D793-V796 HydrophobicContact CB-CG2 4.02Å; D793-V796 PolarHBondContact O-N 2.91Å; D793-V796 VanDerWaalsContact O-N 3.11Å; R794-V796 VanDerWaalsContact C-N 3.3Å
797	Y	95.6	Very high	91.2	Very high	8 Å²	8	73.9 Å²	73.9	3%	0.031	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	145.9	179.7	-54.4	-66.2	0	0	0	110.6	M744 K749 M750 H752 L755 I778 I782 A788 R789	M744-Y797 WeakPolarHBondContact CE-O 3.39Å; K749-Y797 CarbonylContact C-O 3.57Å; K749-Y797 VanDerWaalsContact CA-O 3.29Å; K749-Y797 WeakPolarHBondContact CA-O 3.42Å; M750-Y797 PolarHBondContact N-O 3.09Å; M750-Y797 PolarHBondContact O-N 2.88Å; H752-Y797 HydrophobicContact CB-CE2 3.68Å; H752-Y797 AromaticContact CG-CE2 3.98Å; H752-Y797 AromaticContact ND1-CE2 3.47Å; H752-Y797 WeakPolarHBondContact ND1-CE2 3.36Å; H752-Y797 AromaticContact ND1-CZ 3.64Å; H752-Y797 PolarHBondContact ND1-OH 2.93Å; L755-Y797 HydrophobicContact CD2-CD2 3.86Å; L755-Y797 HydrophobicContact CD2-CE2 4.35Å; I778-Y797 HydrophobicContact CD1-CE2 4.2Å; I778-Y797 HydrophobicContact CG2-CD1 4.27Å; I778-Y797 HydrophobicContact CG2-CE1 3.82Å; I778-Y797 HydrophobicContact CG2-CE2 4.1Å; I782-Y797 HydrophobicContact CD1-CD1 4.22Å; I782-Y797 HydrophobicContact CD1-CE1 3.97Å; A788-Y797 CarbonylContact O-C 3.59Å; A788-Y797 VanDerWaalsContact O-CA 3.26Å; A788-Y797 WeakPolarHBondContact O-CA 3.36Å; R789-Y797 HydrophobicContact CG-CD1 3.99Å; R789-Y797 HydrophobicContact CG-CE1 3.92Å
798	T	94.3	Very high	91	Very high	40 Å²	40	79 Å²	79	25%	0.245	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.7	171.4	46.4	0	0	0	0	110	K748 K749 L787 A788 T790	K748-T798 CarbonylContact O-C 3.52Å; K748-T798 VanDerWaalsContact O-CA 3.32Å; K748-T798 WeakPolarHBondContact O-CA 3.42Å; K749-T798 HydrophobicContact CB-CG2 4.29Å; K749-T798 HydrophobicContact CD-CG2 4.28Å; K749-T798 HydrophobicContact CG-CG2 4.04Å; L787-T798 CarbonylContact C-O 3.59Å; L787-T798 WeakPolarHBondContact CA-O 3.43Å; A788-T798 PolarHBondContact N-O 3.38Å; A788-T798 PolarHBondContact O-N 3.15Å; A788-T798 PolarHBondContact O-OG1 3.32Å; T790-T798 HydrophobicContact CG2-CG2 3.58Å
799	Y	95	Very high	90.8	Very high	35 Å²	35	82.5 Å²	82.5	14%	0.137	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.7	174.3	-176	-105	0	0	0	110.3	V741 M744 K745 K748 Y786 L787 A801	V741-Y799 HydrophobicContact CG1-CE2 4.21Å; M744-Y799 HydrophobicContact CB-CD2 3.9Å; M744-Y799 HydrophobicContact CB-CG 4.38Å; M744-Y799 WeakPolarHBondContact O-CB 3.48Å; K745-Y799 HydrophobicContact CB-CD1 4.38Å; K745-Y799 HydrophobicContact CB-CD2 4.46Å; K745-Y799 HydrophobicContact CB-CE1 3.95Å; K745-Y799 HydrophobicContact CB-CE2 4.09Å; K745-Y799 HydrophobicContact CG-CE1 3.88Å; K748-Y799 HydrophobicContact CD-CD1 4.4Å; K748-Y799 PolarHBondContact O-N 3.31Å; Y786-Y799 WeakPolarHBondContact O-CD2 3.46Å; L787-Y799 HydrophobicContact CD2-CD2 3.98Å; Y799-A801 WeakPolarHBondContact CE1-O 3.4Å; Y799-A801 HydrophobicContact CE2-CB 4.4Å; Y799-A801 PolarHBondContact OH-O 3Å
800	V	90.8	Very high	90.5	Very high	88 Å²	88	81 Å²	81	53%	0.533	43%	0.427	S	S	.	.			trans	-118.2	-20	-167	-170.6	0	0	0	0	113.4	Y786 A788	Y786-V800 PolarHBondContact O-N 3.15Å; A788-V800 HydrophobicContact CB-CG2 3.51Å
801	A	79.9	Confident	90.4	Very high	95 Å²	95	87.5 Å²	87.5	79%	0.785	46%	0.46	S	S	*	.			trans	-89.8	0	-174.1	0	0	0	0	0	115.9	Y786 Y799	Y786-A801 HydrophobicContact CD1-CB 3.86Å; Y786-A801 HydrophobicContact CE1-CB 4.34Å; Y786-A801 HydrophobicContact CG-CB 4.49Å; Y799-A801 WeakPolarHBondContact CE1-O 3.4Å; Y799-A801 HydrophobicContact CE2-CB 4.4Å; Y799-A801 PolarHBondContact OH-O 3Å

Retrieved 801 of 801 residues in 291.1 ms (Link to these results)

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