A0A077Z197_TRITR Loading...

GATOR complex protein NPRL3

As a component of the GATOR1 complex functions as an inhibitor of the amino acid-sensing branch of the TORC1 pathway.

AlphaFold DB , UniProt , Accession A0A077Z197, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 440 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	57.9	Low	78.7	Confident	220 Å²	220	104.8 Å²	104.8	100%	1.084	54%	0.54	S	S	*	.				0	-17.4	0	-67.6	-161.2	-167.5	0	0	112.9
2	C	63	Low	79.3	Confident	43 Å²	43	106.8 Å²	106.8	29%	0.291	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.8	154.1	171	-57.4	0	0	0	0	111.7	K4 P19 S21	C2-K4 VanDerWaalsContact C-N 3.28Å; C2-K4 PolarHBondContact O-N 2.75Å; C2-P19 WeakPolarHBondContact CA-O 3.46Å; C2-S21 WeakPolarHBondContact CB-OG 3.4Å
3	N	72.6	Confident	80	Confident	84 Å²	84	102.6 Å²	102.6	45%	0.449	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	24.7	-177.9	-54.5	-24	0	0	0	115	Y18 P19	N3-Y18 PolarHBondContact O-OH 2.9Å; N3-P19 PolarHBondContact N-O 3.18Å
4	K	81.1	Confident	80.4	Confident	157 Å²	157	99.9 Å²	99.9	68%	0.683	51%	0.513	S	S	*	.	S	Bend	trans	-128	139.4	168.6	-68.2	-170.6	177.8	-173.6	0	109.2	C2 M6 P19	C2-K4 VanDerWaalsContact C-N 3.28Å; C2-K4 PolarHBondContact O-N 2.75Å; K4-M6 PolarHBondContact O-N 2.87Å; K4-P19 WeakPolarHBondContact O-CD 3.45Å
5	A	80.4	Confident	80.9	Confident	46 Å²	46	98.2 Å²	98.2	38%	0.38	50%	0.501	S	S	.	.			trans	-60.3	128.9	174.4	0	0	0	0	0	110.2	G17 V61	A5-G17 CarbonylContact C-O 3.6Å; A5-G17 WeakPolarHBondContact CA-O 3.48Å; A5-V61 HydrophobicContact CB-CG1 3.51Å; A5-V61 HydrophobicContact CB-CG2 4.45Å
6	M	82.6	Confident	81.4	Confident	98 Å²	98	92.1 Å²	92.1	48%	0.483	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	113.1	177.7	179.7	172.9	168.2	0	0	108.2	K4 V8 G17	K4-M6 PolarHBondContact O-N 2.87Å; M6-V8 HydrophobicContact CE-CG2 3.38Å; M6-V8 HydrophobicContact CG-CG2 3.92Å; M6-G17 PolarHBondContact N-O 3.28Å; M6-G17 PolarHBondContact O-N 3.04Å
7	L	84.6	Confident	81.7	Confident	92 Å²	92	86.8 Å²	86.8	48%	0.482	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.7	176.9	-66.9	168.1	0	0	0	108.3	F15 I16 I57 V61	L7-F15 WeakPolarHBondContact CA-O 3.39Å; L7-I16 HydrophobicContact CD2-CB 4.16Å; L7-I16 HydrophobicContact CD2-CD1 4.33Å; L7-I16 HydrophobicContact CD2-CG1 3.68Å; L7-I16 HydrophobicContact CD2-CG2 3.97Å; L7-I57 HydrophobicContact CD2-CG2 4.09Å; L7-V61 HydrophobicContact CD2-CG2 3.81Å; L7-V61 HydrophobicContact CG-CG2 4.48Å
8	V	85.6	Confident	82.1	Confident	50 Å²	50	83.2 Å²	83.2	30%	0.303	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.6	177.5	-176.1	0	0	0	0	109	M6 I10 R14 F15	M6-V8 HydrophobicContact CE-CG2 3.38Å; M6-V8 HydrophobicContact CG-CG2 3.92Å; V8-I10 HydrophobicContact CG1-CD1 4.18Å; V8-I10 HydrophobicContact CG1-CG1 3.87Å; V8-R14 CarbonylContact O-C 3.57Å; V8-R14 WeakPolarHBondContact O-CA 3.47Å; V8-F15 HydrophobicContact CB-CB 4.44Å; V8-F15 PolarHBondContact N-O 3.29Å; V8-F15 PolarHBondContact O-N 2.81Å
9	K	86.7	Confident	82.4	Confident	137 Å²	137	80.1 Å²	80.1	60%	0.596	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	122.7	173	-178.9	179	169.8	176	0	108.9	N11 A50	K9-N11 WeakPolarHBondContact CE-O 3.42Å; K9-A50 HydrophobicContact CD-CB 4.3Å; K9-A50 HydrophobicContact CG-CB 4.42Å
10	I	86.2	Confident	82.5	Confident	91 Å²	91	76.1 Å²	76.1	47%	0.467	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	113.9	172.5	-51.5	-179.9	0	0	0	106.8	V8 D12 V13 F15	V8-I10 HydrophobicContact CG1-CD1 4.18Å; V8-I10 HydrophobicContact CG1-CG1 3.87Å; I10-D12 PolarHBondContact O-N 3.44Å; I10-V13 PolarHBondContact N-O 3.26Å; I10-V13 PolarHBondContact O-N 2.98Å; I10-F15 HydrophobicContact CB-CE2 4.16Å; I10-F15 HydrophobicContact CD1-CD2 4.23Å; I10-F15 HydrophobicContact CD1-CE2 3.99Å; I10-F15 HydrophobicContact CG1-CD2 4.28Å; I10-F15 HydrophobicContact CG1-CE2 4.18Å
11	N	84.8	Confident	82.3	Confident	135 Å²	135	73.9 Å²	73.9	72%	0.722	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	-124.5	-175.5	-54.7	-22.5	0	0	0	111.4	K9 V13	K9-N11 WeakPolarHBondContact CE-O 3.42Å; N11-V13 VanDerWaalsContact C-N 3.28Å; N11-V13 PolarHBondContact O-N 3.21Å
12	D	86.1	Confident	82.9	Confident	128 Å²	128	64.3 Å²	64.3	68%	0.684	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	7.2	-177.5	-55.9	-37.6	0	0	0	113.5	I10 R49 A50	I10-D12 PolarHBondContact O-N 3.44Å; D12-R49 CarbonylContact O-C 3.57Å; D12-R49 WeakPolarHBondContact O-CA 3.32Å; D12-A50 WeakPolarHBondContact O-CB 3.44Å; D12-A50 PolarHBondContact O-N 3.33Å
13	V	87.7	Confident	82.9	Confident	53 Å²	53	67.4 Å²	67.4	32%	0.321	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.6	-177.7	-174	0	0	0	0	110.8	I10 N11 F15 A47 I48	I10-V13 PolarHBondContact N-O 3.26Å; I10-V13 PolarHBondContact O-N 2.98Å; N11-V13 VanDerWaalsContact C-N 3.28Å; N11-V13 PolarHBondContact O-N 3.21Å; V13-F15 HydrophobicContact CB-CE2 4.24Å; V13-F15 HydrophobicContact CB-CZ 4.43Å; V13-F15 HydrophobicContact CG1-CD2 4.36Å; V13-F15 HydrophobicContact CG1-CE1 4.18Å; V13-F15 HydrophobicContact CG1-CE2 3.9Å; V13-F15 HydrophobicContact CG1-CZ 3.81Å; V13-A47 HydrophobicContact CG1-CB 3.95Å; V13-I48 CarbonylContact C-O 3.51Å; V13-I48 WeakPolarHBondContact CA-O 2.93Å
14	R	86.3	Confident	82.2	Confident	64 Å²	64	67.2 Å²	67.2	24%	0.242	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.8	170.9	-166.3	-179.7	-58.5	-159.6	7.2	108.9	V8 I48 A50	V8-R14 CarbonylContact O-C 3.57Å; V8-R14 WeakPolarHBondContact O-CA 3.47Å; R14-I48 HydrophobicContact CB-CG1 4.07Å; R14-I48 PolarHBondContact N-O 3.25Å; R14-I48 PolarHBondContact O-N 2.77Å; R14-A50 PolarHBondContact NH2-O 2.87Å
15	F	88.2	Confident	81	Confident	75 Å²	75	64.9 Å²	64.9	33%	0.329	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.3	173.6	-61.9	-84.1	0	0	0	109.3	L7 V8 I10 V13 V45 F46 A47	L7-F15 WeakPolarHBondContact CA-O 3.39Å; V8-F15 HydrophobicContact CB-CB 4.44Å; V8-F15 PolarHBondContact N-O 3.29Å; V8-F15 PolarHBondContact O-N 2.81Å; I10-F15 HydrophobicContact CB-CE2 4.16Å; I10-F15 HydrophobicContact CD1-CD2 4.23Å; I10-F15 HydrophobicContact CD1-CE2 3.99Å; I10-F15 HydrophobicContact CG1-CD2 4.28Å; I10-F15 HydrophobicContact CG1-CE2 4.18Å; V13-F15 HydrophobicContact CB-CE2 4.24Å; V13-F15 HydrophobicContact CB-CZ 4.43Å; V13-F15 HydrophobicContact CG1-CD2 4.36Å; V13-F15 HydrophobicContact CG1-CE1 4.18Å; V13-F15 HydrophobicContact CG1-CE2 3.9Å; V13-F15 HydrophobicContact CG1-CZ 3.81Å; F15-V45 HydrophobicContact CB-CG1 4.08Å; F15-V45 HydrophobicContact CD1-CG1 4.09Å; F15-F46 CarbonylContact C-O 3.47Å; F15-F46 WeakPolarHBondContact CA-O 3.46Å; F15-A47 HydrophobicContact CD1-CB 3.91Å; F15-A47 HydrophobicContact CE1-CB 3.84Å
16	I	87.9	Confident	79.7	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	104	-179.9	-55.2	-178.8	0	0	0	106.9	L7 V45 F46 I48 I57 F60 V61	L7-I16 HydrophobicContact CD2-CB 4.16Å; L7-I16 HydrophobicContact CD2-CD1 4.33Å; L7-I16 HydrophobicContact CD2-CG1 3.68Å; L7-I16 HydrophobicContact CD2-CG2 3.97Å; I16-V45 CarbonylContact O-C 3.6Å; I16-V45 VanDerWaalsContact O-CA 3.31Å; I16-V45 WeakPolarHBondContact O-CA 3.44Å; I16-F46 PolarHBondContact N-O 3.35Å; I16-F46 PolarHBondContact O-N 2.62Å; I16-I48 HydrophobicContact CD1-CD1 3.48Å; I16-I48 VanDerWaalsContact CD1-CD1 3.48Å; I16-I48 HydrophobicContact CD1-CG1 3.93Å; I16-I48 HydrophobicContact CG1-CD1 4.44Å; I16-I48 HydrophobicContact CG1-CG1 4.45Å; I16-I57 HydrophobicContact CD1-CB 4.49Å; I16-I57 HydrophobicContact CD1-CG2 4.01Å; I16-F60 HydrophobicContact CD1-CB 3.59Å; I16-F60 HydrophobicContact CD1-CG 4.42Å; I16-F60 HydrophobicContact CG2-CB 4.46Å; I16-V61 HydrophobicContact CG2-CB 4.22Å; I16-V61 HydrophobicContact CG2-CG2 3.48Å; I16-V61 VanDerWaalsContact CG2-CG2 3.48Å
17	G	87.1	Confident	77.8	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.021	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	150.8	-178.4	0	0	0	0	0	113	A5 M6 V44	A5-G17 CarbonylContact C-O 3.6Å; A5-G17 WeakPolarHBondContact CA-O 3.48Å; M6-G17 PolarHBondContact N-O 3.28Å; M6-G17 PolarHBondContact O-N 3.04Å; G17-V44 CarbonylContact C-O 3.6Å; G17-V44 VanDerWaalsContact CA-O 3.23Å; G17-V44 WeakPolarHBondContact CA-O 3.5Å
18	Y	89.1	Confident	75.6	Confident	22 Å²	22	65 Å²	65	9%	0.086	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	94.5	163.6	-164	-90.6	0	0	0	110	N3 V20 N43 V44 K65 A68	N3-Y18 PolarHBondContact O-OH 2.9Å; Y18-V20 HydrophobicContact CD1-CG2 3.63Å; Y18-V20 HydrophobicContact CE1-CG2 3.71Å; Y18-N43 PolarHBondContact N-OD1 2.92Å; Y18-N43 PolarHBondContact O-OD1 2.93Å; Y18-V44 PolarHBondContact N-O 2.89Å; Y18-K65 HydrophobicContact CD2-CB 3.82Å; Y18-K65 HydrophobicContact CD2-CG 4.14Å; Y18-K65 HydrophobicContact CE1-CG 4.28Å; Y18-K65 HydrophobicContact CE2-CB 3.94Å; Y18-K65 HydrophobicContact CE2-CD 4.21Å; Y18-K65 HydrophobicContact CE2-CG 3.73Å; Y18-K65 HydrophobicContact CG-CB 4.17Å; Y18-A68 HydrophobicContact CD1-CB 3.5Å; Y18-A68 HydrophobicContact CE1-CB 4.26Å; Y18-A68 HydrophobicContact CG-CB 4.28Å
19	P	86.9	Confident	73.6	Confident	24 Å²	24	68.3 Å²	68.3	16%	0.156	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.8	179.9	29.1	-33.4	0	0	0	111.1	C2 N3 K4 N43	C2-P19 WeakPolarHBondContact CA-O 3.46Å; N3-P19 PolarHBondContact N-O 3.18Å; K4-P19 WeakPolarHBondContact O-CD 3.45Å; P19-N43 HydrophobicContact CB-CB 4.36Å
20	V	84.5	Confident	71.3	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.006	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134	176.4	178.8	0	0	0	0	109.2	Y18 R41 Y42 A68 Q72	Y18-V20 HydrophobicContact CD1-CG2 3.63Å; Y18-V20 HydrophobicContact CE1-CG2 3.71Å; V20-R41 WeakPolarHBondContact O-CA 3.34Å; V20-Y42 HydrophobicContact CB-CD1 4.44Å; V20-Y42 HydrophobicContact CB-CE1 3.8Å; V20-Y42 HydrophobicContact CB-CE2 4.16Å; V20-Y42 HydrophobicContact CG1-CE1 3.87Å; V20-Y42 HydrophobicContact CG2-CE2 4.38Å; V20-Y42 PolarHBondContact N-O 2.89Å; V20-Y42 PolarHBondContact O-N 3.09Å; V20-Y42 VanDerWaalsContact O-N 3.15Å; V20-A68 HydrophobicContact CG2-CB 3.64Å; V20-Q72 HydrophobicContact CG1-CG 4.34Å
21	S	79.4	Confident	69.1	Low	30 Å²	30	70.4 Å²	70.4	21%	0.21	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.9	168	47.3	0	0	0	0	109.2	C2	C2-S21 WeakPolarHBondContact CB-OG 3.4Å
22	H	69.4	Low	67.1	Low	18 Å²	18	67.3 Å²	67.3	8%	0.083	42%	0.416	C	S	.	.			trans	-91.2	123.7	168.1	-160.9	-67.1	0	0	0	107.5	P24 S26 C27 I39 L40 N76	H22-P24 WeakPolarHBondContact O-CD 3.47Å; H22-S26 PolarHBondContact CE1-OG 3.05Å; H22-C27 PolarHBondContact CE1-SG 2.94Å; H22-I39 WeakPolarHBondContact CB-O 3.45Å; H22-L40 PolarHBondContact N-O 3.41Å; H22-N76 PolarHBondContact NE2-OD1 3.33Å
23	D	64.2	Low	64.8	Low	109 Å²	109	69.2 Å²	69.2	58%	0.583	43%	0.425	S	S	*	.			trans	-83.3	114.5	172.2	-76.2	-25.9	0	0	0	107.5	S25 S26	D23-S25 PolarHBondContact O-N 2.91Å; D23-S26 PolarHBondContact O-N 3.15Å; D23-S26 VanDerWaalsContact O-N 3.1Å; D23-S26 PolarHBondContact O-OG 2.94Å
24	P	57.5	Low	62.9	Low	80 Å²	80	73.4 Å²	73.4	52%	0.519	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-62.1	-10.6	-173	23.3	-33	0	0	0	113.7	H22 S26 L40	H22-P24 WeakPolarHBondContact O-CD 3.47Å; P24-S26 VanDerWaalsContact C-N 3.33Å; P24-L40 HydrophobicContact CG-CD2 4.49Å
25	S	55.5	Low	61.2	Low	107 Å²	107	77.4 Å²	77.4	75%	0.748	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-75	-13	176.4	52.3	0	0	0	0	114.8	D23	D23-S25 PolarHBondContact O-N 2.91Å
26	S	52.8	Low	59.7	Low	62 Å²	62	78.8 Å²	78.8	43%	0.434	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-91.4	-6.6	179.9	65.8	0	0	0	0	114.5	H22 D23 P24 S28	H22-S26 PolarHBondContact CE1-OG 3.05Å; D23-S26 PolarHBondContact O-N 3.15Å; D23-S26 VanDerWaalsContact O-N 3.1Å; D23-S26 PolarHBondContact O-OG 2.94Å; P24-S26 VanDerWaalsContact C-N 3.33Å; S26-S28 PolarHBondContact O-N 2.96Å
27	C	44.1	Very low	58.4	Low	68 Å²	68	81.3 Å²	81.3	46%	0.459	50%	0.504	S	S	.	.			trans	-90.6	68.9	175.8	-74.3	0	0	0	0	111.2	H22 T29	H22-C27 PolarHBondContact CE1-SG 2.94Å; C27-T29 VanDerWaalsContact C-N 3.3Å; C27-T29 PolarHBondContact O-N 2.88Å
28	S	38.1	Very low	57.5	Low	108 Å²	108	86.8 Å²	86.8	76%	0.755	53%	0.533	S	S	*	.			trans	-88.9	64.6	169.6	56.7	0	0	0	0	111.1	S26	S26-S28 PolarHBondContact O-N 2.96Å
29	T	42.5	Very low	56.6	Low	120 Å²	120	87.1 Å²	87.1	74%	0.736	54%	0.536	S	S	*	.			trans	-141.9	68	160.5	38.2	0	0	0	0	109	C27 N31	C27-T29 VanDerWaalsContact C-N 3.3Å; C27-T29 PolarHBondContact O-N 2.88Å; T29-N31 PolarHBondContact O-N 3.21Å
30	S	39.9	Very low	56.1	Low	115 Å²	115	90.6 Å²	90.6	80%	0.804	55%	0.553	S	S	*	*			trans	-67.3	86.1	159.7	56.4	0	0	0	0	108.8
31	N	39.9	Very low	56	Low	158 Å²	158	99.6 Å²	99.6	85%	0.845	59%	0.586	S	S	*	*			trans	-134.1	106.9	163.7	-92.5	-14.7	0	0	0	109.1	T29	T29-N31 PolarHBondContact O-N 3.21Å
32	G	41.2	Very low	56.4	Low	69 Å²	69	99.5 Å²	99.5	71%	0.711	58%	0.582	S	S	*	*	S	Bend	trans	96.5	104.6	153.2	0	0	0	0	0	116.2	N34	G32-N34 PolarHBondContact O-N 2.78Å
33	L	38.4	Very low	57.3	Low	168 Å²	168	102 Å²	102	88%	0.88	60%	0.596	S	S	*	*	S	Bend	trans	3.8	98.1	151.4	-69.4	95.7	0	0	0	115.7
34	N	47.5	Very low	58.5	Low	141 Å²	141	97.3 Å²	97.3	75%	0.754	57%	0.571	S	S	*	*	S	Bend	trans	174.5	121.3	146.7	-86	-27.6	0	0	0	106.9	G32 P36	G32-N34 PolarHBondContact O-N 2.78Å; N34-P36 VanDerWaalsContact O-N 3.14Å
35	D	51	Low	60.1	Low	149 Å²	149	96.8 Å²	96.8	80%	0.797	57%	0.566	S	S	*	*			trans	-36.7	116.8	-172.2	-83.1	-35.6	0	0	0	112.8	V37 K86	D35-V37 PolarHBondContact O-N 3.31Å; D35-K86 PolarHBondContact O-NZ 2.8Å
36	P	56.2	Low	61.7	Low	104 Å²	104	92.4 Å²	92.4	68%	0.675	53%	0.533	S	S	*	.			trans	-72	115.4	174.6	28.3	-29.9	0	0	0	106.9	N34 N38	N34-P36 VanDerWaalsContact O-N 3.14Å; P36-N38 VanDerWaalsContact C-N 3.33Å; P36-N38 PolarHBondContact O-N 3.06Å
37	V	61.3	Low	63.4	Low	53 Å²	53	91.8 Å²	91.8	32%	0.321	53%	0.532	S	S	.	.			trans	-60.4	104.8	165.1	176	0	0	0	0	105.3	D35 I39 T82 V85 K86	D35-V37 PolarHBondContact O-N 3.31Å; V37-I39 HydrophobicContact CG1-CG1 3.93Å; V37-I39 PolarHBondContact O-N 2.79Å; V37-T82 HydrophobicContact CB-CG2 4.31Å; V37-V85 HydrophobicContact CG1-CG1 4.44Å; V37-K86 HydrophobicContact CG2-CG 4.07Å
38	N	68	Low	65.5	Low	116 Å²	116	89.3 Å²	89.3	62%	0.62	51%	0.514	S	S	*	.			trans	-79.4	87.4	-173.2	-163.4	0.1	0	0	0	109.1	P36 L40	P36-N38 VanDerWaalsContact C-N 3.33Å; P36-N38 PolarHBondContact O-N 3.06Å; N38-L40 PolarHBondContact O-N 2.81Å
39	I	71.4	Confident	67.7	Low	30 Å²	30	92.7 Å²	92.7	15%	0.154	51%	0.51	C	S	.	.			trans	-78.3	90.1	179.8	-54.9	176.3	0	0	0	108.7	H22 V37 R41 Y42 L81 V85	H22-I39 WeakPolarHBondContact CB-O 3.45Å; V37-I39 HydrophobicContact CG1-CG1 3.93Å; V37-I39 PolarHBondContact O-N 2.79Å; I39-R41 VanDerWaalsContact C-N 3.34Å; I39-Y42 HydrophobicContact CG2-CD1 4.43Å; I39-L81 HydrophobicContact CD1-CB 4.39Å; I39-L81 HydrophobicContact CD1-CD2 3.83Å; I39-L81 HydrophobicContact CD1-CG 3.67Å; I39-L81 HydrophobicContact CG2-CD2 3.99Å; I39-V85 HydrophobicContact CD1-CB 4.26Å; I39-V85 HydrophobicContact CD1-CG2 3.87Å
40	L	75.2	Confident	69.5	Low	97 Å²	97	87.4 Å²	87.4	51%	0.508	48%	0.479	S	S	.	.			trans	-68	-35.2	177.4	-65.2	171.9	0	0	0	112.4	H22 P24 N38	H22-L40 PolarHBondContact N-O 3.41Å; P24-L40 HydrophobicContact CG-CD2 4.49Å; N38-L40 PolarHBondContact O-N 2.81Å
41	R	82.9	Confident	71.4	Confident	189 Å²	189	89.1 Å²	89.1	71%	0.713	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	140.7	-175.5	-62.2	-177.2	-179.3	145.2	2.7	109.7	V20 I39	V20-R41 WeakPolarHBondContact O-CA 3.34Å; I39-R41 VanDerWaalsContact C-N 3.34Å
42	Y	86.6	Confident	73.2	Confident	29 Å²	29	82.7 Å²	82.7	11%	0.114	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	161.9	168.4	68.8	-85.7	0	0	0	109.5	V20 I39 V44 A68 I71 Q72 L81	V20-Y42 HydrophobicContact CB-CD1 4.44Å; V20-Y42 HydrophobicContact CB-CE1 3.8Å; V20-Y42 HydrophobicContact CB-CE2 4.16Å; V20-Y42 HydrophobicContact CG1-CE1 3.87Å; V20-Y42 HydrophobicContact CG2-CE2 4.38Å; V20-Y42 PolarHBondContact N-O 2.89Å; V20-Y42 PolarHBondContact O-N 3.09Å; V20-Y42 VanDerWaalsContact O-N 3.15Å; I39-Y42 HydrophobicContact CG2-CD1 4.43Å; Y42-V44 HydrophobicContact CD2-CG2 4.37Å; Y42-V44 HydrophobicContact CE2-CG2 4.27Å; Y42-A68 HydrophobicContact CE2-CB 4.32Å; Y42-A68 PolarHBondContact OH-O 3.18Å; Y42-I71 HydrophobicContact CE2-CB 4.22Å; Y42-I71 HydrophobicContact CE2-CG2 3.9Å; Y42-Q72 WeakPolarHBondContact OH-CB 3.26Å; Y42-Q72 PolarHBondContact OH-N 2.84Å; Y42-L81 HydrophobicContact CD1-CD2 3.63Å; Y42-L81 HydrophobicContact CD2-CD2 4.36Å; Y42-L81 HydrophobicContact CE1-CD2 4.11Å; Y42-L81 HydrophobicContact CG-CD2 3.78Å
43	N	89.2	Confident	75.1	Confident	70 Å²	70	82 Å²	82	37%	0.374	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	124.4	-179.7	-172.9	14.3	0	0	0	109.1	Y18 P19 V45	Y18-N43 PolarHBondContact N-OD1 2.92Å; Y18-N43 PolarHBondContact O-OD1 2.93Å; P19-N43 HydrophobicContact CB-CB 4.36Å; N43-V45 HydrophobicContact CB-CG2 4.31Å; N43-V45 VanDerWaalsContact CG-CG2 3.5Å; N43-V45 VanDerWaalsContact ND2-CG2 3.26Å; N43-V45 WeakPolarHBondContact ND2-CG2 3.23Å
44	V	89.1	Confident	77.1	Confident	11 Å²	11	83.6 Å²	83.6	7%	0.067	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.4	171.3	-179.6	0	0	0	0	107.2	G17 Y18 Y42 F46 F67 A68 I71 L121	G17-V44 CarbonylContact C-O 3.6Å; G17-V44 VanDerWaalsContact CA-O 3.23Å; G17-V44 WeakPolarHBondContact CA-O 3.5Å; Y18-V44 PolarHBondContact N-O 2.89Å; Y42-V44 HydrophobicContact CD2-CG2 4.37Å; Y42-V44 HydrophobicContact CE2-CG2 4.27Å; V44-F46 HydrophobicContact CG1-CE2 4.4Å; V44-F46 HydrophobicContact CG1-CZ 4.43Å; V44-F67 HydrophobicContact CG1-CB 4.32Å; V44-A68 HydrophobicContact CG2-CB 4.2Å; V44-I71 HydrophobicContact CG2-CD1 3.84Å; V44-L121 HydrophobicContact CG1-CD2 4.05Å
45	V	90.4	Very high	78.5	Confident	69 Å²	69	81.4 Å²	81.4	42%	0.418	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127	-176	-174.3	0	0	0	0	111.2	F15 I16 N43	F15-V45 HydrophobicContact CB-CG1 4.08Å; F15-V45 HydrophobicContact CD1-CG1 4.09Å; I16-V45 CarbonylContact O-C 3.6Å; I16-V45 VanDerWaalsContact O-CA 3.31Å; I16-V45 WeakPolarHBondContact O-CA 3.44Å; N43-V45 HydrophobicContact CB-CG2 4.31Å; N43-V45 VanDerWaalsContact CG-CG2 3.5Å; N43-V45 VanDerWaalsContact ND2-CG2 3.26Å; N43-V45 WeakPolarHBondContact ND2-CG2 3.23Å
46	F	89.9	Confident	79.9	Confident	14 Å²	14	75.4 Å²	75.4	6%	0.061	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.4	166.4	-63.9	-64.3	0	0	0	110.5	F15 I16 V44 F60 L63 A64 F67 F125	F15-F46 CarbonylContact C-O 3.47Å; F15-F46 WeakPolarHBondContact CA-O 3.46Å; I16-F46 PolarHBondContact N-O 3.35Å; I16-F46 PolarHBondContact O-N 2.62Å; V44-F46 HydrophobicContact CG1-CE2 4.4Å; V44-F46 HydrophobicContact CG1-CZ 4.43Å; F46-F60 HydrophobicContact CB-CD1 4.11Å; F46-F60 HydrophobicContact CD2-CD1 4.02Å; F46-F60 AromaticContact CG-CD1 3.99Å; F46-F60 HydrophobicContact CG-CD1 3.99Å; F46-L63 HydrophobicContact CE2-CD2 4.31Å; F46-L63 HydrophobicContact CE2-CG 4.25Å; F46-L63 HydrophobicContact CZ-CD2 4.25Å; F46-L63 HydrophobicContact CZ-CG 4.42Å; F46-A64 HydrophobicContact CD2-CB 3.87Å; F46-A64 HydrophobicContact CE2-CB 3.83Å; F46-F67 HydrophobicContact CE2-CD2 4.44Å; F46-F67 AromaticContact CZ-CD2 3.99Å; F46-F67 HydrophobicContact CZ-CD2 3.99Å; F46-F67 HydrophobicContact CZ-CE2 4.24Å; F46-F125 AromaticContact CD1-CD2 3.92Å; F46-F125 HydrophobicContact CD1-CD2 3.92Å; F46-F125 HydrophobicContact CE1-CB 4.3Å; F46-F125 HydrophobicContact CE1-CD2 4.49Å
47	A	89.5	Confident	81.2	Confident	50 Å²	50	71 Å²	71	41%	0.413	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.3	174.6	0	0	0	0	0	109.3	V13 F15	V13-A47 HydrophobicContact CG1-CB 3.95Å; F15-A47 HydrophobicContact CD1-CB 3.91Å; F15-A47 HydrophobicContact CE1-CB 3.84Å
48	I	86.9	Confident	82.4	Confident	15 Å²	15	74 Å²	74	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	162.1	179.8	64.2	166.7	0	0	0	110.9	V13 R14 I16 A52 I57 F60 F125	V13-I48 CarbonylContact C-O 3.51Å; V13-I48 WeakPolarHBondContact CA-O 2.93Å; R14-I48 HydrophobicContact CB-CG1 4.07Å; R14-I48 PolarHBondContact N-O 3.25Å; R14-I48 PolarHBondContact O-N 2.77Å; I16-I48 HydrophobicContact CD1-CD1 3.48Å; I16-I48 VanDerWaalsContact CD1-CD1 3.48Å; I16-I48 HydrophobicContact CD1-CG1 3.93Å; I16-I48 HydrophobicContact CG1-CD1 4.44Å; I16-I48 HydrophobicContact CG1-CG1 4.45Å; I48-A52 HydrophobicContact CD1-CB 3.92Å; I48-I57 HydrophobicContact CD1-CG1 3.78Å; I48-F60 HydrophobicContact CD1-CD2 4.36Å; I48-F60 HydrophobicContact CG2-CD1 4.5Å; I48-F60 HydrophobicContact CG2-CD2 3.87Å; I48-F60 HydrophobicContact CG2-CE1 4.36Å; I48-F60 HydrophobicContact CG2-CE2 3.71Å; I48-F60 HydrophobicContact CG2-CG 4.26Å; I48-F60 HydrophobicContact CG2-CZ 3.96Å; I48-F125 HydrophobicContact CG2-CE2 4.33Å
49	R	85	Confident	83.1	Confident	179 Å²	179	68.8 Å²	68.8	68%	0.675	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	142	173.2	-72.1	-179.9	60.7	173.9	-4.7	110.9	D12 E51 A52	D12-R49 CarbonylContact O-C 3.57Å; D12-R49 WeakPolarHBondContact O-CA 3.32Å; R49-E51 IonicContact CZ-OE2 3.82Å; R49-E51 IonicContact NH2-OE2 3.45Å; R49-E51 PolarHBondContact NH2-OE2 3.02Å; R49-E51 PolarHBondContact O-N 3.49Å; R49-A52 PolarHBondContact O-N 3.02Å
50	A	79.1	Confident	83.9	Confident	10 Å²	10	67.4 Å²	67.4	8%	0.083	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.6	-175.3	0	0	0	0	0	114.4	K9 D12 R14 A52	K9-A50 HydrophobicContact CD-CB 4.3Å; K9-A50 HydrophobicContact CG-CB 4.42Å; D12-A50 WeakPolarHBondContact O-CB 3.44Å; D12-A50 PolarHBondContact O-N 3.33Å; R14-A50 PolarHBondContact NH2-O 2.87Å; A50-A52 VanDerWaalsContact C-N 3.33Å
51	E	80.9	Confident	84.5	Confident	151 Å²	151	64.3 Å²	64.3	71%	0.706	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	5.7	-176.6	-60.4	168.7	154.9	0	0	113.9	R49	R49-E51 IonicContact CZ-OE2 3.82Å; R49-E51 IonicContact NH2-OE2 3.45Å; R49-E51 PolarHBondContact NH2-OE2 3.02Å; R49-E51 PolarHBondContact O-N 3.49Å
52	A	77.5	Confident	84.8	Confident	23 Å²	23	57 Å²	57	19%	0.19	28%	0.28	C	S	.	.			trans	-64.7	143.7	-179.5	0	0	0	0	0	112.4	I48 R49 A50 I57	I48-A52 HydrophobicContact CD1-CB 3.92Å; R49-A52 PolarHBondContact O-N 3.02Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A52-I57 HydrophobicContact CB-CG1 4.33Å; A52-I57 WeakPolarHBondContact O-CD1 3.48Å
53	P	80.1	Confident	84.9	Confident	54 Å²	54	55.6 Å²	55.6	35%	0.351	27%	0.274	S	S	.	.			trans	-65.3	151.7	177.9	27.3	-35.7	0	0	0	112.1	K55 I56 I57	P53-K55 VanDerWaalsContact C-N 3.34Å; P53-K55 PolarHBondContact O-N 3.2Å; P53-I56 HydrophobicContact CG-CB 4.15Å; P53-I56 HydrophobicContact CG-CD1 3.46Å; P53-I56 VanDerWaalsContact CG-CD1 3.46Å; P53-I56 HydrophobicContact CG-CG1 3.76Å; P53-I56 PolarHBondContact O-N 3.48Å; P53-I57 PolarHBondContact O-N 3.26Å
54	R	81	Confident	84.9	Confident	202 Å²	202	52.3 Å²	52.3	76%	0.762	26%	0.257	S	S	*	.	H	α-helix	trans	-53.8	-44.2	-173	-70	-176.5	179.4	163.8	2.1	113.6	I56 I57 E58	R54-I56 VanDerWaalsContact C-N 3.29Å; R54-I56 PolarHBondContact O-N 3.14Å; R54-I57 WeakPolarHBondContact O-CB 3.31Å; R54-I57 PolarHBondContact O-N 3.07Å; R54-I57 VanDerWaalsContact O-N 3.1Å; R54-E58 WeakPolarHBondContact O-CG 3.48Å; R54-E58 PolarHBondContact O-N 3.32Å
55	K	78	Confident	85	Confident	94 Å²	94	55.8 Å²	55.8	41%	0.409	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-31.9	-179.7	-67.2	-178.5	-174.8	174.4	0	113.6	P53 S59 Y152	P53-K55 VanDerWaalsContact C-N 3.34Å; P53-K55 PolarHBondContact O-N 3.2Å; K55-S59 WeakPolarHBondContact O-CB 3.48Å; K55-S59 PolarHBondContact O-N 2.63Å; K55-S59 PolarHBondContact O-OG 3.37Å; K55-Y152 HydrophobicContact CB-CE2 4.44Å; K55-Y152 HydrophobicContact CD-CD2 4.43Å; K55-Y152 HydrophobicContact CD-CE2 3.39Å; K55-Y152 VanDerWaalsContact CD-OH 3.3Å; K55-Y152 WeakPolarHBondContact CD-OH 3.34Å; K55-Y152 WeakPolarHBondContact CE-OH 3.15Å; K55-Y152 PolarHBondContact NZ-OH 3.3Å
56	I	80.4	Confident	84.9	Confident	23 Å²	23	55.7 Å²	55.7	12%	0.118	27%	0.266	C	S	.	.	H	α-helix	trans	-70.6	-42.6	174.4	-68	-178.9	0	0	0	109.7	P53 R54 E58 S59 F60 L156	P53-I56 HydrophobicContact CG-CB 4.15Å; P53-I56 HydrophobicContact CG-CD1 3.46Å; P53-I56 VanDerWaalsContact CG-CD1 3.46Å; P53-I56 HydrophobicContact CG-CG1 3.76Å; P53-I56 PolarHBondContact O-N 3.48Å; R54-I56 VanDerWaalsContact C-N 3.29Å; R54-I56 PolarHBondContact O-N 3.14Å; I56-E58 VanDerWaalsContact C-N 3.35Å; I56-E58 PolarHBondContact O-N 3.35Å; I56-S59 WeakPolarHBondContact O-CB 3.38Å; I56-S59 PolarHBondContact O-N 2.9Å; I56-F60 HydrophobicContact CG2-CD2 3.67Å; I56-F60 HydrophobicContact CG2-CE2 3.58Å; I56-F60 VanDerWaalsContact O-CD2 3.29Å; I56-F60 WeakPolarHBondContact O-CD2 3.03Å; I56-F60 PolarHBondContact O-N 2.75Å; I56-L156 HydrophobicContact CD1-CD2 3.56Å
57	I	83.6	Confident	84.9	Confident	12 Å²	12	55 Å²	55	6%	0.062	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-47.3	175.6	-65.3	150.4	0	0	0	110.4	L7 I16 I48 A52 P53 R54 S59 F60 V61	L7-I57 HydrophobicContact CD2-CG2 4.09Å; I16-I57 HydrophobicContact CD1-CB 4.49Å; I16-I57 HydrophobicContact CD1-CG2 4.01Å; I48-I57 HydrophobicContact CD1-CG1 3.78Å; A52-I57 HydrophobicContact CB-CG1 4.33Å; A52-I57 WeakPolarHBondContact O-CD1 3.48Å; P53-I57 PolarHBondContact O-N 3.26Å; R54-I57 WeakPolarHBondContact O-CB 3.31Å; R54-I57 PolarHBondContact O-N 3.07Å; R54-I57 VanDerWaalsContact O-N 3.1Å; I57-S59 VanDerWaalsContact C-N 3.27Å; I57-S59 PolarHBondContact O-N 3.16Å; I57-F60 PolarHBondContact O-N 3.36Å; I57-V61 HydrophobicContact CG2-CG2 4.46Å; I57-V61 VanDerWaalsContact O-CG2 3.28Å; I57-V61 WeakPolarHBondContact O-CG2 3.21Å; I57-V61 PolarHBondContact O-N 3.13Å
58	E	85.2	Confident	85	Confident	115 Å²	115	52.6 Å²	52.6	54%	0.537	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-40.9	175.4	-72.7	167.9	-175.9	0	0	111.7	R54 I56 V61 T62	R54-E58 WeakPolarHBondContact O-CG 3.48Å; R54-E58 PolarHBondContact O-N 3.32Å; I56-E58 VanDerWaalsContact C-N 3.35Å; I56-E58 PolarHBondContact O-N 3.35Å; E58-V61 WeakPolarHBondContact O-CB 3.46Å; E58-V61 PolarHBondContact O-N 2.99Å; E58-T62 PolarHBondContact O-N 3.23Å; E58-T62 PolarHBondContact O-OG1 3.36Å; E58-T62 VanDerWaalsContact O-OG1 3.11Å
59	S	84.1	Confident	85	Confident	7 Å²	7	54.4 Å²	54.4	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-43.3	177	-63.7	0	0	0	0	112.9	K55 I56 I57 V61 T62 L63 W146 V148	K55-S59 WeakPolarHBondContact O-CB 3.48Å; K55-S59 PolarHBondContact O-N 2.63Å; K55-S59 PolarHBondContact O-OG 3.37Å; I56-S59 WeakPolarHBondContact O-CB 3.38Å; I56-S59 PolarHBondContact O-N 2.9Å; I57-S59 VanDerWaalsContact C-N 3.27Å; I57-S59 PolarHBondContact O-N 3.16Å; S59-V61 VanDerWaalsContact C-N 3.34Å; S59-T62 PolarHBondContact O-N 3.1Å; S59-L63 VanDerWaalsContact O-CB 3.25Å; S59-L63 WeakPolarHBondContact O-CB 3.47Å; S59-L63 PolarHBondContact O-N 3.24Å; S59-W146 VanDerWaalsContact CB-NE1 3.33Å; S59-W146 PolarHBondContact OG-NE1 3.21Å; S59-V148 WeakPolarHBondContact OG-CG2 3.29Å
60	F	87.2	Confident	85.2	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-33.5	174.8	-83.2	-71.2	0	0	0	112.5	I16 F46 I48 I56 I57 A64 F125 L128 L129	I16-F60 HydrophobicContact CD1-CB 3.59Å; I16-F60 HydrophobicContact CD1-CG 4.42Å; I16-F60 HydrophobicContact CG2-CB 4.46Å; F46-F60 HydrophobicContact CB-CD1 4.11Å; F46-F60 HydrophobicContact CD2-CD1 4.02Å; F46-F60 AromaticContact CG-CD1 3.99Å; F46-F60 HydrophobicContact CG-CD1 3.99Å; I48-F60 HydrophobicContact CD1-CD2 4.36Å; I48-F60 HydrophobicContact CG2-CD1 4.5Å; I48-F60 HydrophobicContact CG2-CD2 3.87Å; I48-F60 HydrophobicContact CG2-CE1 4.36Å; I48-F60 HydrophobicContact CG2-CE2 3.71Å; I48-F60 HydrophobicContact CG2-CG 4.26Å; I48-F60 HydrophobicContact CG2-CZ 3.96Å; I56-F60 HydrophobicContact CG2-CD2 3.67Å; I56-F60 HydrophobicContact CG2-CE2 3.58Å; I56-F60 VanDerWaalsContact O-CD2 3.29Å; I56-F60 WeakPolarHBondContact O-CD2 3.03Å; I56-F60 PolarHBondContact O-N 2.75Å; I57-F60 PolarHBondContact O-N 3.36Å; F60-A64 VanDerWaalsContact O-CB 3.28Å; F60-A64 WeakPolarHBondContact O-CB 3.13Å; F60-A64 PolarHBondContact O-N 3.49Å; F60-F125 AromaticContact CE1-CD2 3.61Å; F60-F125 HydrophobicContact CE1-CD2 3.61Å; F60-F125 AromaticContact CE1-CE2 3.91Å; F60-F125 HydrophobicContact CE1-CE2 3.91Å; F60-F125 HydrophobicContact CZ-CD2 4.09Å; F60-F125 HydrophobicContact CZ-CE2 4.01Å; F60-L128 HydrophobicContact CD1-CD2 3.58Å; F60-L128 HydrophobicContact CD2-CD2 3.88Å; F60-L128 HydrophobicContact CE1-CB 4.45Å; F60-L128 HydrophobicContact CE1-CD2 3.46Å; F60-L128 VanDerWaalsContact CE1-CD2 3.46Å; F60-L128 HydrophobicContact CE2-CD2 3.77Å; F60-L128 HydrophobicContact CG-CD2 3.79Å; F60-L128 HydrophobicContact CZ-CB 4.47Å; F60-L128 HydrophobicContact CZ-CD2 3.58Å; F60-L128 HydrophobicContact CZ-CG 4.41Å; F60-L129 HydrophobicContact CE2-CD2 4.41Å; F60-L129 HydrophobicContact CZ-CD2 4.04Å; F60-L129 HydrophobicContact CZ-CG 4.28Å
61	V	88.3	Confident	85.7	Confident	31 Å²	31	45.7 Å²	45.7	19%	0.188	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-49.2	173.9	167.9	0	0	0	0	110.3	A5 L7 I16 I57 E58 S59 A64 K65	A5-V61 HydrophobicContact CB-CG1 3.51Å; A5-V61 HydrophobicContact CB-CG2 4.45Å; L7-V61 HydrophobicContact CD2-CG2 3.81Å; L7-V61 HydrophobicContact CG-CG2 4.48Å; I16-V61 HydrophobicContact CG2-CB 4.22Å; I16-V61 HydrophobicContact CG2-CG2 3.48Å; I16-V61 VanDerWaalsContact CG2-CG2 3.48Å; I57-V61 HydrophobicContact CG2-CG2 4.46Å; I57-V61 VanDerWaalsContact O-CG2 3.28Å; I57-V61 WeakPolarHBondContact O-CG2 3.21Å; I57-V61 PolarHBondContact O-N 3.13Å; E58-V61 WeakPolarHBondContact O-CB 3.46Å; E58-V61 PolarHBondContact O-N 2.99Å; S59-V61 VanDerWaalsContact C-N 3.34Å; V61-A64 PolarHBondContact O-N 2.93Å; V61-K65 PolarHBondContact O-N 3.33Å
62	T	88	Confident	86	Confident	35 Å²	35	40.8 Å²	40.8	22%	0.215	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-42.7	179	-51.1	0	0	0	0	111	E58 S59 A64 K65 E66 W146	E58-T62 PolarHBondContact O-N 3.23Å; E58-T62 PolarHBondContact O-OG1 3.36Å; E58-T62 VanDerWaalsContact O-OG1 3.11Å; S59-T62 PolarHBondContact O-N 3.1Å; T62-A64 VanDerWaalsContact C-N 3.34Å; T62-A64 PolarHBondContact O-N 2.87Å; T62-K65 WeakPolarHBondContact O-CB 3.45Å; T62-K65 PolarHBondContact O-N 3.45Å; T62-K65 VanDerWaalsContact O-N 3.15Å; T62-E66 HydrophobicContact CG2-CG 4.3Å; T62-E66 WeakPolarHBondContact O-CG 3.32Å; T62-E66 PolarHBondContact O-N 2.84Å; T62-W146 HydrophobicContact CG2-CD2 4.03Å; T62-W146 HydrophobicContact CG2-CE3 3.51Å; T62-W146 HydrophobicContact CG2-CH2 3.45Å; T62-W146 VanDerWaalsContact CG2-CH2 3.45Å; T62-W146 HydrophobicContact CG2-CZ2 3.96Å; T62-W146 HydrophobicContact CG2-CZ3 3.22Å
63	L	89.1	Confident	86.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-42.8	175.7	-174	64.9	0	0	0	112.2	F46 S59 K65 E66 F67 L128 V134 V144 W146	F46-L63 HydrophobicContact CE2-CD2 4.31Å; F46-L63 HydrophobicContact CE2-CG 4.25Å; F46-L63 HydrophobicContact CZ-CD2 4.25Å; F46-L63 HydrophobicContact CZ-CG 4.42Å; S59-L63 VanDerWaalsContact O-CB 3.25Å; S59-L63 WeakPolarHBondContact O-CB 3.47Å; S59-L63 PolarHBondContact O-N 3.24Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 2.61Å; L63-E66 PolarHBondContact O-N 3.25Å; L63-F67 HydrophobicContact CD1-CD2 3.91Å; L63-F67 HydrophobicContact CD1-CE2 3.56Å; L63-F67 HydrophobicContact CD1-CZ 4.46Å; L63-F67 HydrophobicContact CD2-CE2 4.13Å; L63-F67 HydrophobicContact CG-CD2 3.8Å; L63-F67 HydrophobicContact CG-CE2 3.68Å; L63-F67 VanDerWaalsContact O-CD2 3.28Å; L63-F67 WeakPolarHBondContact O-CD2 3.47Å; L63-F67 PolarHBondContact O-N 3.38Å; L63-L128 HydrophobicContact CD2-CB 4.43Å; L63-L128 HydrophobicContact CD2-CD2 3.99Å; L63-V134 HydrophobicContact CD1-CB 4.18Å; L63-V134 HydrophobicContact CD1-CG1 4.01Å; L63-V134 HydrophobicContact CD1-CG2 4.29Å; L63-V134 HydrophobicContact CD2-CG2 4.14Å; L63-V144 HydrophobicContact CD1-CG1 3.82Å; L63-W146 HydrophobicContact CD1-CB 4.14Å
64	A	90.5	Very high	86.7	Confident	1 Å²	1	43 Å²	43	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-40.2	176	0	0	0	0	0	112	F46 F60 V61 T62 A68	F46-A64 HydrophobicContact CD2-CB 3.87Å; F46-A64 HydrophobicContact CE2-CB 3.83Å; F60-A64 VanDerWaalsContact O-CB 3.28Å; F60-A64 WeakPolarHBondContact O-CB 3.13Å; F60-A64 PolarHBondContact O-N 3.49Å; V61-A64 PolarHBondContact O-N 2.93Å; T62-A64 VanDerWaalsContact C-N 3.34Å; T62-A64 PolarHBondContact O-N 2.87Å; A64-A68 VanDerWaalsContact O-CB 3.28Å; A64-A68 WeakPolarHBondContact O-CB 3.28Å; A64-A68 PolarHBondContact O-N 2.69Å
65	K	90	Very high	87	Confident	85 Å²	85	34.4 Å²	34.4	37%	0.37	17%	0.166	S	C	.	.	H	α-helix	trans	-62.6	-49.5	174.6	177.5	-173.7	174.2	-161	0	111.4	Y18 V61 T62 L63 F67 A68 L69	Y18-K65 HydrophobicContact CD2-CB 3.82Å; Y18-K65 HydrophobicContact CD2-CG 4.14Å; Y18-K65 HydrophobicContact CE1-CG 4.28Å; Y18-K65 HydrophobicContact CE2-CB 3.94Å; Y18-K65 HydrophobicContact CE2-CD 4.21Å; Y18-K65 HydrophobicContact CE2-CG 3.73Å; Y18-K65 HydrophobicContact CG-CB 4.17Å; V61-K65 PolarHBondContact O-N 3.33Å; T62-K65 WeakPolarHBondContact O-CB 3.45Å; T62-K65 PolarHBondContact O-N 3.45Å; T62-K65 VanDerWaalsContact O-N 3.15Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 2.61Å; K65-F67 PolarHBondContact O-N 2.95Å; K65-A68 PolarHBondContact O-N 2.95Å; K65-L69 HydrophobicContact CG-CD1 4.01Å; K65-L69 HydrophobicContact CG-CG 4.44Å; K65-L69 WeakPolarHBondContact O-CG 3.47Å; K65-L69 PolarHBondContact O-N 3.22Å
66	E	88.7	Confident	87.3	Confident	66 Å²	66	33.4 Å²	33.4	31%	0.308	17%	0.165	S	C	.	.	H	α-helix	trans	-62.1	-43.4	179.8	-66.8	-52.6	130.3	0	0	111.5	T62 L63 A68 L69 A70 V144	T62-E66 HydrophobicContact CG2-CG 4.3Å; T62-E66 WeakPolarHBondContact O-CG 3.32Å; T62-E66 PolarHBondContact O-N 2.84Å; L63-E66 PolarHBondContact O-N 3.25Å; E66-A68 PolarHBondContact O-N 3.01Å; E66-L69 PolarHBondContact O-N 3.24Å; E66-A70 VanDerWaalsContact O-CB 3.28Å; E66-A70 WeakPolarHBondContact O-CB 3.44Å; E66-A70 PolarHBondContact O-N 3.17Å; E66-V144 HydrophobicContact CB-CG1 3.78Å
67	F	90.7	Very high	87.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-43.6	173.5	-87.4	-60.3	0	0	0	112.5	V44 F46 L63 K65 A70 I71 T120 L121 L136 V138 V144	V44-F67 HydrophobicContact CG1-CB 4.32Å; F46-F67 HydrophobicContact CE2-CD2 4.44Å; F46-F67 AromaticContact CZ-CD2 3.99Å; F46-F67 HydrophobicContact CZ-CD2 3.99Å; F46-F67 HydrophobicContact CZ-CE2 4.24Å; L63-F67 HydrophobicContact CD1-CD2 3.91Å; L63-F67 HydrophobicContact CD1-CE2 3.56Å; L63-F67 HydrophobicContact CD1-CZ 4.46Å; L63-F67 HydrophobicContact CD2-CE2 4.13Å; L63-F67 HydrophobicContact CG-CD2 3.8Å; L63-F67 HydrophobicContact CG-CE2 3.68Å; L63-F67 VanDerWaalsContact O-CD2 3.28Å; L63-F67 WeakPolarHBondContact O-CD2 3.47Å; L63-F67 PolarHBondContact O-N 3.38Å; K65-F67 PolarHBondContact O-N 2.95Å; F67-A70 PolarHBondContact O-N 3.32Å; F67-I71 WeakPolarHBondContact O-CB 3.46Å; F67-I71 WeakPolarHBondContact O-CD1 3.23Å; F67-I71 WeakPolarHBondContact O-CG1 3.28Å; F67-I71 PolarHBondContact O-N 3.49Å; F67-T120 HydrophobicContact CE1-CG2 3.84Å; F67-T120 HydrophobicContact CZ-CG2 4.39Å; F67-L121 HydrophobicContact CB-CD2 4.28Å; F67-L121 HydrophobicContact CD1-CD2 3.92Å; F67-L121 HydrophobicContact CD2-CD2 4.04Å; F67-L121 HydrophobicContact CE1-CD2 4.27Å; F67-L121 HydrophobicContact CE2-CD2 4.35Å; F67-L121 HydrophobicContact CG-CD2 3.81Å; F67-L121 HydrophobicContact CZ-CD2 4.47Å; F67-L136 HydrophobicContact CZ-CD1 4.23Å; F67-V138 HydrophobicContact CD1-CG2 3.98Å; F67-V138 HydrophobicContact CE1-CG2 4.03Å; F67-V144 HydrophobicContact CD1-CB 4.39Å; F67-V144 HydrophobicContact CD1-CG1 4.24Å; F67-V144 HydrophobicContact CD1-CG2 4.01Å; F67-V144 HydrophobicContact CD2-CG1 4.21Å; F67-V144 HydrophobicContact CE1-CB 4.17Å; F67-V144 HydrophobicContact CE1-CG1 4.14Å; F67-V144 HydrophobicContact CE1-CG2 4.2Å; F67-V144 HydrophobicContact CE2-CG1 4.14Å; F67-V144 HydrophobicContact CG-CG1 4.25Å; F67-V144 HydrophobicContact CZ-CB 4.49Å; F67-V144 HydrophobicContact CZ-CG1 4.1Å
68	A	90.1	Very high	87.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-44.7	179.3	0	0	0	0	0	111.3	Y18 V20 Y42 V44 A64 K65 E66 A70 I71 Q72	Y18-A68 HydrophobicContact CD1-CB 3.5Å; Y18-A68 HydrophobicContact CE1-CB 4.26Å; Y18-A68 HydrophobicContact CG-CB 4.28Å; V20-A68 HydrophobicContact CG2-CB 3.64Å; Y42-A68 HydrophobicContact CE2-CB 4.32Å; Y42-A68 PolarHBondContact OH-O 3.18Å; V44-A68 HydrophobicContact CG2-CB 4.2Å; A64-A68 VanDerWaalsContact O-CB 3.28Å; A64-A68 WeakPolarHBondContact O-CB 3.28Å; A64-A68 PolarHBondContact O-N 2.69Å; K65-A68 PolarHBondContact O-N 2.95Å; E66-A68 PolarHBondContact O-N 3.01Å; A68-A70 VanDerWaalsContact C-N 3.35Å; A68-A70 PolarHBondContact O-N 3.1Å; A68-I71 PolarHBondContact O-N 3.48Å; A68-Q72 WeakPolarHBondContact O-CB 3.36Å; A68-Q72 PolarHBondContact O-N 3.25Å
69	L	87.9	Confident	87.4	Confident	53 Å²	53	36.9 Å²	36.9	28%	0.277	19%	0.188	S	C	.	.	H	α-helix	trans	-62.7	-40.4	175.4	-67.2	175.3	0	0	0	112.2	K65 E66 Q72 H73	K65-L69 HydrophobicContact CG-CD1 4.01Å; K65-L69 HydrophobicContact CG-CG 4.44Å; K65-L69 WeakPolarHBondContact O-CG 3.47Å; K65-L69 PolarHBondContact O-N 3.22Å; E66-L69 PolarHBondContact O-N 3.24Å; L69-Q72 WeakPolarHBondContact O-CB 3.36Å; L69-Q72 PolarHBondContact O-N 2.91Å; L69-H73 PolarHBondContact O-CD2 3.36Å; L69-H73 PolarHBondContact O-N 2.84Å
70	A	89.5	Confident	87.6	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.033	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-44.3	175.9	0	0	0	0	0	112.1	E66 F67 A68 Q72 H73 E74 V138 I142 V144	E66-A70 VanDerWaalsContact O-CB 3.28Å; E66-A70 WeakPolarHBondContact O-CB 3.44Å; E66-A70 PolarHBondContact O-N 3.17Å; F67-A70 PolarHBondContact O-N 3.32Å; A68-A70 VanDerWaalsContact C-N 3.35Å; A68-A70 PolarHBondContact O-N 3.1Å; A70-Q72 VanDerWaalsContact C-N 3.32Å; A70-Q72 PolarHBondContact O-N 3.27Å; A70-H73 PolarHBondContact O-N 2.89Å; A70-E74 PolarHBondContact O-N 2.89Å; A70-V138 HydrophobicContact CB-CB 4.27Å; A70-V138 HydrophobicContact CB-CG2 3.87Å; A70-I142 HydrophobicContact CB-CB 4.21Å; A70-I142 HydrophobicContact CB-CG2 3.66Å; A70-V144 HydrophobicContact CB-CG2 3.57Å
71	I	89.3	Confident	87.6	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-39.7	175.8	-68.1	163.3	0	0	0	110.7	Y42 V44 F67 A68 H73 E74 E75 L81 L117	Y42-I71 HydrophobicContact CE2-CB 4.22Å; Y42-I71 HydrophobicContact CE2-CG2 3.9Å; V44-I71 HydrophobicContact CG2-CD1 3.84Å; F67-I71 WeakPolarHBondContact O-CB 3.46Å; F67-I71 WeakPolarHBondContact O-CD1 3.23Å; F67-I71 WeakPolarHBondContact O-CG1 3.28Å; F67-I71 PolarHBondContact O-N 3.49Å; A68-I71 PolarHBondContact O-N 3.48Å; I71-H73 PolarHBondContact O-N 2.92Å; I71-E74 PolarHBondContact O-N 3.38Å; I71-E75 WeakPolarHBondContact O-CB 3.38Å; I71-E75 PolarHBondContact O-N 3.18Å; I71-L81 HydrophobicContact CG2-CB 3.97Å; I71-L81 HydrophobicContact CG2-CD1 3.94Å; I71-L81 HydrophobicContact CG2-CD2 3.93Å; I71-L81 HydrophobicContact CG2-CG 4.16Å; I71-L117 HydrophobicContact CD1-CD1 3.76Å; I71-L117 HydrophobicContact CG1-CD1 4.01Å
72	Q	87.7	Confident	87.5	Confident	48 Å²	48	36.9 Å²	36.9	22%	0.224	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-44.8	176.4	-170.3	175.8	17.8	0	0	111.8	V20 Y42 A68 L69 A70 E75 N76	V20-Q72 HydrophobicContact CG1-CG 4.34Å; Y42-Q72 WeakPolarHBondContact OH-CB 3.26Å; Y42-Q72 PolarHBondContact OH-N 2.84Å; A68-Q72 WeakPolarHBondContact O-CB 3.36Å; A68-Q72 PolarHBondContact O-N 3.25Å; L69-Q72 WeakPolarHBondContact O-CB 3.36Å; L69-Q72 PolarHBondContact O-N 2.91Å; A70-Q72 VanDerWaalsContact C-N 3.32Å; A70-Q72 PolarHBondContact O-N 3.27Å; Q72-E75 PolarHBondContact O-N 3.3Å; Q72-N76 PolarHBondContact O-N 3.06Å; Q72-N76 VanDerWaalsContact O-N 3.09Å
73	H	86.5	Confident	87.4	Confident	123 Å²	123	37.6 Å²	37.6	57%	0.569	19%	0.193	S	C	*	.	H	α-helix	trans	-65.5	-42.7	176.6	-89.4	-74	0	0	0	112.4	L69 A70 I71 E75 N76 R77 I142	L69-H73 PolarHBondContact O-CD2 3.36Å; L69-H73 PolarHBondContact O-N 2.84Å; A70-H73 PolarHBondContact O-N 2.89Å; I71-H73 PolarHBondContact O-N 2.92Å; H73-E75 VanDerWaalsContact C-N 3.35Å; H73-N76 PolarHBondContact O-N 3.23Å; H73-R77 WeakPolarHBondContact O-CB 3.43Å; H73-R77 PolarHBondContact O-N 3.07Å; H73-I142 HydrophobicContact CB-CD1 3.3Å
74	E	85.7	Confident	87.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-33.1	177.4	-80.4	-63	132.4	0	0	112.9	A70 I71 R77 C78 G79 Y80 V138 N139 I142	A70-E74 PolarHBondContact O-N 2.89Å; I71-E74 PolarHBondContact O-N 3.38Å; E74-R77 PolarHBondContact O-N 3.16Å; E74-R77 IonicContact OE1-NH1 3.68Å; E74-C78 PolarHBondContact O-N 3.41Å; E74-C78 PolarHBondContact O-SG 3.09Å; E74-C78 VanDerWaalsContact O-SG 3.32Å; E74-C78 PolarHBondContact OE2-SG 3.39Å; E74-C78 VanDerWaalsContact OE2-SG 3.39Å; E74-G79 PolarHBondContact O-N 2.83Å; E74-Y80 HydrophobicContact CB-CD1 4.27Å; E74-Y80 HydrophobicContact CB-CG 4.24Å; E74-Y80 PolarHBondContact O-N 3.32Å; E74-V138 HydrophobicContact CG-CG1 4.2Å; E74-N139 HydrophobicContact CG-CB 4.15Å; E74-N139 WeakPolarHBondContact OE2-CB 3.1Å; E74-N139 PolarHBondContact OE2-ND2 3.48Å; E74-I142 HydrophobicContact CG-CD1 3.85Å; E74-I142 HydrophobicContact CG-CG1 4.22Å
75	E	86.9	Confident	87.2	Confident	21 Å²	21	40.5 Å²	40.5	10%	0.098	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-46.4	172.9	-175.2	60.6	-168.9	0	0	111.3	I71 Q72 H73 R77 G79 Y80 L81 T82	I71-E75 WeakPolarHBondContact O-CB 3.38Å; I71-E75 PolarHBondContact O-N 3.18Å; Q72-E75 PolarHBondContact O-N 3.3Å; H73-E75 VanDerWaalsContact C-N 3.35Å; E75-R77 PolarHBondContact O-N 2.84Å; E75-G79 WeakPolarHBondContact O-CA 3.5Å; E75-G79 PolarHBondContact O-N 3.47Å; E75-G79 VanDerWaalsContact OE2-CA 3.27Å; E75-G79 WeakPolarHBondContact OE2-CA 3.21Å; E75-Y80 PolarHBondContact OE2-N 2.91Å; E75-L81 HydrophobicContact CB-CB 4.37Å; E75-L81 HydrophobicContact CG-CB 4.45Å; E75-L81 VanDerWaalsContact OE2-CA 3.32Å; E75-L81 WeakPolarHBondContact OE2-CA 3.15Å; E75-L81 WeakPolarHBondContact OE2-CB 3.3Å; E75-L81 PolarHBondContact OE2-N 3.39Å; E75-T82 WeakPolarHBondContact OE1-CB 3.28Å; E75-T82 PolarHBondContact OE1-OG1 3Å; E75-T82 PolarHBondContact OE2-N 3.16Å
76	N	84.6	Confident	87.1	Confident	73 Å²	73	39.8 Å²	39.8	39%	0.39	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-29.9	176.7	-72.6	-12.4	0	0	0	112.8	H22 Q72 H73	H22-N76 PolarHBondContact NE2-OD1 3.33Å; Q72-N76 PolarHBondContact O-N 3.06Å; Q72-N76 VanDerWaalsContact O-N 3.09Å; H73-N76 PolarHBondContact O-N 3.23Å
77	R	83.9	Confident	87.1	Confident	132 Å²	132	38.8 Å²	38.8	50%	0.498	21%	0.205	S	C	.	.	H	α-helix	trans	-80.8	-48.7	-178.5	-170.9	-162.8	-174.1	-166	2.5	112.8	H73 E74 E75 W141	H73-R77 WeakPolarHBondContact O-CB 3.43Å; H73-R77 PolarHBondContact O-N 3.07Å; E74-R77 PolarHBondContact O-N 3.16Å; E74-R77 IonicContact OE1-NH1 3.68Å; E75-R77 PolarHBondContact O-N 2.84Å; R77-W141 HydrophobicContact CG-CZ3 4.3Å; R77-W141 VanDerWaalsContact CZ-CH2 3.49Å; R77-W141 VanDerWaalsContact CZ-CZ2 3.44Å; R77-W141 VanDerWaalsContact CZ-CZ3 3.47Å; R77-W141 VanDerWaalsContact NE-CZ3 3.32Å; R77-W141 VanDerWaalsContact NH1-CE2 3.34Å; R77-W141 VanDerWaalsContact NH2-CZ2 3.3Å
78	C	83.4	Confident	86.9	Confident	70 Å²	70	40.9 Å²	40.9	47%	0.473	22%	0.215	S	C	.	.	H	α-helix	trans	-140.6	7.1	-168.4	67.6	0	0	0	0	115	E74 Y80	E74-C78 PolarHBondContact O-N 3.41Å; E74-C78 PolarHBondContact O-SG 3.09Å; E74-C78 VanDerWaalsContact O-SG 3.32Å; E74-C78 PolarHBondContact OE2-SG 3.39Å; E74-C78 VanDerWaalsContact OE2-SG 3.39Å; C78-Y80 PolarHBondContact O-N 2.78Å
79	G	84.1	Confident	86.7	Confident	22 Å²	22	44.8 Å²	44.8	23%	0.227	24%	0.235	C	C	.	.			trans	63.6	33.4	-174.6	0	0	0	0	0	112.1	E74 E75 L81 T82 S83	E74-G79 PolarHBondContact O-N 2.83Å; E75-G79 WeakPolarHBondContact O-CA 3.5Å; E75-G79 PolarHBondContact O-N 3.47Å; E75-G79 VanDerWaalsContact OE2-CA 3.27Å; E75-G79 WeakPolarHBondContact OE2-CA 3.21Å; G79-L81 PolarHBondContact O-N 3.31Å; G79-T82 WeakPolarHBondContact O-CB 3.22Å; G79-T82 PolarHBondContact O-N 3.4Å; G79-S83 PolarHBondContact O-N 3.39Å
80	Y	86.7	Confident	86.6	Confident	5 Å²	5	46.4 Å²	46.4	2%	0.02	24%	0.244	C	C	.	.	H	α-helix	trans	-56.8	-47.5	-174.8	179.4	-108.2	0	0	0	112.2	E74 E75 C78 T82 S83 Q84 N116 L117 V138 N139	E74-Y80 HydrophobicContact CB-CD1 4.27Å; E74-Y80 HydrophobicContact CB-CG 4.24Å; E74-Y80 PolarHBondContact O-N 3.32Å; E75-Y80 PolarHBondContact OE2-N 2.91Å; C78-Y80 PolarHBondContact O-N 2.78Å; Y80-T82 VanDerWaalsContact C-N 3.34Å; Y80-T82 PolarHBondContact O-N 2.88Å; Y80-S83 PolarHBondContact O-N 3.23Å; Y80-S83 PolarHBondContact O-OG 3.25Å; Y80-Q84 HydrophobicContact CD1-CG 4.2Å; Y80-Q84 HydrophobicContact CD2-CG 4.15Å; Y80-Q84 HydrophobicContact CE1-CG 3.82Å; Y80-Q84 HydrophobicContact CE2-CG 3.77Å; Y80-Q84 HydrophobicContact CG-CG 4.37Å; Y80-Q84 VanDerWaalsContact O-CG 3.32Å; Y80-Q84 WeakPolarHBondContact O-CG 3.29Å; Y80-Q84 PolarHBondContact O-N 2.94Å; Y80-N116 WeakPolarHBondContact OH-CB 3.33Å; Y80-L117 HydrophobicContact CE1-CB 4.08Å; Y80-L117 HydrophobicContact CE1-CD1 4.31Å; Y80-L117 PolarHBondContact OH-N 3.34Å; Y80-V138 HydrophobicContact CD1-CG1 4.48Å; Y80-V138 HydrophobicContact CE1-CG1 4.09Å; Y80-N139 HydrophobicContact CD2-CB 3.82Å; Y80-N139 VanDerWaalsContact CD2-CG 3.43Å; Y80-N139 HydrophobicContact CE2-CB 3.69Å; Y80-N139 VanDerWaalsContact CE2-CG 3.49Å; Y80-N139 WeakPolarHBondContact CE2-OD1 3.42Å; Y80-N139 HydrophobicContact CG-CB 4.28Å
81	L	87.2	Confident	86.3	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-43.8	179.4	-177.2	66.1	0	0	0	110.1	I39 Y42 I71 E75 G79 S83 Q84 V85 L117	I39-L81 HydrophobicContact CD1-CB 4.39Å; I39-L81 HydrophobicContact CD1-CD2 3.83Å; I39-L81 HydrophobicContact CD1-CG 3.67Å; I39-L81 HydrophobicContact CG2-CD2 3.99Å; Y42-L81 HydrophobicContact CD1-CD2 3.63Å; Y42-L81 HydrophobicContact CD2-CD2 4.36Å; Y42-L81 HydrophobicContact CE1-CD2 4.11Å; Y42-L81 HydrophobicContact CG-CD2 3.78Å; I71-L81 HydrophobicContact CG2-CB 3.97Å; I71-L81 HydrophobicContact CG2-CD1 3.94Å; I71-L81 HydrophobicContact CG2-CD2 3.93Å; I71-L81 HydrophobicContact CG2-CG 4.16Å; E75-L81 HydrophobicContact CB-CB 4.37Å; E75-L81 HydrophobicContact CG-CB 4.45Å; E75-L81 VanDerWaalsContact OE2-CA 3.32Å; E75-L81 WeakPolarHBondContact OE2-CA 3.15Å; E75-L81 WeakPolarHBondContact OE2-CB 3.3Å; E75-L81 PolarHBondContact OE2-N 3.39Å; G79-L81 PolarHBondContact O-N 3.31Å; L81-S83 VanDerWaalsContact C-N 3.3Å; L81-S83 PolarHBondContact O-N 2.9Å; L81-Q84 PolarHBondContact O-N 3.46Å; L81-V85 HydrophobicContact CD1-CG2 4.08Å; L81-V85 HydrophobicContact CG-CG2 4.21Å; L81-V85 WeakPolarHBondContact O-CB 3.32Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.3Å; L81-V85 PolarHBondContact O-N 3.43Å; L81-L117 HydrophobicContact CD1-CD2 3.73Å
82	T	86.9	Confident	86	Confident	22 Å²	22	50 Å²	50	14%	0.135	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-43.5	175	-69	0	0	0	0	111.7	V37 E75 G79 Y80 K86	V37-T82 HydrophobicContact CB-CG2 4.31Å; E75-T82 WeakPolarHBondContact OE1-CB 3.28Å; E75-T82 PolarHBondContact OE1-OG1 3Å; E75-T82 PolarHBondContact OE2-N 3.16Å; G79-T82 WeakPolarHBondContact O-CB 3.22Å; G79-T82 PolarHBondContact O-N 3.4Å; Y80-T82 VanDerWaalsContact C-N 3.34Å; Y80-T82 PolarHBondContact O-N 2.88Å; T82-K86 WeakPolarHBondContact O-CG 3.21Å; T82-K86 PolarHBondContact O-N 3.41Å; T82-K86 VanDerWaalsContact O-N 3.17Å
83	S	86.7	Confident	85.9	Confident	51 Å²	51	53.8 Å²	53.8	36%	0.357	28%	0.277	S	S	.	.	H	α-helix	trans	-65.8	-44.3	177.1	78.2	0	0	0	0	112.8	G79 Y80 L81 K86 V87	G79-S83 PolarHBondContact O-N 3.39Å; Y80-S83 PolarHBondContact O-N 3.23Å; Y80-S83 PolarHBondContact O-OG 3.25Å; L81-S83 VanDerWaalsContact C-N 3.3Å; L81-S83 PolarHBondContact O-N 2.9Å; S83-K86 PolarHBondContact O-N 3.39Å; S83-V87 WeakPolarHBondContact O-CG2 3.35Å; S83-V87 PolarHBondContact O-N 3.5Å
84	Q	87.5	Confident	85.5	Confident	24 Å²	24	51.9 Å²	51.9	11%	0.112	27%	0.274	C	S	.	.	H	α-helix	trans	-70.6	-36.5	-178.1	-67.5	-60.5	-56	0	0	111.6	Y80 L81 V87 M88 S115 L117	Y80-Q84 HydrophobicContact CD1-CG 4.2Å; Y80-Q84 HydrophobicContact CD2-CG 4.15Å; Y80-Q84 HydrophobicContact CE1-CG 3.82Å; Y80-Q84 HydrophobicContact CE2-CG 3.77Å; Y80-Q84 HydrophobicContact CG-CG 4.37Å; Y80-Q84 VanDerWaalsContact O-CG 3.32Å; Y80-Q84 WeakPolarHBondContact O-CG 3.29Å; Y80-Q84 PolarHBondContact O-N 2.94Å; L81-Q84 PolarHBondContact O-N 3.46Å; Q84-V87 PolarHBondContact O-N 3.41Å; Q84-M88 VanDerWaalsContact O-CG 3.3Å; Q84-M88 WeakPolarHBondContact O-CG 3.21Å; Q84-M88 PolarHBondContact O-N 2.88Å; Q84-S115 PolarHBondContact OE1-OG 3.32Å; Q84-L117 HydrophobicContact CB-CB 4.19Å; Q84-L117 HydrophobicContact CB-CD2 4.38Å; Q84-L117 HydrophobicContact CG-CB 4.01Å
85	V	87.7	Confident	85	Confident	37 Å²	37	52.7 Å²	52.7	22%	0.224	28%	0.281	C	S	.	.	H	α-helix	trans	-65.1	-40.7	175.2	169.8	0	0	0	0	110.9	V37 I39 L81 V87 M88 L89	V37-V85 HydrophobicContact CG1-CG1 4.44Å; I39-V85 HydrophobicContact CD1-CB 4.26Å; I39-V85 HydrophobicContact CD1-CG2 3.87Å; L81-V85 HydrophobicContact CD1-CG2 4.08Å; L81-V85 HydrophobicContact CG-CG2 4.21Å; L81-V85 WeakPolarHBondContact O-CB 3.32Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.3Å; L81-V85 PolarHBondContact O-N 3.43Å; V85-V87 PolarHBondContact O-N 3.31Å; V85-M88 WeakPolarHBondContact O-CB 3.44Å; V85-M88 PolarHBondContact O-N 3.09Å; V85-M88 VanDerWaalsContact O-N 3.16Å; V85-L89 HydrophobicContact CG1-CD1 3.96Å; V85-L89 HydrophobicContact CG1-CG 4.25Å; V85-L89 WeakPolarHBondContact O-CG 3.27Å; V85-L89 PolarHBondContact O-N 2.92Å
86	K	88.2	Confident	84.3	Confident	70 Å²	70	58.9 Å²	58.9	30%	0.304	31%	0.31	S	S	.	.	H	α-helix	trans	-57	-49	172.6	-73.5	176.9	179.6	-171.8	0	111.1	D35 V37 T82 S83 M88 L89 D90	D35-K86 PolarHBondContact O-NZ 2.8Å; V37-K86 HydrophobicContact CG2-CG 4.07Å; T82-K86 WeakPolarHBondContact O-CG 3.21Å; T82-K86 PolarHBondContact O-N 3.41Å; T82-K86 VanDerWaalsContact O-N 3.17Å; S83-K86 PolarHBondContact O-N 3.39Å; K86-M88 VanDerWaalsContact C-N 3.29Å; K86-M88 PolarHBondContact O-N 3.48Å; K86-L89 PolarHBondContact O-N 3.49Å; K86-D90 PolarHBondContact O-N 2.85Å
87	V	87.7	Confident	83.6	Confident	46 Å²	46	59.4 Å²	59.4	28%	0.279	32%	0.319	S	S	.	.	H	α-helix	trans	-58.7	-40.3	175.6	175.4	0	0	0	0	112.1	S83 Q84 V85 C91 K114	S83-V87 WeakPolarHBondContact O-CG2 3.35Å; S83-V87 PolarHBondContact O-N 3.5Å; Q84-V87 PolarHBondContact O-N 3.41Å; V85-V87 PolarHBondContact O-N 3.31Å; V87-C91 PolarHBondContact O-N 3.11Å; V87-C91 VanDerWaalsContact O-N 3.16Å; V87-C91 PolarHBondContact O-SG 3.39Å; V87-K114 HydrophobicContact CG1-CB 3.88Å
88	M	85.9	Confident	82.7	Confident	43 Å²	43	58.9 Å²	58.9	21%	0.212	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-47.2	176.6	-70.3	-178.7	-172.6	0	0	111.5	Q84 V85 K86 D90 C91 F92 V111 S115 L117 A118	Q84-M88 VanDerWaalsContact O-CG 3.3Å; Q84-M88 WeakPolarHBondContact O-CG 3.21Å; Q84-M88 PolarHBondContact O-N 2.88Å; V85-M88 WeakPolarHBondContact O-CB 3.44Å; V85-M88 PolarHBondContact O-N 3.09Å; V85-M88 VanDerWaalsContact O-N 3.16Å; K86-M88 VanDerWaalsContact C-N 3.29Å; K86-M88 PolarHBondContact O-N 3.48Å; M88-D90 PolarHBondContact O-N 3.24Å; M88-C91 WeakPolarHBondContact O-CB 3.46Å; M88-C91 PolarHBondContact O-N 3.37Å; M88-C91 VanDerWaalsContact O-N 3.14Å; M88-F92 WeakPolarHBondContact O-CD2 3.39Å; M88-F92 PolarHBondContact O-N 2.86Å; M88-V111 HydrophobicContact CE-CG1 4.38Å; M88-V111 HydrophobicContact CG-CG1 3.9Å; M88-V111 HydrophobicContact SD-CG1 4.43Å; M88-S115 WeakPolarHBondContact CE-OG 3.45Å; M88-L117 HydrophobicContact CE-CB 4.38Å; M88-L117 HydrophobicContact CE-CD2 4.32Å; M88-A118 HydrophobicContact CE-CB 4.1Å
89	L	87	Confident	81.6	Confident	82 Å²	82	66.5 Å²	66.5	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-45.4	177.7	-70.6	172.2	0	0	0	111.2	V85 K86 C91 F92 E93	V85-L89 HydrophobicContact CG1-CD1 3.96Å; V85-L89 HydrophobicContact CG1-CG 4.25Å; V85-L89 WeakPolarHBondContact O-CG 3.27Å; V85-L89 PolarHBondContact O-N 2.92Å; K86-L89 PolarHBondContact O-N 3.49Å; L89-C91 PolarHBondContact O-N 2.78Å; L89-F92 CarbonylContact O-C 3.55Å; L89-F92 WeakPolarHBondContact O-CA 3.18Å; L89-F92 WeakPolarHBondContact O-CB 3.39Å; L89-F92 PolarHBondContact O-N 3.15Å; L89-E93 WeakPolarHBondContact O-CG 3.34Å; L89-E93 PolarHBondContact O-N 3.43Å
90	D	86.2	Confident	80.6	Confident	88 Å²	88	71.1 Å²	71.1	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-58.1	-37.9	175.8	-62.5	-16.4	0	0	0	111.8	K86 M88 E93 V94	K86-D90 PolarHBondContact O-N 2.85Å; M88-D90 PolarHBondContact O-N 3.24Å; D90-E93 PolarHBondContact O-N 2.92Å; D90-V94 VanDerWaalsContact O-CG2 3.29Å; D90-V94 WeakPolarHBondContact O-CG2 3.39Å; D90-V94 PolarHBondContact O-N 3Å; D90-V94 VanDerWaalsContact O-N 3.07Å
91	C	83.4	Confident	79.2	Confident	5 Å²	5	79.4 Å²	79.4	3%	0.034	40%	0.399	C	S	.	.	H	α-helix	trans	-67.8	-39	175.6	-64.2	0	0	0	0	112.4	V87 M88 L89 A95 V111 K114	V87-C91 PolarHBondContact O-N 3.11Å; V87-C91 VanDerWaalsContact O-N 3.16Å; V87-C91 PolarHBondContact O-SG 3.39Å; M88-C91 WeakPolarHBondContact O-CB 3.46Å; M88-C91 PolarHBondContact O-N 3.37Å; M88-C91 VanDerWaalsContact O-N 3.14Å; L89-C91 PolarHBondContact O-N 2.78Å; C91-A95 WeakPolarHBondContact O-CB 3.28Å; C91-A95 PolarHBondContact O-N 3.49Å; C91-A95 VanDerWaalsContact O-N 3.13Å; C91-V111 HydrophobicContact CB-CG2 3.74Å; C91-K114 WeakPolarHBondContact SG-CD 3.32Å
92	F	83.1	Confident	78	Confident	75 Å²	75	86.1 Å²	86.1	33%	0.329	44%	0.435	S	S	.	.	H	α-helix	trans	-67.3	-38.7	175.9	-82.3	-74.1	0	0	0	111.6	M88 L89 A95 Q96 V107 Y108 V111	M88-F92 WeakPolarHBondContact O-CD2 3.39Å; M88-F92 PolarHBondContact O-N 2.86Å; L89-F92 CarbonylContact O-C 3.55Å; L89-F92 WeakPolarHBondContact O-CA 3.18Å; L89-F92 WeakPolarHBondContact O-CB 3.39Å; L89-F92 PolarHBondContact O-N 3.15Å; F92-A95 PolarHBondContact O-N 2.95Å; F92-Q96 WeakPolarHBondContact O-CG 3.37Å; F92-Q96 PolarHBondContact O-N 3.21Å; F92-V107 HydrophobicContact CD1-CG1 3.66Å; F92-V107 HydrophobicContact CE1-CG1 3.75Å; F92-V107 HydrophobicContact CG-CG1 4.13Å; F92-V107 HydrophobicContact CZ-CG1 4.28Å; F92-Y108 HydrophobicContact CZ-CE1 4.03Å; F92-V111 HydrophobicContact CE2-CG2 4.2Å
93	E	83.8	Confident	76.9	Confident	128 Å²	128	86.6 Å²	86.6	60%	0.598	44%	0.439	S	S	*	.	H	α-helix	trans	-65.8	-45.3	176.8	-71.5	-177.1	-177.1	0	0	112.2	L89 D90 A95 Q96 S97	L89-E93 WeakPolarHBondContact O-CG 3.34Å; L89-E93 PolarHBondContact O-N 3.43Å; D90-E93 PolarHBondContact O-N 2.92Å; E93-A95 VanDerWaalsContact C-N 3.26Å; E93-A95 PolarHBondContact O-N 3.46Å; E93-Q96 PolarHBondContact O-N 3.48Å; E93-S97 PolarHBondContact O-N 2.97Å
94	V	79.8	Confident	76.1	Confident	84 Å²	84	89 Å²	89	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-60.2	-39.5	175.4	172.1	0	0	0	0	111	D90 S97	D90-V94 VanDerWaalsContact O-CG2 3.29Å; D90-V94 WeakPolarHBondContact O-CG2 3.39Å; D90-V94 PolarHBondContact O-N 3Å; D90-V94 VanDerWaalsContact O-N 3.07Å; V94-S97 PolarHBondContact O-N 2.9Å; V94-S97 PolarHBondContact O-OG 2.93Å
95	A	75.1	Confident	75.6	Confident	16 Å²	16	95.9 Å²	95.9	13%	0.132	48%	0.476	C	S	.	.	H	α-helix	trans	-70.4	-35.8	177.9	0	0	0	0	0	113.5	C91 F92 E93 S97 H98 V107	C91-A95 WeakPolarHBondContact O-CB 3.28Å; C91-A95 PolarHBondContact O-N 3.49Å; C91-A95 VanDerWaalsContact O-N 3.13Å; F92-A95 PolarHBondContact O-N 2.95Å; E93-A95 VanDerWaalsContact C-N 3.26Å; E93-A95 PolarHBondContact O-N 3.46Å; A95-S97 PolarHBondContact O-N 3.42Å; A95-H98 CarbonylContact O-C 3.58Å; A95-H98 PolarHBondContact O-N 3.38Å; A95-H98 VanDerWaalsContact O-N 3.09Å; A95-H98 VanDerWaalsContact O-O 3.08Å; A95-V107 HydrophobicContact CB-CB 4.11Å; A95-V107 HydrophobicContact CB-CG1 3.94Å; A95-V107 HydrophobicContact CB-CG2 3.13Å
96	Q	72	Confident	75	Confident	152 Å²	152	97.8 Å²	97.8	71%	0.71	49%	0.491	S	S	*	.	H	α-helix	trans	-62.7	-25.7	174.9	-74.5	177.1	26.2	0	0	112.6	F92 E93 H98	F92-Q96 WeakPolarHBondContact O-CG 3.37Å; F92-Q96 PolarHBondContact O-N 3.21Å; E93-Q96 PolarHBondContact O-N 3.48Å; Q96-H98 VanDerWaalsContact C-N 3.31Å
97	S	70.1	Confident	74.7	Confident	83 Å²	83	94.9 Å²	94.9	58%	0.58	48%	0.479	S	S	*	.	H	α-helix	trans	-72.3	-22.2	175.4	77.8	0	0	0	0	113.8	E93 V94 A95	E93-S97 PolarHBondContact O-N 2.97Å; V94-S97 PolarHBondContact O-N 2.9Å; V94-S97 PolarHBondContact O-OG 2.93Å; A95-S97 PolarHBondContact O-N 3.42Å
98	H	64.9	Low	74.5	Confident	122 Å²	122	98.9 Å²	98.9	57%	0.565	49%	0.49	S	S	*	.	S	Bend	trans	-103.6	97.2	176.4	-71.4	-72.4	0	0	0	110.5	A95 Q96 D100	A95-H98 CarbonylContact O-C 3.58Å; A95-H98 PolarHBondContact O-N 3.38Å; A95-H98 VanDerWaalsContact O-N 3.09Å; A95-H98 VanDerWaalsContact O-O 3.08Å; Q96-H98 VanDerWaalsContact C-N 3.31Å; H98-D100 PolarHBondContact O-N 2.7Å
99	R	60.1	Low	74.4	Confident	230 Å²	230	101 Å²	101	87%	0.868	50%	0.502	S	S	*	.			trans	-68.2	20.1	-170.5	-68.1	-175.1	175.6	-178	-0.8	117.2
100	D	61.8	Low	74.3	Confident	119 Å²	119	98.7 Å²	98.7	64%	0.636	50%	0.495	S	S	*	.			trans	-88.9	128.9	-178.7	-65.5	-33.2	0	0	0	110.7	H98 D102 S103	H98-D100 PolarHBondContact O-N 2.7Å; D100-D102 PolarHBondContact O-N 3.22Å; D100-S103 WeakPolarHBondContact O-CA 3.15Å; D100-S103 WeakPolarHBondContact O-CB 3.42Å; D100-S103 PolarHBondContact O-N 2.9Å; D100-S103 PolarHBondContact O-OG 2.8Å
101	H	58.9	Low	74.4	Confident	179 Å²	179	95 Å²	95	83%	0.829	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.6	-176.2	-87.3	-75.3	0	0	0	114.6	S103	H101-S103 PolarHBondContact O-N 3.25Å
102	D	60.9	Low	74.6	Confident	152 Å²	152	96.8 Å²	96.8	81%	0.813	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-4.9	169.3	-73	-36.3	0	0	0	112.9	D100 I104	D100-D102 PolarHBondContact O-N 3.22Å; D102-I104 VanDerWaalsContact C-N 3.34Å; D102-I104 PolarHBondContact O-N 3.4Å
103	S	63.7	Low	74.7	Confident	32 Å²	32	101 Å²	101	22%	0.224	50%	0.503	C	S	.	.	H	α-helix	trans	-61.8	-32.8	-178.3	57.9	0	0	0	0	113.7	D100 H101 K105 S106 V107	D100-S103 WeakPolarHBondContact O-CA 3.15Å; D100-S103 WeakPolarHBondContact O-CB 3.42Å; D100-S103 PolarHBondContact O-N 2.9Å; D100-S103 PolarHBondContact O-OG 2.8Å; H101-S103 PolarHBondContact O-N 3.25Å; S103-K105 PolarHBondContact O-N 2.97Å; S103-S106 CarbonylContact O-C 3.26Å; S103-S106 WeakPolarHBondContact O-CA 3.5Å; S103-S106 WeakPolarHBondContact O-CB 3.3Å; S103-S106 PolarHBondContact O-N 2.87Å; S103-V107 WeakPolarHBondContact O-CG2 3.4Å; S103-V107 PolarHBondContact O-N 3.24Å
104	I	70.3	Confident	74.9	Confident	101 Å²	101	100.9 Å²	100.9	52%	0.518	50%	0.501	S	S	.	.	H	α-helix	trans	-60.5	-46.4	-170.2	-61.4	176.9	0	0	0	111.9	D102 S106 V107 Y108	D102-I104 VanDerWaalsContact C-N 3.34Å; D102-I104 PolarHBondContact O-N 3.4Å; I104-S106 VanDerWaalsContact C-N 3.31Å; I104-S106 PolarHBondContact O-N 2.95Å; I104-V107 PolarHBondContact O-N 3.38Å; I104-Y108 HydrophobicContact CG2-CD2 3.91Å; I104-Y108 HydrophobicContact CG2-CE2 3.46Å; I104-Y108 VanDerWaalsContact CG2-CE2 3.46Å; I104-Y108 WeakPolarHBondContact O-CD2 3.28Å; I104-Y108 PolarHBondContact O-N 3.33Å; I104-Y108 VanDerWaalsContact O-N 3.16Å
105	K	76.3	Confident	75.3	Confident	169 Å²	169	96.9 Å²	96.9	74%	0.735	48%	0.477	S	S	*	.	H	α-helix	trans	-63.9	-40.9	175.3	-69.5	-178.8	-179.2	174.5	0	110.8	S103 V107 Y108 D109	S103-K105 PolarHBondContact O-N 2.97Å; K105-V107 VanDerWaalsContact C-N 3.28Å; K105-V107 PolarHBondContact O-N 3.49Å; K105-Y108 PolarHBondContact O-N 3.05Å; K105-D109 WeakPolarHBondContact O-CB 3.32Å; K105-D109 PolarHBondContact O-N 3.19Å
106	S	76.3	Confident	76	Confident	77 Å²	77	99.2 Å²	99.2	54%	0.538	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-35.5	174.7	-166.9	0	0	0	0	112.4	S103 I104 D109 A110	S103-S106 CarbonylContact O-C 3.26Å; S103-S106 WeakPolarHBondContact O-CA 3.5Å; S103-S106 WeakPolarHBondContact O-CB 3.3Å; S103-S106 PolarHBondContact O-N 2.87Å; I104-S106 VanDerWaalsContact C-N 3.31Å; I104-S106 PolarHBondContact O-N 2.95Å; S106-D109 PolarHBondContact O-N 3.4Å; S106-A110 VanDerWaalsContact O-CB 3.3Å; S106-A110 WeakPolarHBondContact O-CB 3.4Å; S106-A110 PolarHBondContact O-N 2.95Å
107	V	81.4	Confident	76.8	Confident	9 Å²	9	92.5 Å²	92.5	6%	0.055	46%	0.456	C	S	.	.	H	α-helix	trans	-67.3	-48.9	176.5	-166.5	0	0	0	0	110.7	F92 A95 S103 I104 K105 D109 A110 V111	F92-V107 HydrophobicContact CD1-CG1 3.66Å; F92-V107 HydrophobicContact CE1-CG1 3.75Å; F92-V107 HydrophobicContact CG-CG1 4.13Å; F92-V107 HydrophobicContact CZ-CG1 4.28Å; A95-V107 HydrophobicContact CB-CB 4.11Å; A95-V107 HydrophobicContact CB-CG1 3.94Å; A95-V107 HydrophobicContact CB-CG2 3.13Å; S103-V107 WeakPolarHBondContact O-CG2 3.4Å; S103-V107 PolarHBondContact O-N 3.24Å; I104-V107 PolarHBondContact O-N 3.38Å; K105-V107 VanDerWaalsContact C-N 3.28Å; K105-V107 PolarHBondContact O-N 3.49Å; V107-D109 VanDerWaalsContact C-N 3.27Å; V107-D109 PolarHBondContact O-N 2.81Å; V107-A110 CarbonylContact O-C 3.59Å; V107-A110 WeakPolarHBondContact O-CB 3.43Å; V107-A110 PolarHBondContact O-N 3.4Å; V107-A110 VanDerWaalsContact O-N 3.09Å; V107-V111 HydrophobicContact CG1-CG2 4.36Å; V107-V111 WeakPolarHBondContact O-CG2 3.48Å; V107-V111 PolarHBondContact O-N 3.29Å
108	Y	83.5	Confident	77.7	Confident	130 Å²	130	89.2 Å²	89.2	51%	0.51	43%	0.433	S	S	.	.	H	α-helix	trans	-63.3	-37	178.2	-69.6	-63.5	0	0	0	111.4	F92 I104 K105 V111 L112	F92-Y108 HydrophobicContact CZ-CE1 4.03Å; I104-Y108 HydrophobicContact CG2-CD2 3.91Å; I104-Y108 HydrophobicContact CG2-CE2 3.46Å; I104-Y108 VanDerWaalsContact CG2-CE2 3.46Å; I104-Y108 WeakPolarHBondContact O-CD2 3.28Å; I104-Y108 PolarHBondContact O-N 3.33Å; I104-Y108 VanDerWaalsContact O-N 3.16Å; K105-Y108 PolarHBondContact O-N 3.05Å; Y108-V111 PolarHBondContact O-N 3.38Å; Y108-L112 VanDerWaalsContact O-CB 3.32Å; Y108-L112 WeakPolarHBondContact O-CB 3.42Å; Y108-L112 WeakPolarHBondContact O-CG 3.25Å; Y108-L112 PolarHBondContact O-N 3.01Å
109	D	84.5	Confident	78.9	Confident	87 Å²	87	87.9 Å²	87.9	47%	0.465	43%	0.427	S	S	.	.	H	α-helix	trans	-66.3	-36.5	172.8	-72.8	-25.5	0	0	0	112.1	K105 S106 V107 K113	K105-D109 WeakPolarHBondContact O-CB 3.32Å; K105-D109 PolarHBondContact O-N 3.19Å; S106-D109 PolarHBondContact O-N 3.4Å; V107-D109 VanDerWaalsContact C-N 3.27Å; V107-D109 PolarHBondContact O-N 2.81Å; D109-K113 VanDerWaalsContact O-CG 3.27Å; D109-K113 WeakPolarHBondContact O-CG 3.34Å; D109-K113 PolarHBondContact O-N 3.36Å
110	A	84.1	Confident	80.3	Confident	34 Å²	34	77.5 Å²	77.5	28%	0.281	39%	0.39	S	S	.	.	H	α-helix	trans	-68.1	-42	174	0	0	0	0	0	112	S106 V107 K113 K114	S106-A110 VanDerWaalsContact O-CB 3.3Å; S106-A110 WeakPolarHBondContact O-CB 3.4Å; S106-A110 PolarHBondContact O-N 2.95Å; V107-A110 CarbonylContact O-C 3.59Å; V107-A110 WeakPolarHBondContact O-CB 3.43Å; V107-A110 PolarHBondContact O-N 3.4Å; V107-A110 VanDerWaalsContact O-N 3.09Å; A110-K113 PolarHBondContact O-N 3.32Å; A110-K113 VanDerWaalsContact O-N 3.14Å; A110-K114 WeakPolarHBondContact O-CB 3.48Å; A110-K114 PolarHBondContact O-N 2.81Å
111	V	87.8	Confident	81.7	Confident	11 Å²	11	74 Å²	74	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-44.2	174.4	168.9	0	0	0	0	110.2	M88 C91 F92 V107 Y108 K113 K114 S115 A118	M88-V111 HydrophobicContact CE-CG1 4.38Å; M88-V111 HydrophobicContact CG-CG1 3.9Å; M88-V111 HydrophobicContact SD-CG1 4.43Å; C91-V111 HydrophobicContact CB-CG2 3.74Å; F92-V111 HydrophobicContact CE2-CG2 4.2Å; V107-V111 HydrophobicContact CG1-CG2 4.36Å; V107-V111 WeakPolarHBondContact O-CG2 3.48Å; V107-V111 PolarHBondContact O-N 3.29Å; Y108-V111 PolarHBondContact O-N 3.38Å; V111-K113 PolarHBondContact O-N 3.17Å; V111-K114 PolarHBondContact O-N 3.42Å; V111-S115 WeakPolarHBondContact O-CB 3.36Å; V111-S115 PolarHBondContact O-N 3.27Å; V111-A118 HydrophobicContact CG1-CB 3.99Å
112	L	87.7	Confident	83.2	Confident	42 Å²	42	70.7 Å²	70.7	22%	0.22	35%	0.354	C	S	.	.	H	α-helix	trans	-64.1	-27.8	174.7	-75.5	171.4	0	0	0	112.5	Y108 A118 Q119 K122	Y108-L112 VanDerWaalsContact O-CB 3.32Å; Y108-L112 WeakPolarHBondContact O-CB 3.42Å; Y108-L112 WeakPolarHBondContact O-CG 3.25Å; Y108-L112 PolarHBondContact O-N 3.01Å; L112-A118 HydrophobicContact CD2-CB 3.97Å; L112-Q119 VanDerWaalsContact O-CD 3.28Å; L112-Q119 WeakPolarHBondContact O-CG 3.4Å; L112-Q119 PolarHBondContact O-NE2 3.34Å; L112-K122 HydrophobicContact CD1-CD 3.96Å; L112-K122 HydrophobicContact CD2-CB 4.03Å; L112-K122 HydrophobicContact CD2-CD 3.74Å; L112-K122 HydrophobicContact CG-CD 4.49Å
113	K	86.8	Confident	84.5	Confident	165 Å²	165	67.5 Å²	67.5	72%	0.717	33%	0.334	S	S	*	.	H	α-helix	trans	-79.4	-32.6	175.6	-75.3	170.9	-175.8	176.6	0	112.9	D109 A110 V111 Q119	D109-K113 VanDerWaalsContact O-CG 3.27Å; D109-K113 WeakPolarHBondContact O-CG 3.34Å; D109-K113 PolarHBondContact O-N 3.36Å; A110-K113 PolarHBondContact O-N 3.32Å; A110-K113 VanDerWaalsContact O-N 3.14Å; V111-K113 PolarHBondContact O-N 3.17Å; K113-Q119 PolarHBondContact O-NE2 2.76Å
114	K	87.3	Confident	85.6	Confident	124 Å²	124	66 Å²	66	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-97.7	-37.2	-172.5	-73.7	173.4	167	-172.6	0	114.3	V87 C91 A110 V111	V87-K114 HydrophobicContact CG1-CB 3.88Å; C91-K114 WeakPolarHBondContact SG-CD 3.32Å; A110-K114 WeakPolarHBondContact O-CB 3.48Å; A110-K114 PolarHBondContact O-N 2.81Å; V111-K114 PolarHBondContact O-N 3.42Å
115	S	87.8	Confident	86.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.007	31%	0.312	C	S	.	.			trans	-91.6	120	-177	178.4	0	0	0	0	111.4	Q84 M88 V111 L117 A118 Q119	Q84-S115 PolarHBondContact OE1-OG 3.32Å; M88-S115 WeakPolarHBondContact CE-OG 3.45Å; V111-S115 WeakPolarHBondContact O-CB 3.36Å; V111-S115 PolarHBondContact O-N 3.27Å; S115-L117 VanDerWaalsContact C-N 3.3Å; S115-L117 PolarHBondContact O-N 3.19Å; S115-L117 PolarHBondContact OG-N 3.46Å; S115-A118 PolarHBondContact O-N 3.14Å; S115-A118 PolarHBondContact OG-N 2.94Å; S115-Q119 WeakPolarHBondContact O-CG 3.49Å; S115-Q119 PolarHBondContact O-N 3.14Å
116	N	89.3	Confident	86.8	Confident	65 Å²	65	58.9 Å²	58.9	35%	0.348	29%	0.294	S	S	.	.	H	α-helix	trans	-63.9	-37.6	173.2	-176.6	-12.7	0	0	0	110.9	Y80 A118 Q119 T120	Y80-N116 WeakPolarHBondContact OH-CB 3.33Å; N116-A118 PolarHBondContact O-N 3Å; N116-Q119 PolarHBondContact O-N 3.02Å; N116-T120 WeakPolarHBondContact O-CB 3.4Å; N116-T120 PolarHBondContact O-N 3.39Å; N116-T120 PolarHBondContact O-OG1 3.32Å; N116-T120 PolarHBondContact OD1-OG1 3.01Å
117	L	89.9	Confident	87.1	Confident	10 Å²	10	56 Å²	56	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-44.9	176.5	178	61.6	0	0	0	111.7	I71 Y80 L81 Q84 M88 S115 T120 L121	I71-L117 HydrophobicContact CD1-CD1 3.76Å; I71-L117 HydrophobicContact CG1-CD1 4.01Å; Y80-L117 HydrophobicContact CE1-CB 4.08Å; Y80-L117 HydrophobicContact CE1-CD1 4.31Å; Y80-L117 PolarHBondContact OH-N 3.34Å; L81-L117 HydrophobicContact CD1-CD2 3.73Å; Q84-L117 HydrophobicContact CB-CB 4.19Å; Q84-L117 HydrophobicContact CB-CD2 4.38Å; Q84-L117 HydrophobicContact CG-CB 4.01Å; M88-L117 HydrophobicContact CE-CB 4.38Å; M88-L117 HydrophobicContact CE-CD2 4.32Å; S115-L117 VanDerWaalsContact C-N 3.3Å; S115-L117 PolarHBondContact O-N 3.19Å; S115-L117 PolarHBondContact OG-N 3.46Å; L117-T120 PolarHBondContact O-N 3.32Å; L117-L121 HydrophobicContact CD1-CD1 4.15Å; L117-L121 HydrophobicContact CD1-CG 4.21Å; L117-L121 HydrophobicContact CG-CD1 4.18Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 2.94Å
118	A	88.2	Confident	87.2	Confident	14 Å²	14	55.8 Å²	55.8	12%	0.116	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-39.9	178.8	0	0	0	0	0	112.2	M88 V111 L112 S115 N116 K122	M88-A118 HydrophobicContact CE-CB 4.1Å; V111-A118 HydrophobicContact CG1-CB 3.99Å; L112-A118 HydrophobicContact CD2-CB 3.97Å; S115-A118 PolarHBondContact O-N 3.14Å; S115-A118 PolarHBondContact OG-N 2.94Å; N116-A118 PolarHBondContact O-N 3Å; A118-K122 WeakPolarHBondContact O-CB 3.39Å; A118-K122 PolarHBondContact O-N 3.39Å
119	Q	90.3	Very high	87.1	Confident	94 Å²	94	53 Å²	53	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-62.1	-45.7	173.9	-69.9	179	2.2	0	0	111.5	L112 K113 S115 N116 K122 Q123	L112-Q119 VanDerWaalsContact O-CD 3.28Å; L112-Q119 WeakPolarHBondContact O-CG 3.4Å; L112-Q119 PolarHBondContact O-NE2 3.34Å; K113-Q119 PolarHBondContact O-NE2 2.76Å; S115-Q119 WeakPolarHBondContact O-CG 3.49Å; S115-Q119 PolarHBondContact O-N 3.14Å; N116-Q119 PolarHBondContact O-N 3.02Å; Q119-K122 PolarHBondContact O-N 2.94Å; Q119-Q123 VanDerWaalsContact O-CB 3.26Å; Q119-Q123 WeakPolarHBondContact O-CB 2.91Å; Q119-Q123 PolarHBondContact O-N 3.5Å
120	T	89.8	Confident	86.7	Confident	13 Å²	13	56.9 Å²	56.9	8%	0.08	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-44	-178.8	-56	0	0	0	0	111.4	F67 N116 L117 Q123 G124 L136 V138	F67-T120 HydrophobicContact CE1-CG2 3.84Å; F67-T120 HydrophobicContact CZ-CG2 4.39Å; N116-T120 WeakPolarHBondContact O-CB 3.4Å; N116-T120 PolarHBondContact O-N 3.39Å; N116-T120 PolarHBondContact O-OG1 3.32Å; N116-T120 PolarHBondContact OD1-OG1 3.01Å; L117-T120 PolarHBondContact O-N 3.32Å; T120-Q123 PolarHBondContact O-N 3.42Å; T120-G124 PolarHBondContact O-N 3.35Å; T120-L136 HydrophobicContact CG2-CB 4.21Å; T120-L136 HydrophobicContact CG2-CD1 4.31Å; T120-L136 WeakPolarHBondContact O-CD1 3.43Å; T120-V138 HydrophobicContact CG2-CG2 4.44Å
121	L	90.5	Very high	86.1	Confident	44 Å²	44	56.8 Å²	56.8	23%	0.23	27%	0.268	C	S	.	.	H	α-helix	trans	-65.3	-42.2	176.8	-71.9	174.5	0	0	0	112.3	V44 F67 L117 Q123 G124 F125	V44-L121 HydrophobicContact CG1-CD2 4.05Å; F67-L121 HydrophobicContact CB-CD2 4.28Å; F67-L121 HydrophobicContact CD1-CD2 3.92Å; F67-L121 HydrophobicContact CD2-CD2 4.04Å; F67-L121 HydrophobicContact CE1-CD2 4.27Å; F67-L121 HydrophobicContact CE2-CD2 4.35Å; F67-L121 HydrophobicContact CG-CD2 3.81Å; F67-L121 HydrophobicContact CZ-CD2 4.47Å; L117-L121 HydrophobicContact CD1-CD1 4.15Å; L117-L121 HydrophobicContact CD1-CG 4.21Å; L117-L121 HydrophobicContact CG-CD1 4.18Å; L117-L121 WeakPolarHBondContact O-CG 3.33Å; L117-L121 PolarHBondContact O-N 2.94Å; L121-Q123 VanDerWaalsContact C-N 3.35Å; L121-G124 PolarHBondContact O-N 3.32Å; L121-F125 PolarHBondContact O-N 3.07Å
122	K	90.3	Very high	85.5	Confident	111 Å²	111	56.2 Å²	56.2	48%	0.483	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-45.4	174.9	178	178.5	176.1	178.8	0	110.9	L112 A118 Q119 G124 F125 V126	L112-K122 HydrophobicContact CD1-CD 3.96Å; L112-K122 HydrophobicContact CD2-CB 4.03Å; L112-K122 HydrophobicContact CD2-CD 3.74Å; L112-K122 HydrophobicContact CG-CD 4.49Å; A118-K122 WeakPolarHBondContact O-CB 3.39Å; A118-K122 PolarHBondContact O-N 3.39Å; Q119-K122 PolarHBondContact O-N 2.94Å; K122-G124 VanDerWaalsContact C-N 3.35Å; K122-F125 PolarHBondContact O-N 3.03Å; K122-V126 HydrophobicContact CG-CG2 4.4Å; K122-V126 WeakPolarHBondContact O-CG2 3.36Å; K122-V126 PolarHBondContact O-N 3.4Å
123	Q	88.6	Confident	84.9	Confident	84 Å²	84	55.7 Å²	55.7	39%	0.393	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-43.5	179.3	-171.1	62.6	23.7	0	0	110.8	Q119 T120 L121 F125 V126 D127 L136	Q119-Q123 VanDerWaalsContact O-CB 3.26Å; Q119-Q123 WeakPolarHBondContact O-CB 2.91Å; Q119-Q123 PolarHBondContact O-N 3.5Å; T120-Q123 PolarHBondContact O-N 3.42Å; L121-Q123 VanDerWaalsContact C-N 3.35Å; Q123-F125 VanDerWaalsContact C-N 3.33Å; Q123-F125 PolarHBondContact O-N 2.69Å; Q123-V126 PolarHBondContact O-N 2.77Å; Q123-D127 WeakPolarHBondContact CG-OD2 3.39Å; Q123-D127 PolarHBondContact NE2-OD1 3.49Å; Q123-D127 PolarHBondContact NE2-OD2 3.13Å; Q123-D127 VanDerWaalsContact O-CB 3.26Å; Q123-D127 WeakPolarHBondContact O-CB 3.27Å; Q123-D127 PolarHBondContact O-N 2.9Å; Q123-L136 HydrophobicContact CB-CD1 4.02Å; Q123-L136 HydrophobicContact CB-CD2 4.35Å; Q123-L136 HydrophobicContact CG-CD1 4.07Å; Q123-L136 HydrophobicContact CG-CD2 3.68Å
124	G	86.4	Confident	84.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-40.6	177.1	0	0	0	0	0	112.7	T120 L121 K122 L128 V134	T120-G124 PolarHBondContact O-N 3.35Å; L121-G124 PolarHBondContact O-N 3.32Å; K122-G124 VanDerWaalsContact C-N 3.35Å; G124-L128 WeakPolarHBondContact O-CB 3.45Å; G124-L128 PolarHBondContact O-N 2.89Å; G124-L128 VanDerWaalsContact O-N 3.11Å; G124-V134 WeakPolarHBondContact O-CG2 3.46Å
125	F	86.5	Confident	84.2	Confident	64 Å²	64	44.6 Å²	44.6	28%	0.281	22%	0.222	S	C	.	.	H	α-helix	trans	-65.4	-47.4	174.9	-178.6	-99.3	0	0	0	112.4	F46 I48 F60 L121 K122 Q123 L129	F46-F125 AromaticContact CD1-CD2 3.92Å; F46-F125 HydrophobicContact CD1-CD2 3.92Å; F46-F125 HydrophobicContact CE1-CB 4.3Å; F46-F125 HydrophobicContact CE1-CD2 4.49Å; I48-F125 HydrophobicContact CG2-CE2 4.33Å; F60-F125 AromaticContact CE1-CD2 3.61Å; F60-F125 HydrophobicContact CE1-CD2 3.61Å; F60-F125 AromaticContact CE1-CE2 3.91Å; F60-F125 HydrophobicContact CE1-CE2 3.91Å; F60-F125 HydrophobicContact CZ-CD2 4.09Å; F60-F125 HydrophobicContact CZ-CE2 4.01Å; L121-F125 PolarHBondContact O-N 3.07Å; K122-F125 PolarHBondContact O-N 3.03Å; Q123-F125 VanDerWaalsContact C-N 3.33Å; Q123-F125 PolarHBondContact O-N 2.69Å; F125-L129 HydrophobicContact CD1-CD1 3.86Å; F125-L129 HydrophobicContact CE1-CD1 3.29Å; F125-L129 HydrophobicContact CE1-CG 4.41Å; F125-L129 HydrophobicContact CE2-CD1 4.15Å; F125-L129 HydrophobicContact CZ-CD1 3.46Å; F125-L129 VanDerWaalsContact CZ-CD1 3.46Å; F125-L129 HydrophobicContact CZ-CG 4.41Å; F125-L129 WeakPolarHBondContact O-CG 3.27Å; F125-L129 PolarHBondContact O-N 2.8Å; F125-L129 VanDerWaalsContact O-N 3.14Å
126	V	86.2	Confident	84	Confident	57 Å²	57	45.8 Å²	45.8	35%	0.345	23%	0.229	S	C	.	.	H	α-helix	trans	-67.2	-40.2	-179.2	171.8	0	0	0	0	111.5	K122 Q123 L129 R130	K122-V126 HydrophobicContact CG-CG2 4.4Å; K122-V126 WeakPolarHBondContact O-CG2 3.36Å; K122-V126 PolarHBondContact O-N 3.4Å; Q123-V126 PolarHBondContact O-N 2.77Å; V126-L129 PolarHBondContact O-N 3.28Å; V126-R130 VanDerWaalsContact O-CB 3.23Å; V126-R130 WeakPolarHBondContact O-CB 3.36Å; V126-R130 PolarHBondContact O-N 2.85Å
127	D	83.1	Confident	83.7	Confident	18 Å²	18	45.6 Å²	45.6	10%	0.096	23%	0.231	C	C	.	.	H	α-helix	trans	-69.1	-38.9	-179.5	-77.1	-22	0	0	0	111.6	Q123 L129 R130 T131 G132 V134	Q123-D127 WeakPolarHBondContact CG-OD2 3.39Å; Q123-D127 PolarHBondContact NE2-OD1 3.49Å; Q123-D127 PolarHBondContact NE2-OD2 3.13Å; Q123-D127 VanDerWaalsContact O-CB 3.26Å; Q123-D127 WeakPolarHBondContact O-CB 3.27Å; Q123-D127 PolarHBondContact O-N 2.9Å; D127-L129 VanDerWaalsContact C-N 3.33Å; D127-L129 PolarHBondContact O-N 3.37Å; D127-R130 PolarHBondContact O-N 3.14Å; D127-R130 IonicContact OD1-NH2 3.28Å; D127-R130 PolarHBondContact OD1-NH2 3.11Å; D127-T131 WeakPolarHBondContact O-CA 3.46Å; D127-T131 PolarHBondContact O-N 2.86Å; D127-T131 PolarHBondContact O-OG1 2.79Å; D127-G132 PolarHBondContact O-N 2.89Å; D127-V134 HydrophobicContact CB-CG2 4.35Å
128	L	83.3	Confident	83.2	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-40.5	172.9	-158.9	75.4	0	0	0	111.5	F60 L63 G124 G132 V134 V148 L156	F60-L128 HydrophobicContact CD1-CD2 3.58Å; F60-L128 HydrophobicContact CD2-CD2 3.88Å; F60-L128 HydrophobicContact CE1-CB 4.45Å; F60-L128 HydrophobicContact CE1-CD2 3.46Å; F60-L128 VanDerWaalsContact CE1-CD2 3.46Å; F60-L128 HydrophobicContact CE2-CD2 3.77Å; F60-L128 HydrophobicContact CG-CD2 3.79Å; F60-L128 HydrophobicContact CZ-CB 4.47Å; F60-L128 HydrophobicContact CZ-CD2 3.58Å; F60-L128 HydrophobicContact CZ-CG 4.41Å; L63-L128 HydrophobicContact CD2-CB 4.43Å; L63-L128 HydrophobicContact CD2-CD2 3.99Å; G124-L128 WeakPolarHBondContact O-CB 3.45Å; G124-L128 PolarHBondContact O-N 2.89Å; G124-L128 VanDerWaalsContact O-N 3.11Å; L128-G132 VanDerWaalsContact O-CA 3.27Å; L128-G132 WeakPolarHBondContact O-CA 3.39Å; L128-G132 PolarHBondContact O-N 3.12Å; L128-G132 VanDerWaalsContact O-N 3.12Å; L128-V134 HydrophobicContact CB-CG2 3.83Å; L128-V134 HydrophobicContact CD1-CG2 3.76Å; L128-V134 HydrophobicContact CG-CG2 4.41Å; L128-V148 HydrophobicContact CD1-CG2 3.45Å; L128-V148 VanDerWaalsContact CD1-CG2 3.45Å; L128-V148 HydrophobicContact CG-CG2 4Å; L128-L156 WeakPolarHBondContact O-CD1 3.13Å
129	L	80.4	Confident	82.9	Confident	71 Å²	71	47.3 Å²	47.3	37%	0.372	24%	0.239	S	C	.	.	H	α-helix	trans	-74.4	-32.4	178.8	-72.6	179.5	0	0	0	114.2	F60 F125 V126 D127 L156	F60-L129 HydrophobicContact CE2-CD2 4.41Å; F60-L129 HydrophobicContact CZ-CD2 4.04Å; F60-L129 HydrophobicContact CZ-CG 4.28Å; F125-L129 HydrophobicContact CD1-CD1 3.86Å; F125-L129 HydrophobicContact CE1-CD1 3.29Å; F125-L129 HydrophobicContact CE1-CG 4.41Å; F125-L129 HydrophobicContact CE2-CD1 4.15Å; F125-L129 HydrophobicContact CZ-CD1 3.46Å; F125-L129 VanDerWaalsContact CZ-CD1 3.46Å; F125-L129 HydrophobicContact CZ-CG 4.41Å; F125-L129 WeakPolarHBondContact O-CG 3.27Å; F125-L129 PolarHBondContact O-N 2.8Å; F125-L129 VanDerWaalsContact O-N 3.14Å; V126-L129 PolarHBondContact O-N 3.28Å; D127-L129 VanDerWaalsContact C-N 3.33Å; D127-L129 PolarHBondContact O-N 3.37Å; L129-L156 WeakPolarHBondContact O-CB 3.5Å; L129-L156 WeakPolarHBondContact O-CD1 3.04Å
130	R	76.2	Confident	82.3	Confident	169 Å²	169	45.8 Å²	45.8	64%	0.638	25%	0.249	S	C	*	.	H	α-helix	trans	-92.9	-38	-174.5	-175	-177.4	63.7	88.9	3.9	112.8	V126 D127	V126-R130 VanDerWaalsContact O-CB 3.23Å; V126-R130 WeakPolarHBondContact O-CB 3.36Å; V126-R130 PolarHBondContact O-N 2.85Å; D127-R130 PolarHBondContact O-N 3.14Å; D127-R130 IonicContact OD1-NH2 3.28Å; D127-R130 PolarHBondContact OD1-NH2 3.11Å
131	T	72	Confident	81.7	Confident	31 Å²	31	52.7 Å²	52.7	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-121.1	-9.6	-172	64.3	0	0	0	0	113.4	D127 T133 S153	D127-T131 WeakPolarHBondContact O-CA 3.46Å; D127-T131 PolarHBondContact O-N 2.86Å; D127-T131 PolarHBondContact O-OG1 2.79Å; T131-T133 PolarHBondContact O-N 3.32Å; T131-T133 PolarHBondContact OG1-N 3.32Å; T131-T133 PolarHBondContact OG1-O 3.12Å; T131-T133 VanDerWaalsContact OG1-O 3.05Å; T131-T133 PolarHBondContact OG1-OG1 3.24Å; T131-S153 WeakPolarHBondContact O-CB 3.44Å; T131-S153 PolarHBondContact O-OG 3.05Å
132	G	74	Confident	81.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	63.4	0.3	-170.1	0	0	0	0	0	115.2	D127 L128 N147 V148	D127-G132 PolarHBondContact O-N 2.89Å; L128-G132 VanDerWaalsContact O-CA 3.27Å; L128-G132 WeakPolarHBondContact O-CA 3.39Å; L128-G132 PolarHBondContact O-N 3.12Å; L128-G132 VanDerWaalsContact O-N 3.12Å; G132-N147 PolarHBondContact O-OD1 3.2Å; G132-V148 WeakPolarHBondContact O-CG2 3.38Å; G132-V148 PolarHBondContact O-N 2.78Å
133	T	75.2	Confident	80.7	Confident	30 Å²	30	48.6 Å²	48.6	18%	0.184	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.8	-178.4	70.4	0	0	0	0	109.9	T131 W146 N147	T131-T133 PolarHBondContact O-N 3.32Å; T131-T133 PolarHBondContact OG1-N 3.32Å; T131-T133 PolarHBondContact OG1-O 3.12Å; T131-T133 VanDerWaalsContact OG1-O 3.05Å; T131-T133 PolarHBondContact OG1-OG1 3.24Å; T133-W146 CarbonylContact C-O 3.59Å; T133-N147 WeakPolarHBondContact CG2-ND2 3.34Å
134	V	79.9	Confident	80.3	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.6	173.6	-177.3	0	0	0	0	107.4	L63 G124 D127 L128 L136 S145 W146	L63-V134 HydrophobicContact CD1-CB 4.18Å; L63-V134 HydrophobicContact CD1-CG1 4.01Å; L63-V134 HydrophobicContact CD1-CG2 4.29Å; L63-V134 HydrophobicContact CD2-CG2 4.14Å; G124-V134 WeakPolarHBondContact O-CG2 3.46Å; D127-V134 HydrophobicContact CB-CG2 4.35Å; L128-V134 HydrophobicContact CB-CG2 3.83Å; L128-V134 HydrophobicContact CD1-CG2 3.76Å; L128-V134 HydrophobicContact CG-CG2 4.41Å; V134-L136 HydrophobicContact CG1-CB 4.46Å; V134-L136 HydrophobicContact CG1-CD1 3.77Å; V134-L136 HydrophobicContact CG1-CG 3.89Å; V134-S145 CarbonylContact O-C 3.48Å; V134-S145 WeakPolarHBondContact O-CA 3.26Å; V134-W146 PolarHBondContact N-O 3.5Å; V134-W146 PolarHBondContact O-N 3.35Å; V134-W146 VanDerWaalsContact O-O 3.13Å
135	S	80.5	Confident	80	Confident	55 Å²	55	46.1 Å²	46.1	39%	0.385	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	100.2	168.6	163	0	0	0	0	105.3	E143	S135-E143 WeakPolarHBondContact CB-OE1 3.26Å; S135-E143 PolarHBondContact OG-OE1 3.16Å
136	L	83.4	Confident	79.8	Confident	27 Å²	27	46 Å²	46	14%	0.141	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	140.2	-173.8	-64.8	174.7	0	0	0	109.8	F67 T120 Q123 V134 E143 V144	F67-L136 HydrophobicContact CZ-CD1 4.23Å; T120-L136 HydrophobicContact CG2-CB 4.21Å; T120-L136 HydrophobicContact CG2-CD1 4.31Å; T120-L136 WeakPolarHBondContact O-CD1 3.43Å; Q123-L136 HydrophobicContact CB-CD1 4.02Å; Q123-L136 HydrophobicContact CB-CD2 4.35Å; Q123-L136 HydrophobicContact CG-CD1 4.07Å; Q123-L136 HydrophobicContact CG-CD2 3.68Å; V134-L136 HydrophobicContact CG1-CB 4.46Å; V134-L136 HydrophobicContact CG1-CD1 3.77Å; V134-L136 HydrophobicContact CG1-CG 3.89Å; L136-E143 CarbonylContact O-C 3.58Å; L136-E143 WeakPolarHBondContact O-CA 3.23Å; L136-V144 PolarHBondContact N-O 2.75Å; L136-V144 PolarHBondContact O-N 3Å
137	C	82.8	Confident	79.3	Confident	60 Å²	60	43.6 Å²	43.6	41%	0.405	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	113	176.2	-62	0	0	0	0	110.9	N139 G140 I142	C137-N139 PolarHBondContact O-N 3.43Å; C137-G140 PolarHBondContact O-N 2.85Å; C137-I142 CarbonylContact C-O 3.52Å; C137-I142 WeakPolarHBondContact CA-O 3.47Å
138	V	80.6	Confident	78.7	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	123.3	169.9	-176.1	0	0	0	0	108.2	F67 A70 E74 Y80 T120 G140 W141 I142 V144	F67-V138 HydrophobicContact CD1-CG2 3.98Å; F67-V138 HydrophobicContact CE1-CG2 4.03Å; A70-V138 HydrophobicContact CB-CB 4.27Å; A70-V138 HydrophobicContact CB-CG2 3.87Å; E74-V138 HydrophobicContact CG-CG1 4.2Å; Y80-V138 HydrophobicContact CD1-CG1 4.48Å; Y80-V138 HydrophobicContact CE1-CG1 4.09Å; T120-V138 HydrophobicContact CG2-CG2 4.44Å; V138-G140 PolarHBondContact O-N 2.86Å; V138-G140 VanDerWaalsContact O-N 3.09Å; V138-W141 PolarHBondContact O-N 2.71Å; V138-W141 VanDerWaalsContact O-N 3.07Å; V138-I142 PolarHBondContact N-O 2.78Å; V138-I142 PolarHBondContact O-N 3.04Å; V138-V144 HydrophobicContact CG2-CG2 3.75Å
139	N	81.1	Confident	77.7	Confident	59 Å²	59	48 Å²	48	32%	0.316	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	25.7	-174.7	-159.5	27.4	0	0	0	114.5	E74 Y80 C137 W141	E74-N139 HydrophobicContact CG-CB 4.15Å; E74-N139 WeakPolarHBondContact OE2-CB 3.1Å; E74-N139 PolarHBondContact OE2-ND2 3.48Å; Y80-N139 HydrophobicContact CD2-CB 3.82Å; Y80-N139 VanDerWaalsContact CD2-CG 3.43Å; Y80-N139 HydrophobicContact CE2-CB 3.69Å; Y80-N139 VanDerWaalsContact CE2-CG 3.49Å; Y80-N139 WeakPolarHBondContact CE2-OD1 3.42Å; Y80-N139 HydrophobicContact CG-CB 4.28Å; C137-N139 PolarHBondContact O-N 3.43Å; N139-W141 PolarHBondContact O-N 3.5Å
140	G	77	Confident	76.4	Confident	63 Å²	63	47.3 Å²	47.3	65%	0.649	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.1	9.4	-177.4	0	0	0	0	0	115	C137 V138	C137-G140 PolarHBondContact O-N 2.85Å; V138-G140 PolarHBondContact O-N 2.86Å; V138-G140 VanDerWaalsContact O-N 3.09Å
141	W	77.4	Confident	75.2	Confident	157 Å²	157	46.3 Å²	46.3	60%	0.595	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-53.3	-175.9	-155.4	54.1	0	0	0	113.5	R77 V138 N139 E143	R77-W141 HydrophobicContact CG-CZ3 4.3Å; R77-W141 VanDerWaalsContact CZ-CH2 3.49Å; R77-W141 VanDerWaalsContact CZ-CZ2 3.44Å; R77-W141 VanDerWaalsContact CZ-CZ3 3.47Å; R77-W141 VanDerWaalsContact NE-CZ3 3.32Å; R77-W141 VanDerWaalsContact NH1-CE2 3.34Å; R77-W141 VanDerWaalsContact NH2-CZ2 3.3Å; V138-W141 PolarHBondContact O-N 2.71Å; V138-W141 VanDerWaalsContact O-N 3.07Å; N139-W141 PolarHBondContact O-N 3.5Å; W141-E143 PolarHBondContact O-N 3.31Å
142	I	78.8	Confident	73.9	Confident	38 Å²	38	47.2 Å²	47.2	20%	0.195	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	109.3	-177.2	-55.1	-175.9	0	0	0	109.3	A70 H73 E74 C137 V138 V144	A70-I142 HydrophobicContact CB-CB 4.21Å; A70-I142 HydrophobicContact CB-CG2 3.66Å; H73-I142 HydrophobicContact CB-CD1 3.3Å; E74-I142 HydrophobicContact CG-CD1 3.85Å; E74-I142 HydrophobicContact CG-CG1 4.22Å; C137-I142 CarbonylContact C-O 3.52Å; C137-I142 WeakPolarHBondContact CA-O 3.47Å; V138-I142 PolarHBondContact N-O 2.78Å; V138-I142 PolarHBondContact O-N 3.04Å; I142-V144 PolarHBondContact O-N 2.69Å
143	E	81.1	Confident	72.4	Confident	31 Å²	31	48.7 Å²	48.7	15%	0.145	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	119	173.9	-170.4	-161.5	-165.8	0	0	110.6	S135 L136 W141 S145 R193	S135-E143 WeakPolarHBondContact CB-OE1 3.26Å; S135-E143 PolarHBondContact OG-OE1 3.16Å; L136-E143 CarbonylContact O-C 3.58Å; L136-E143 WeakPolarHBondContact O-CA 3.23Å; W141-E143 PolarHBondContact O-N 3.31Å; E143-S145 WeakPolarHBondContact OE1-CB 3.38Å; E143-R193 IonicContact OE2-CZ 2.9Å; E143-R193 IonicContact OE2-NE 3.7Å; E143-R193 PolarHBondContact OE2-NE 3.42Å; E143-R193 IonicContact OE2-NH2 3.88Å; E143-R193 PolarHBondContact OE2-NH2 2.61Å
144	V	81.1	Confident	70.9	Confident	2 Å²	2	54 Å²	54	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	103.9	163.3	175	0	0	0	0	106.7	L63 E66 F67 A70 L136 V138 I142	L63-V144 HydrophobicContact CD1-CG1 3.82Å; E66-V144 HydrophobicContact CB-CG1 3.78Å; F67-V144 HydrophobicContact CD1-CB 4.39Å; F67-V144 HydrophobicContact CD1-CG1 4.24Å; F67-V144 HydrophobicContact CD1-CG2 4.01Å; F67-V144 HydrophobicContact CD2-CG1 4.21Å; F67-V144 HydrophobicContact CE1-CB 4.17Å; F67-V144 HydrophobicContact CE1-CG1 4.14Å; F67-V144 HydrophobicContact CE1-CG2 4.2Å; F67-V144 HydrophobicContact CE2-CG1 4.14Å; F67-V144 HydrophobicContact CG-CG1 4.25Å; F67-V144 HydrophobicContact CZ-CB 4.49Å; F67-V144 HydrophobicContact CZ-CG1 4.1Å; A70-V144 HydrophobicContact CB-CG2 3.57Å; L136-V144 PolarHBondContact N-O 2.75Å; L136-V144 PolarHBondContact O-N 3Å; V138-V144 HydrophobicContact CG2-CG2 3.75Å; I142-V144 PolarHBondContact O-N 2.69Å
145	S	80.5	Confident	68.7	Low	30 Å²	30	57.2 Å²	57.2	21%	0.21	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.4	176.1	62.6	0	0	0	0	111.5	V134 E143 W237	V134-S145 CarbonylContact O-C 3.48Å; V134-S145 WeakPolarHBondContact O-CA 3.26Å; E143-S145 WeakPolarHBondContact OE1-CB 3.38Å; S145-W237 VanDerWaalsContact CB-CH2 3.42Å; S145-W237 WeakPolarHBondContact OG-CH2 3.39Å
146	W	81.4	Confident	66.6	Low	63 Å²	63	57.4 Å²	57.4	24%	0.239	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	140.3	-179.6	-172.9	-102.6	0	0	0	109.8	S59 T62 L63 T133 V134	S59-W146 VanDerWaalsContact CB-NE1 3.33Å; S59-W146 PolarHBondContact OG-NE1 3.21Å; T62-W146 HydrophobicContact CG2-CD2 4.03Å; T62-W146 HydrophobicContact CG2-CE3 3.51Å; T62-W146 HydrophobicContact CG2-CH2 3.45Å; T62-W146 VanDerWaalsContact CG2-CH2 3.45Å; T62-W146 HydrophobicContact CG2-CZ2 3.96Å; T62-W146 HydrophobicContact CG2-CZ3 3.22Å; L63-W146 HydrophobicContact CD1-CB 4.14Å; T133-W146 CarbonylContact C-O 3.59Å; V134-W146 PolarHBondContact N-O 3.5Å; V134-W146 PolarHBondContact O-N 3.35Å; V134-W146 VanDerWaalsContact O-O 3.13Å
147	N	74.9	Confident	64.3	Low	5 Å²	5	62.8 Å²	62.8	3%	0.027	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.5	175.2	-164.8	-35.9	0	0	0	109.7	G132 T133 H149 Y236 W237	G132-N147 PolarHBondContact O-OD1 3.2Å; T133-N147 WeakPolarHBondContact CG2-ND2 3.34Å; N147-H149 PolarHBondContact O-N 3.19Å; N147-H149 VanDerWaalsContact O-N 3.13Å; N147-Y236 HydrophobicContact CB-CE1 4.02Å; N147-Y236 VanDerWaalsContact CG-O 3.3Å; N147-Y236 PolarHBondContact ND2-O 3.29Å; N147-W237 HydrophobicContact CB-CE3 4.19Å; N147-W237 HydrophobicContact CB-CZ3 4.15Å; N147-W237 WeakPolarHBondContact ND2-CA 3.44Å
148	V	70.9	Confident	62	Low	9 Å²	9	67.9 Å²	67.9	6%	0.055	34%	0.34	C	S	.	.			trans	-73.1	101	162.7	-166.3	0	0	0	0	106.4	S59 L128 G132 Q150 Y152	S59-V148 WeakPolarHBondContact OG-CG2 3.29Å; L128-V148 HydrophobicContact CD1-CG2 3.45Å; L128-V148 VanDerWaalsContact CD1-CG2 3.45Å; L128-V148 HydrophobicContact CG-CG2 4Å; G132-V148 WeakPolarHBondContact O-CG2 3.38Å; G132-V148 PolarHBondContact O-N 2.78Å; V148-Q150 PolarHBondContact O-N 3.18Å; V148-Y152 HydrophobicContact CG1-CD2 4.03Å; V148-Y152 HydrophobicContact CG1-CG 4.17Å
149	H	62.2	Low	59.6	Low	106 Å²	106	74 Å²	74	49%	0.491	38%	0.38	S	S	.	.			trans	-22.6	126.7	-178.9	-163	81.1	0	0	0	113.1	N147 R151 Y152	N147-H149 PolarHBondContact O-N 3.19Å; N147-H149 VanDerWaalsContact O-N 3.13Å; H149-R151 PolarHBondContact O-N 3.07Å; H149-Y152 PolarHBondContact O-N 2.74Å
150	Q	54.3	Low	57.6	Low	56 Å²	56	75 Å²	75	26%	0.262	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-37.2	-32.2	-163.3	-81.7	-170.5	-31.5	0	0	116.5	V148 Y152 S153 I235	V148-Q150 PolarHBondContact O-N 3.18Å; Q150-Y152 PolarHBondContact O-N 2.81Å; Q150-S153 PolarHBondContact O-N 3.25Å; Q150-I235 WeakPolarHBondContact CG-O 3.17Å; Q150-I235 PolarHBondContact NE2-O 3.09Å; Q150-I235 VanDerWaalsContact OE1-CG2 3.27Å
151	R	50.7	Low	55.5	Low	149 Å²	149	77.7 Å²	77.7	56%	0.562	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-49.5	-26.4	176.2	-61.3	-173.3	-168.8	179.9	4.7	114.3	H149	H149-R151 PolarHBondContact O-N 3.07Å
152	Y	44.1	Very low	53.5	Low	49 Å²	49	75.1 Å²	75.1	19%	0.192	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-104.8	-12.9	-176.7	-60.9	-75.5	0	0	0	115	K55 V148 H149 Q150 K154 C155	K55-Y152 HydrophobicContact CB-CE2 4.44Å; K55-Y152 HydrophobicContact CD-CD2 4.43Å; K55-Y152 HydrophobicContact CD-CE2 3.39Å; K55-Y152 VanDerWaalsContact CD-OH 3.3Å; K55-Y152 WeakPolarHBondContact CD-OH 3.34Å; K55-Y152 WeakPolarHBondContact CE-OH 3.15Å; K55-Y152 PolarHBondContact NZ-OH 3.3Å; V148-Y152 HydrophobicContact CG1-CD2 4.03Å; V148-Y152 HydrophobicContact CG1-CG 4.17Å; H149-Y152 PolarHBondContact O-N 2.74Å; Q150-Y152 PolarHBondContact O-N 2.81Å; Y152-K154 VanDerWaalsContact C-N 3.33Å; Y152-K154 PolarHBondContact O-N 2.99Å; Y152-C155 PolarHBondContact O-N 3.31Å
153	S	43.2	Very low	51.5	Low	32 Å²	32	80 Å²	80	22%	0.224	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.7	-165.7	132.8	0	0	0	0	113.8	T131 Q150	T131-S153 WeakPolarHBondContact O-CB 3.44Å; T131-S153 PolarHBondContact O-OG 3.05Å; Q150-S153 PolarHBondContact O-N 3.25Å
154	K	42.4	Very low	49.3	Very low	142 Å²	142	84.7 Å²	84.7	62%	0.617	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-13.1	174.9	-71.6	-174.9	179.1	-179.3	0	114.5	Y152	Y152-K154 VanDerWaalsContact C-N 3.33Å; Y152-K154 PolarHBondContact O-N 2.99Å
155	C	33.5	Very low	47	Very low	67 Å²	67	88 Å²	88	45%	0.453	47%	0.468	S	S	.	.			trans	-127.9	64.8	-168.4	-76.1	0	0	0	0	113.4	Y152 L160	Y152-C155 PolarHBondContact O-N 3.31Å; C155-L160 HydrophobicContact CB-CD1 4.15Å
156	L	38	Very low	44.8	Very low	60 Å²	60	94.4 Å²	94.4	31%	0.314	50%	0.499	S	S	.	.			trans	-101.2	13	174.9	-83.9	153.7	0	0	0	114.4	I56 L128 L129	I56-L156 HydrophobicContact CD1-CD2 3.56Å; L128-L156 WeakPolarHBondContact O-CD1 3.13Å; L129-L156 WeakPolarHBondContact O-CB 3.5Å; L129-L156 WeakPolarHBondContact O-CD1 3.04Å
157	T	35.1	Very low	42.5	Very low	139 Å²	139	95.7 Å²	95.7	85%	0.853	51%	0.513	S	S	*	.	S	Bend	trans	-118.3	4.6	179.7	47	0	0	0	0	115.3
158	K	34	Very low	40.8	Very low	168 Å²	168	103.3 Å²	103.3	73%	0.73	55%	0.554	S	S	*	*	S	Bend	trans	-133.4	139.4	169.9	-74.4	-177.3	178.7	177.9	0	111.1	L160	K158-L160 PolarHBondContact O-N 3.35Å
159	P	30.7	Very low	39.4	Very low	130 Å²	130	107.2 Å²	107.2	84%	0.844	58%	0.575	S	S	*	*			trans	-70.2	110.9	177	28.9	-30.1	0	0	0	108.5
160	L	38.5	Very low	38.9	Very low	80 Å²	80	104.8 Å²	104.8	42%	0.419	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-84.3	129.7	172.9	-73.2	159.9	0	0	0	108.8	C155 K158	C155-L160 HydrophobicContact CB-CD1 4.15Å; K158-L160 PolarHBondContact O-N 3.35Å
161	L	33.8	Very low	39.1	Very low	118 Å²	118	104.9 Å²	104.9	62%	0.618	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-58.8	149.5	-179.5	-70.9	165.3	0	0	0	111.9	F440	L161-F440 HydrophobicContact CD1-CB 3.45Å; L161-F440 VanDerWaalsContact CD1-CB 3.45Å; L161-F440 WeakPolarHBondContact CD1-O 3.16Å
162	P	33.6	Very low	40	Very low	104 Å²	104	102.3 Å²	102.3	68%	0.675	58%	0.58	S	S	*	*	S	Bend	trans	-76.7	152.5	171.7	33.7	-30.6	0	0	0	109.9
163	D	38	Very low	41.8	Very low	141 Å²	141	100.5 Å²	100.5	75%	0.754	57%	0.573	S	S	*	*			trans	86.4	86.9	170	-55.2	-25.6	0	0	0	116
164	D	34.6	Very low	43.8	Very low	128 Å²	128	100.4 Å²	100.4	68%	0.684	57%	0.569	S	S	*	*				-145.6	130.2	111.4	-110.8	-26.4	0	0	0	112.2	Y437	D164-Y437 HydrophobicContact CB-CE1 4Å
165	A	32.6	Very low	46	Very low	73 Å²	73	94.8 Å²	94.8	60%	0.603	55%	0.547	S	S	*	.			trans	-86.5	144.6	-172.1	0	0	0	0	0	109.4
166	L	33.5	Very low	48.6	Very low	163 Å²	163	92.2 Å²	92.2	85%	0.853	53%	0.528	S	S	*	.			trans	65.9	73.3	148.9	-53.2	159.2	0	0	0	117.1
167	V	34.9	Very low	51	Low	91 Å²	91	89.8 Å²	89.8	55%	0.552	52%	0.515	S	S	*	.			trans	-127.4	100.7	139.4	-170.9	0	0	0	0	107.6	D169	V167-D169 HydrophobicContact CG1-CB 3.86Å; V167-D169 PolarHBondContact O-N 3.13Å; V167-D169 VanDerWaalsContact O-N 3.16Å
168	D	37.6	Very low	53.6	Low	165 Å²	165	83.2 Å²	83.2	88%	0.882	48%	0.475	S	S	*	.			trans	-75.7	25.8	175.2	-167.2	30.8	0	0	0	112.2	G170	D168-G170 VanDerWaalsContact C-N 3.33Å; D168-G170 PolarHBondContact O-N 3.02Å
169	D	42.3	Very low	56.2	Low	91 Å²	91	75.4 Å²	75.4	49%	0.487	44%	0.441	S	S	.	.			trans	-82.1	88.6	174.4	-80.1	-8.7	0	0	0	108.5	V167 M171 R433	V167-D169 HydrophobicContact CG1-CB 3.86Å; V167-D169 PolarHBondContact O-N 3.13Å; V167-D169 VanDerWaalsContact O-N 3.16Å; D169-M171 PolarHBondContact O-N 3.26Å; D169-R433 IonicContact OD2-CZ 3.5Å; D169-R433 IonicContact OD2-NH1 3.04Å; D169-R433 PolarHBondContact OD2-NH1 2.76Å; D169-R433 IonicContact OD2-NH2 2.69Å
170	G	50.8	Low	58.9	Low	55 Å²	55	69.4 Å²	69.4	57%	0.567	40%	0.402	S	S	*	.			trans	-47.7	138.2	161.7	0	0	0	0	0	109.6	D168 V172	D168-G170 VanDerWaalsContact C-N 3.33Å; D168-G170 PolarHBondContact O-N 3.02Å; G170-V172 WeakPolarHBondContact O-CG2 3.46Å; G170-V172 PolarHBondContact O-N 2.91Å
171	M	59.1	Low	61.2	Low	58 Å²	58	66.6 Å²	66.6	29%	0.286	39%	0.387	S	S	.	.			trans	-51	108.2	175.1	179.4	169.6	56.2	0	0	109.7	D169 I173 I235 V242 R434	D169-M171 PolarHBondContact O-N 3.26Å; M171-I173 PolarHBondContact O-N 2.85Å; M171-I173 VanDerWaalsContact O-N 3.07Å; M171-I235 HydrophobicContact CE-CB 4.23Å; M171-I235 HydrophobicContact CE-CD1 3.22Å; M171-I235 HydrophobicContact CE-CG1 4.02Å; M171-I235 HydrophobicContact CE-CG2 3.44Å; M171-I235 VanDerWaalsContact CE-CG2 3.44Å; M171-V242 HydrophobicContact CE-CG2 4.4Å; M171-V242 HydrophobicContact SD-CB 4.44Å; M171-R434 PolarHBondContact SD-NH2 3.17Å
172	V	69.4	Low	63.6	Low	95 Å²	95	63.4 Å²	63.4	58%	0.576	37%	0.37	S	S	*	.			trans	-74.2	104	-179.2	-177.3	0	0	0	0	107.3	G170 K174	G170-V172 WeakPolarHBondContact O-CG2 3.46Å; G170-V172 PolarHBondContact O-N 2.91Å; V172-K174 HydrophobicContact CG1-CG 4.48Å; V172-K174 PolarHBondContact O-N 2.83Å
173	I	82.4	Confident	65.9	Low	10 Å²	10	61.5 Å²	61.5	5%	0.051	35%	0.353	C	S	.	.			trans	-77.4	117.3	176.8	-50.8	-174.3	0	0	0	107.5	M171 L213 F228 V231 Q232 I235 V242	M171-I173 PolarHBondContact O-N 2.85Å; M171-I173 VanDerWaalsContact O-N 3.07Å; I173-L213 HydrophobicContact CG2-CD1 3.57Å; I173-F228 HydrophobicContact CB-CD1 4.09Å; I173-F228 HydrophobicContact CB-CE1 4.33Å; I173-F228 HydrophobicContact CB-CG 4.5Å; I173-F228 HydrophobicContact CG2-CD1 3.67Å; I173-F228 HydrophobicContact CG2-CE1 3.76Å; I173-F228 WeakPolarHBondContact O-CZ 3.16Å; I173-V231 HydrophobicContact CD1-CB 4.03Å; I173-V231 HydrophobicContact CD1-CG1 3.61Å; I173-Q232 HydrophobicContact CD1-CG 3.6Å; I173-Q232 HydrophobicContact CG1-CG 4.44Å; I173-I235 HydrophobicContact CD1-CD1 4.03Å; I173-V242 HydrophobicContact CD1-CG2 4.23Å; I173-V242 HydrophobicContact CG1-CG2 4.38Å; I173-V242 HydrophobicContact CG2-CG2 4.37Å
174	K	85.1	Confident	68.2	Low	31 Å²	31	58 Å²	58	14%	0.135	34%	0.339	C	S	.	.			trans	-94.3	152.6	175.6	-61.7	-179.5	-179	-178.3	0	110.8	V172 Y176 H177 E398	V172-K174 HydrophobicContact CG1-CG 4.48Å; V172-K174 PolarHBondContact O-N 2.83Å; K174-Y176 VanDerWaalsContact C-N 3.27Å; K174-Y176 HydrophobicContact CB-CD1 4Å; K174-Y176 HydrophobicContact CB-CD2 4.48Å; K174-Y176 HydrophobicContact CB-CE1 3.66Å; K174-Y176 HydrophobicContact CB-CE2 4.14Å; K174-Y176 HydrophobicContact CB-CG 4.45Å; K174-Y176 HydrophobicContact CD-CE1 3.57Å; K174-Y176 HydrophobicContact CD-CE2 4.14Å; K174-Y176 WeakPolarHBondContact CD-OH 3.46Å; K174-Y176 HydrophobicContact CG-CE1 4.22Å; K174-Y176 PolarHBondContact NZ-OH 2.87Å; K174-Y176 VanDerWaalsContact NZ-OH 3.09Å; K174-Y176 PolarHBondContact O-N 3.15Å; K174-H177 PolarHBondContact N-ND1 3.28Å; K174-H177 VanDerWaalsContact N-ND1 3.13Å; K174-H177 WeakPolarHBondContact O-CB 3.26Å; K174-H177 PolarHBondContact O-N 3.46Å; K174-E398 IonicContact NZ-OE1 3.71Å; K174-E398 PolarHBondContact NZ-OE1 3.44Å; K174-E398 IonicContact NZ-OE2 3.38Å; K174-E398 PolarHBondContact NZ-OE2 2.56Å
175	P	88.8	Confident	70.7	Confident	24 Å²	24	54.5 Å²	54.5	16%	0.156	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.2	-176.3	20.4	-33	0	0	0	115.3	H177 L213 L214 L224 F228 F401	P175-H177 VanDerWaalsContact C-N 3.34Å; P175-L213 PolarHBondContact O-N 2.8Å; P175-L214 HydrophobicContact CB-CB 4.2Å; P175-L214 PolarHBondContact O-N 2.93Å; P175-L224 HydrophobicContact CB-CD1 4.04Å; P175-L224 HydrophobicContact CB-CD2 3.81Å; P175-L224 HydrophobicContact CG-CD2 4.35Å; P175-F228 HydrophobicContact CB-CZ 4.35Å; P175-F401 HydrophobicContact CB-CE1 4.34Å; P175-F401 HydrophobicContact CB-CE2 4.22Å; P175-F401 HydrophobicContact CB-CZ 3.66Å; P175-F401 HydrophobicContact CG-CD1 4.43Å; P175-F401 HydrophobicContact CG-CE1 3.43Å; P175-F401 VanDerWaalsContact CG-CE1 3.43Å; P175-F401 HydrophobicContact CG-CE2 4.14Å; P175-F401 HydrophobicContact CG-CZ 3.25Å
176	Y	87.6	Confident	73.2	Confident	13 Å²	13	58.9 Å²	58.9	5%	0.051	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.4	179.4	54	-103.7	0	0	0	113.7	K174 P212 F244 P245 H395 E398 F401	K174-Y176 VanDerWaalsContact C-N 3.27Å; K174-Y176 HydrophobicContact CB-CD1 4Å; K174-Y176 HydrophobicContact CB-CD2 4.48Å; K174-Y176 HydrophobicContact CB-CE1 3.66Å; K174-Y176 HydrophobicContact CB-CE2 4.14Å; K174-Y176 HydrophobicContact CB-CG 4.45Å; K174-Y176 HydrophobicContact CD-CE1 3.57Å; K174-Y176 HydrophobicContact CD-CE2 4.14Å; K174-Y176 WeakPolarHBondContact CD-OH 3.46Å; K174-Y176 HydrophobicContact CG-CE1 4.22Å; K174-Y176 PolarHBondContact NZ-OH 2.87Å; K174-Y176 VanDerWaalsContact NZ-OH 3.09Å; K174-Y176 PolarHBondContact O-N 3.15Å; Y176-P212 WeakPolarHBondContact O-CB 3.5Å; Y176-F244 HydrophobicContact CD2-CD1 4.19Å; Y176-F244 AromaticContact CD2-CE1 3.82Å; Y176-F244 HydrophobicContact CD2-CE1 3.82Å; Y176-F244 HydrophobicContact CE2-CD1 4.29Å; Y176-F244 AromaticContact CE2-CE1 3.47Å; Y176-F244 HydrophobicContact CE2-CE1 3.47Å; Y176-F244 VanDerWaalsContact CE2-CE1 3.47Å; Y176-F244 HydrophobicContact CE2-CZ 4.15Å; Y176-P245 WeakPolarHBondContact O-CD 3.28Å; Y176-P245 WeakPolarHBondContact O-CG 3.39Å; Y176-H395 AromaticContact CE2-NE2 3.96Å; Y176-E398 HydrophobicContact CE1-CB 4.48Å; Y176-E398 HydrophobicContact CE1-CG 4.19Å; Y176-E398 WeakPolarHBondContact OH-CG 3.44Å; Y176-E398 PolarHBondContact OH-OE2 2.98Å; Y176-E398 VanDerWaalsContact OH-OE2 3.06Å; Y176-F401 HydrophobicContact CD1-CB 3.87Å; Y176-F401 AromaticContact CD1-CD1 3.64Å; Y176-F401 HydrophobicContact CD1-CD1 3.64Å; Y176-F401 HydrophobicContact CD1-CD2 4.18Å; Y176-F401 HydrophobicContact CD1-CE1 4.26Å; Y176-F401 AromaticContact CD1-CG 3.6Å; Y176-F401 HydrophobicContact CD1-CG 3.6Å; Y176-F401 HydrophobicContact CE1-CD1 4.34Å; Y176-F401 HydrophobicContact CG-CB 4.31Å; Y176-F401 HydrophobicContact CG-CD2 4.4Å; Y176-F401 HydrophobicContact CG-CG 4.17Å
177	H	89.6	Confident	75.6	Confident	9 Å²	9	53.4 Å²	53.4	4%	0.042	30%	0.3	C	S	.	.			trans	-68.3	159.2	175.2	-60.8	153.5	0	0	0	111.3	K174 P175 P212 L213 V242 I243 F244	K174-H177 PolarHBondContact N-ND1 3.28Å; K174-H177 VanDerWaalsContact N-ND1 3.13Å; K174-H177 WeakPolarHBondContact O-CB 3.26Å; K174-H177 PolarHBondContact O-N 3.46Å; P175-H177 VanDerWaalsContact C-N 3.34Å; H177-P212 CarbonylContact O-C 3.58Å; H177-P212 WeakPolarHBondContact O-CA 3.26Å; H177-L213 HydrophobicContact CB-CD1 4.47Å; H177-L213 WeakPolarHBondContact O-CB 3.41Å; H177-L213 WeakPolarHBondContact O-CG 3.3Å; H177-L213 PolarHBondContact O-N 3.45Å; H177-V242 HydrophobicContact CB-CG1 3.47Å; H177-V242 VanDerWaalsContact CB-CG1 3.47Å; H177-I243 CarbonylContact C-O 3.53Å; H177-F244 AromaticContact CD2-CE1 3.78Å; H177-F244 AromaticContact CD2-CZ 3.88Å; H177-F244 AromaticContact NE2-CZ 3.75Å
178	A	88.9	Confident	77.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	169.7	169.3	0	0	0	0	0	110.6	K211 V242 I243 P245	A178-K211 VanDerWaalsContact CB-O 3.31Å; A178-K211 WeakPolarHBondContact CB-O 3.44Å; A178-V242 WeakPolarHBondContact O-CA 3.45Å; A178-I243 CarbonylContact C-O 3.59Å; A178-I243 HydrophobicContact CB-CG1 4.17Å; A178-I243 PolarHBondContact N-O 3.41Å; A178-I243 PolarHBondContact O-N 2.96Å; A178-P245 HydrophobicContact CB-CB 4.18Å; A178-P245 HydrophobicContact CB-CG 4Å
179	V	88	Confident	80.1	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.03	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.6	178.9	172.2	0	0	0	0	110.3	L181 F203 L213 V231 A240	V179-L181 HydrophobicContact CG1-CD2 4.2Å; V179-F203 HydrophobicContact CG2-CZ 4.47Å; V179-L213 HydrophobicContact CG2-CD1 4.26Å; V179-L213 HydrophobicContact CG2-CD2 3.67Å; V179-L213 HydrophobicContact CG2-CG 4.25Å; V179-V231 HydrophobicContact CG2-CB 4.38Å; V179-V231 HydrophobicContact CG2-CG1 3.58Å; V179-V231 HydrophobicContact CG2-CG2 3.77Å; V179-A240 HydrophobicContact CG1-CB 3.76Å
180	L	87.3	Confident	81.9	Confident	3 Å²	3	46 Å²	46	2%	0.016	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	112.1	174.3	-176.6	64.8	0	0	0	109.3	P209 A240 L241 I243 V310 L313 Q314	L180-P209 HydrophobicContact CD1-CB 4.19Å; L180-A240 CarbonylContact O-C 3.59Å; L180-A240 WeakPolarHBondContact O-CA 3.43Å; L180-L241 HydrophobicContact CB-CB 4.37Å; L180-L241 PolarHBondContact N-O 3.13Å; L180-L241 PolarHBondContact O-N 2.85Å; L180-I243 HydrophobicContact CB-CD1 3.86Å; L180-I243 HydrophobicContact CB-CG1 3.97Å; L180-I243 HydrophobicContact CB-CG2 3.93Å; L180-I243 HydrophobicContact CD1-CD1 4.43Å; L180-I243 HydrophobicContact CD2-CD1 4.46Å; L180-I243 HydrophobicContact CD2-CG2 4.03Å; L180-I243 HydrophobicContact CG-CD1 4.49Å; L180-V310 HydrophobicContact CD1-CG1 3.71Å; L180-L313 HydrophobicContact CD2-CB 3.73Å; L180-Q314 HydrophobicContact CD1-CG 3.84Å; L180-Q314 HydrophobicContact CD2-CB 4.47Å; L180-Q314 HydrophobicContact CD2-CG 3.82Å; L180-Q314 HydrophobicContact CG-CG 3.76Å
181	L	88.1	Confident	83.1	Confident	21 Å²	21	51.2 Å²	51.2	11%	0.11	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.7	174.5	-59.7	178.1	0	0	0	110.1	V179 I185 I188 L204 A240 Q314	V179-L181 HydrophobicContact CG1-CD2 4.2Å; L181-I185 HydrophobicContact CD1-CG1 3.82Å; L181-I188 HydrophobicContact CD2-CD1 4.42Å; L181-L204 HydrophobicContact CD1-CD2 3.92Å; L181-L204 HydrophobicContact CD2-CD2 3.62Å; L181-L204 HydrophobicContact CG-CD2 4.44Å; L181-A240 HydrophobicContact CD2-CB 4.17Å; L181-Q314 PolarHBondContact O-NE2 3.26Å
182	L	83.5	Confident	83.7	Confident	51 Å²	51	50 Å²	50	27%	0.267	26%	0.256	S	S	.	.	S	Bend	trans	-86.3	-23.3	178.8	-67.4	178.2	0	0	0	112.9	G238 K239 L241 Q314	L182-G238 WeakPolarHBondContact CD1-O 3.49Å; L182-K239 PolarHBondContact N-O 3.34Å; L182-L241 HydrophobicContact CD1-CD1 4.49Å; L182-L241 HydrophobicContact CD1-CD2 4.46Å; L182-L241 HydrophobicContact CD1-CG 4.07Å; L182-L241 HydrophobicContact CD2-CD1 3.71Å; L182-L241 HydrophobicContact CD2-CG 3.94Å; L182-L241 HydrophobicContact CG-CD1 4.44Å; L182-L241 HydrophobicContact CG-CG 4.14Å; L182-Q314 HydrophobicContact CD2-CB 4.18Å; L182-Q314 HydrophobicContact CD2-CG 4.37Å; L182-Q314 VanDerWaalsContact CD2-O 3.23Å; L182-Q314 WeakPolarHBondContact CD2-O 3.42Å
183	E	82.6	Confident	83.8	Confident	65 Å²	65	50.8 Å²	50.8	30%	0.304	25%	0.248	S	C	.	.	S	Bend	trans	-123.4	159.9	179.9	-69.4	178.4	-165.2	0	0	110.3	I188 K239	E183-I188 HydrophobicContact CB-CD1 4.16Å; E183-I188 HydrophobicContact CB-CG1 3.82Å; E183-K239 IonicContact OE1-NZ 3.73Å; E183-K239 PolarHBondContact OE1-NZ 3.2Å; E183-K239 IonicContact OE2-NZ 2.62Å; E183-K239 PolarHBondContact OE2-NZ 3.1Å
184	S	85.3	Confident	82.9	Confident	66 Å²	66	56.4 Å²	56.4	46%	0.462	29%	0.286	S	S	.	.			trans	-64.5	145	174.8	83.7	0	0	0	0	110.5	K186 S187 I188	S184-K186 PolarHBondContact O-N 2.77Å; S184-K186 VanDerWaalsContact O-N 3.16Å; S184-S187 WeakPolarHBondContact O-CB 3.34Å; S184-S187 PolarHBondContact O-N 3.09Å; S184-S187 PolarHBondContact OG-N 2.99Å; S184-S187 PolarHBondContact OG-OG 2.62Å; S184-I188 WeakPolarHBondContact O-CG1 3.34Å; S184-I188 PolarHBondContact O-N 2.76Å; S184-I188 VanDerWaalsContact O-N 3.1Å
185	I	88.2	Confident	82	Confident	56 Å²	56	61.8 Å²	61.8	29%	0.287	32%	0.316	S	S	.	.	H	α-helix	trans	-52.4	-42.6	-179.4	-62.3	167.7	0	0	0	110.9	L181 S187 I188 V189 L204	L181-I185 HydrophobicContact CD1-CG1 3.82Å; I185-S187 PolarHBondContact O-N 3.34Å; I185-I188 PolarHBondContact O-N 2.87Å; I185-V189 HydrophobicContact CG2-CG2 4.13Å; I185-V189 VanDerWaalsContact O-CG2 3.28Å; I185-V189 WeakPolarHBondContact O-CG2 3.23Å; I185-V189 PolarHBondContact O-N 2.77Å; I185-L204 WeakPolarHBondContact CD1-O 3.18Å; I185-L204 HydrophobicContact CG2-CB 4.11Å
186	K	85.5	Confident	81.2	Confident	165 Å²	165	63.1 Å²	63.1	72%	0.717	32%	0.32	S	S	*	.	H	α-helix	trans	-58.9	-47.6	177.5	-62.8	-178.4	-179.1	179.5	0	111.8	S184 I188 V189 D190	S184-K186 PolarHBondContact O-N 2.77Å; S184-K186 VanDerWaalsContact O-N 3.16Å; K186-I188 VanDerWaalsContact C-N 3.26Å; K186-I188 PolarHBondContact O-N 3.46Å; K186-V189 PolarHBondContact O-N 3.08Å; K186-D190 WeakPolarHBondContact O-CB 3.44Å; K186-D190 PolarHBondContact O-N 3.06Å
187	S	83.9	Confident	80.9	Confident	47 Å²	47	65.5 Å²	65.5	33%	0.329	34%	0.338	S	S	.	.	H	α-helix	trans	-62.5	-32.9	178.7	-54.3	0	0	0	0	113.2	S184 I185 R191	S184-S187 WeakPolarHBondContact O-CB 3.34Å; S184-S187 PolarHBondContact O-N 3.09Å; S184-S187 PolarHBondContact OG-N 2.99Å; S184-S187 PolarHBondContact OG-OG 2.62Å; I185-S187 PolarHBondContact O-N 3.34Å; S187-R191 WeakPolarHBondContact O-CD 3.12Å; S187-R191 VanDerWaalsContact O-CG 3.23Å; S187-R191 WeakPolarHBondContact O-CG 3.37Å
188	I	81.7	Confident	80.7	Confident	6 Å²	6	69.9 Å²	69.9	3%	0.031	37%	0.366	C	S	.	.	H	α-helix	trans	-73.2	-46.5	176.3	-58.2	171.9	0	0	0	109.3	L181 E183 S184 I185 K186 R191 M192 L204 K239	L181-I188 HydrophobicContact CD2-CD1 4.42Å; E183-I188 HydrophobicContact CB-CD1 4.16Å; E183-I188 HydrophobicContact CB-CG1 3.82Å; S184-I188 WeakPolarHBondContact O-CG1 3.34Å; S184-I188 PolarHBondContact O-N 2.76Å; S184-I188 VanDerWaalsContact O-N 3.1Å; I185-I188 PolarHBondContact O-N 2.87Å; K186-I188 VanDerWaalsContact C-N 3.26Å; K186-I188 PolarHBondContact O-N 3.46Å; I188-R191 PolarHBondContact O-N 3.45Å; I188-M192 HydrophobicContact CG2-CE 3.98Å; I188-M192 HydrophobicContact CG2-SD 4.3Å; I188-M192 WeakPolarHBondContact O-CB 3.38Å; I188-M192 VanDerWaalsContact O-CG 3.3Å; I188-M192 WeakPolarHBondContact O-CG 3.46Å; I188-M192 PolarHBondContact O-N 2.63Å; I188-M192 VanDerWaalsContact O-N 3.08Å; I188-L204 HydrophobicContact CG2-CD1 4.08Å; I188-K239 HydrophobicContact CD1-CB 4.31Å
189	V	83.6	Confident	80.6	Confident	51 Å²	51	70.4 Å²	70.4	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-64.6	-39.2	-179.8	175.4	0	0	0	0	112.5	I185 K186 R191 M192 V201 L204	I185-V189 HydrophobicContact CG2-CG2 4.13Å; I185-V189 VanDerWaalsContact O-CG2 3.28Å; I185-V189 WeakPolarHBondContact O-CG2 3.23Å; I185-V189 PolarHBondContact O-N 2.77Å; K186-V189 PolarHBondContact O-N 3.08Å; V189-R191 VanDerWaalsContact C-N 3.3Å; V189-R191 PolarHBondContact O-N 3.49Å; V189-M192 HydrophobicContact CB-CE 4.22Å; V189-M192 HydrophobicContact CG2-CE 3.74Å; V189-M192 WeakPolarHBondContact O-CB 3.01Å; V189-M192 PolarHBondContact O-N 3.21Å; V189-V201 HydrophobicContact CG2-CG2 4.49Å; V189-L204 HydrophobicContact CG2-CD1 4.36Å
190	D	81.2	Confident	80.7	Confident	135 Å²	135	70.7 Å²	70.7	72%	0.722	37%	0.372	S	S	*	.	H	α-helix	trans	-69.7	-27.3	179.9	-65	-22.2	0	0	0	112.8	K186	K186-D190 WeakPolarHBondContact O-CB 3.44Å; K186-D190 PolarHBondContact O-N 3.06Å
191	R	76.5	Confident	80.8	Confident	164 Å²	164	72.7 Å²	72.7	62%	0.619	38%	0.384	S	S	*	.	H	α-helix	trans	-86.1	-20.8	176.4	-70	173.8	-173.9	-110.1	1.3	112.7	S187 I188 V189	S187-R191 WeakPolarHBondContact O-CD 3.12Å; S187-R191 VanDerWaalsContact O-CG 3.23Å; S187-R191 WeakPolarHBondContact O-CG 3.37Å; I188-R191 PolarHBondContact O-N 3.45Å; V189-R191 VanDerWaalsContact C-N 3.3Å; V189-R191 PolarHBondContact O-N 3.49Å
192	M	71.8	Confident	80.8	Confident	32 Å²	32	79.1 Å²	79.1	16%	0.158	41%	0.407	C	S	.	.	S	Bend	trans	-71.9	138.2	177.2	-92.2	-164.5	-52.5	0	0	108.8	I188 V189 H196 I200 L204	I188-M192 HydrophobicContact CG2-CE 3.98Å; I188-M192 HydrophobicContact CG2-SD 4.3Å; I188-M192 WeakPolarHBondContact O-CB 3.38Å; I188-M192 VanDerWaalsContact O-CG 3.3Å; I188-M192 WeakPolarHBondContact O-CG 3.46Å; I188-M192 PolarHBondContact O-N 2.63Å; I188-M192 VanDerWaalsContact O-N 3.08Å; V189-M192 HydrophobicContact CB-CE 4.22Å; V189-M192 HydrophobicContact CG2-CE 3.74Å; V189-M192 WeakPolarHBondContact O-CB 3.01Å; V189-M192 PolarHBondContact O-N 3.21Å; M192-H196 VanDerWaalsContact CA-CD2 3.43Å; M192-H196 WeakPolarHBondContact CA-CD2 3.19Å; M192-H196 WeakPolarHBondContact CA-NE2 3.47Å; M192-H196 WeakPolarHBondContact CB-CD2 3.35Å; M192-H196 HydrophobicContact SD-CB 4.44Å; M192-I200 HydrophobicContact CE-CG2 4.25Å; M192-I200 HydrophobicContact SD-CG2 4Å; M192-L204 HydrophobicContact CE-CD1 3.8Å
193	R	70.2	Confident	81.3	Confident	112 Å²	112	76.7 Å²	76.7	42%	0.423	39%	0.394	S	S	.	.			trans	-47.8	150.1	169	-63.9	-170.3	-167.9	166.4	10.3	111.7	E143 D195 H196	E143-R193 IonicContact OE2-CZ 2.9Å; E143-R193 IonicContact OE2-NE 3.7Å; E143-R193 PolarHBondContact OE2-NE 3.42Å; E143-R193 IonicContact OE2-NH2 3.88Å; E143-R193 PolarHBondContact OE2-NH2 2.61Å; R193-D195 PolarHBondContact O-N 3.48Å; R193-D195 VanDerWaalsContact O-N 3.07Å; R193-H196 PolarHBondContact N-CD2 2.65Å; R193-H196 PolarHBondContact N-NE2 2.87Å; R193-H196 PolarHBondContact O-CD2 3.41Å; R193-H196 PolarHBondContact O-N 3.43Å
194	P	63.5	Low	81.6	Confident	129 Å²	129	73.6 Å²	73.6	84%	0.838	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.6	170	24.6	-33.6	0	0	0	113.1
195	D	66.2	Low	81.9	Confident	143 Å²	143	75.7 Å²	75.7	77%	0.765	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	6.8	-176.3	-58.6	-30.3	0	0	0	114.9	R193 S197	R193-D195 PolarHBondContact O-N 3.48Å; R193-D195 VanDerWaalsContact O-N 3.07Å; D195-S197 PolarHBondContact O-N 3.31Å
196	H	72.6	Confident	82	Confident	52 Å²	52	73.6 Å²	73.6	24%	0.241	38%	0.377	C	S	.	.	S	Bend	trans	-63.7	143.7	178.3	-74.4	-74.1	0	0	0	111.6	M192 R193 T198	M192-H196 VanDerWaalsContact CA-CD2 3.43Å; M192-H196 WeakPolarHBondContact CA-CD2 3.19Å; M192-H196 WeakPolarHBondContact CA-NE2 3.47Å; M192-H196 WeakPolarHBondContact CB-CD2 3.35Å; M192-H196 HydrophobicContact SD-CB 4.44Å; R193-H196 PolarHBondContact N-CD2 2.65Å; R193-H196 PolarHBondContact N-NE2 2.87Å; R193-H196 PolarHBondContact O-CD2 3.41Å; R193-H196 PolarHBondContact O-N 3.43Å; H196-T198 PolarHBondContact O-N 3.32Å
197	S	79.9	Confident	82	Confident	63 Å²	63	66.5 Å²	66.5	44%	0.441	35%	0.348	S	S	.	.			trans	-53.4	127.6	175.1	60.5	0	0	0	0	109.9	D195 A199 I200	D195-S197 PolarHBondContact O-N 3.31Å; S197-A199 PolarHBondContact O-N 2.81Å; S197-I200 PolarHBondContact O-N 2.88Å; S197-I200 WeakPolarHBondContact OG-CG1 3.38Å
198	T	85.4	Confident	82.3	Confident	101 Å²	101	66.7 Å²	66.7	62%	0.62	35%	0.347	S	S	*	.	H	α-helix	trans	-55.2	-20.6	175.1	56.5	0	0	0	0	112.5	H196 I200 V201 R202	H196-T198 PolarHBondContact O-N 3.32Å; T198-I200 PolarHBondContact O-N 3.21Å; T198-V201 PolarHBondContact O-N 2.8Å; T198-R202 WeakPolarHBondContact O-CG 3.39Å; T198-R202 PolarHBondContact O-N 2.72Å
199	A	88.3	Confident	82.6	Confident	12 Å²	12	67.8 Å²	67.8	10%	0.099	36%	0.355	C	S	.	.	H	α-helix	trans	-58.3	-40.3	173.5	0	0	0	0	0	113.8	S197 F203 Y222 I230	S197-A199 PolarHBondContact O-N 2.81Å; A199-F203 VanDerWaalsContact O-CB 3.27Å; A199-F203 WeakPolarHBondContact O-CB 3.34Å; A199-F203 PolarHBondContact O-N 2.86Å; A199-Y222 VanDerWaalsContact CA-OH 3.32Å; A199-Y222 WeakPolarHBondContact CA-OH 3.42Å; A199-Y222 HydrophobicContact CB-CE2 4.28Å; A199-I230 HydrophobicContact CB-CD1 4.32Å
200	I	89.2	Confident	82.8	Confident	10 Å²	10	68.9 Å²	68.9	5%	0.051	36%	0.362	C	S	.	.	H	α-helix	trans	-67.6	-42.7	178.1	-64.2	168.7	0	0	0	109.8	M192 S197 T198 F203 L204 I230	M192-I200 HydrophobicContact CE-CG2 4.25Å; M192-I200 HydrophobicContact SD-CG2 4Å; S197-I200 PolarHBondContact O-N 2.88Å; S197-I200 WeakPolarHBondContact OG-CG1 3.38Å; T198-I200 PolarHBondContact O-N 3.21Å; I200-F203 WeakPolarHBondContact O-CB 3.22Å; I200-F203 PolarHBondContact O-N 2.94Å; I200-L204 HydrophobicContact CG2-CD1 3.97Å; I200-L204 HydrophobicContact CG2-CG 4.21Å; I200-L204 WeakPolarHBondContact O-CB 3.3Å; I200-L204 VanDerWaalsContact O-CG 3.26Å; I200-L204 WeakPolarHBondContact O-CG 3.43Å; I200-L204 PolarHBondContact O-N 3.12Å; I200-I230 HydrophobicContact CG1-CG1 4.18Å; I200-I230 HydrophobicContact CG1-CG2 4.12Å
201	V	88.7	Confident	83.3	Confident	46 Å²	46	66.1 Å²	66.1	28%	0.279	34%	0.343	S	S	.	.	H	α-helix	trans	-65.1	-42.8	179.7	-178.5	0	0	0	0	111	V189 T198 L204 N205	V189-V201 HydrophobicContact CG2-CG2 4.49Å; T198-V201 PolarHBondContact O-N 2.8Å; V201-L204 PolarHBondContact O-N 3.07Å; V201-N205 PolarHBondContact O-N 3.29Å; V201-N205 VanDerWaalsContact O-N 3.1Å; V201-N205 PolarHBondContact O-ND2 3.47Å
202	R	89.7	Confident	84	Confident	155 Å²	155	60.4 Å²	60.4	59%	0.585	33%	0.327	S	S	*	.	H	α-helix	trans	-61	-44.3	173.2	-72.8	178.7	178.8	-164.4	2.9	111.5	T198 N205 A206 L220 Y222	T198-R202 WeakPolarHBondContact O-CG 3.39Å; T198-R202 PolarHBondContact O-N 2.72Å; R202-N205 PolarHBondContact O-N 2.98Å; R202-A206 PolarHBondContact O-N 3.09Å; R202-L220 HydrophobicContact CB-CD2 4.33Å; R202-Y222 WeakPolarHBondContact CB-OH 3.36Å; R202-Y222 WeakPolarHBondContact CD-OH 3.5Å
203	F	92.3	Very high	85	Confident	1 Å²	1	59 Å²	59	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-59.7	-48.7	175.2	179.8	-96.2	0	0	0	112.5	V179 A199 I200 N205 A206 S207 L213 V216 L220 V227 I230 V231 L234	V179-F203 HydrophobicContact CG2-CZ 4.47Å; A199-F203 VanDerWaalsContact O-CB 3.27Å; A199-F203 WeakPolarHBondContact O-CB 3.34Å; A199-F203 PolarHBondContact O-N 2.86Å; I200-F203 WeakPolarHBondContact O-CB 3.22Å; I200-F203 PolarHBondContact O-N 2.94Å; F203-N205 VanDerWaalsContact C-N 3.29Å; F203-N205 PolarHBondContact O-N 3.42Å; F203-A206 PolarHBondContact O-N 3.49Å; F203-S207 VanDerWaalsContact O-CB 3.29Å; F203-S207 WeakPolarHBondContact O-CB 3.39Å; F203-S207 PolarHBondContact O-N 3.2Å; F203-L213 HydrophobicContact CE2-CD2 4.07Å; F203-L213 HydrophobicContact CZ-CD2 3.83Å; F203-V216 HydrophobicContact CD2-CG1 3.96Å; F203-V216 HydrophobicContact CE2-CG1 3.75Å; F203-L220 HydrophobicContact CB-CD1 4.2Å; F203-L220 HydrophobicContact CD2-CD1 4.07Å; F203-V227 HydrophobicContact CD2-CG1 4.4Å; F203-V227 HydrophobicContact CE2-CG1 3.66Å; F203-V227 HydrophobicContact CZ-CG1 4.33Å; F203-I230 HydrophobicContact CB-CD1 4.35Å; F203-I230 HydrophobicContact CB-CG2 4.24Å; F203-I230 HydrophobicContact CD1-CG2 3.6Å; F203-I230 HydrophobicContact CE1-CG2 4.15Å; F203-I230 HydrophobicContact CG-CG2 3.91Å; F203-V231 HydrophobicContact CE1-CG2 3.84Å; F203-V231 HydrophobicContact CE2-CG2 4.22Å; F203-V231 HydrophobicContact CZ-CG2 3.41Å; F203-V231 VanDerWaalsContact CZ-CG2 3.41Å; F203-L234 HydrophobicContact CD1-CD1 4.15Å; F203-L234 HydrophobicContact CE1-CD1 3.99Å
204	L	90.8	Very high	86.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-39	179.6	-71.6	173.3	0	0	0	112.2	L181 I185 I188 V189 M192 I200 V201 S207 L234	L181-L204 HydrophobicContact CD1-CD2 3.92Å; L181-L204 HydrophobicContact CD2-CD2 3.62Å; L181-L204 HydrophobicContact CG-CD2 4.44Å; I185-L204 WeakPolarHBondContact CD1-O 3.18Å; I185-L204 HydrophobicContact CG2-CB 4.11Å; I188-L204 HydrophobicContact CG2-CD1 4.08Å; V189-L204 HydrophobicContact CG2-CD1 4.36Å; M192-L204 HydrophobicContact CE-CD1 3.8Å; I200-L204 HydrophobicContact CG2-CD1 3.97Å; I200-L204 HydrophobicContact CG2-CG 4.21Å; I200-L204 WeakPolarHBondContact O-CB 3.3Å; I200-L204 VanDerWaalsContact O-CG 3.26Å; I200-L204 WeakPolarHBondContact O-CG 3.43Å; I200-L204 PolarHBondContact O-N 3.12Å; V201-L204 PolarHBondContact O-N 3.07Å; L204-S207 PolarHBondContact O-OG 2.68Å; L204-L234 HydrophobicContact CD2-CD1 3.86Å; L204-L234 HydrophobicContact CD2-CD2 4.25Å
205	N	90.2	Very high	87.5	Confident	109 Å²	109	51.2 Å²	51.2	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-70.1	-31	178.8	-71.8	-30.3	0	0	0	113.4	V201 R202 F203	V201-N205 PolarHBondContact O-N 3.29Å; V201-N205 VanDerWaalsContact O-N 3.1Å; V201-N205 PolarHBondContact O-ND2 3.47Å; R202-N205 PolarHBondContact O-N 2.98Å; F203-N205 VanDerWaalsContact C-N 3.29Å; F203-N205 PolarHBondContact O-N 3.42Å
206	A	90.4	Very high	88.8	Confident	13 Å²	13	44.5 Å²	44.5	11%	0.107	25%	0.249	C	C	.	.	H	α-helix	trans	-89.4	-20.3	176.6	0	0	0	0	0	113.3	R202 F203 T208 V216 L220	R202-A206 PolarHBondContact O-N 3.09Å; F203-A206 PolarHBondContact O-N 3.49Å; A206-T208 PolarHBondContact O-N 3.38Å; A206-V216 HydrophobicContact CB-CG1 4.25Å; A206-L220 HydrophobicContact CB-CD1 3.99Å; A206-L220 HydrophobicContact CB-CD2 3.79Å; A206-L220 HydrophobicContact CB-CG 3.99Å
207	S	86.7	Confident	89.9	Confident	16 Å²	16	42.3 Å²	42.3	11%	0.112	24%	0.24	C	C	.	.			trans	-64.6	120.9	-177.5	69.4	0	0	0	0	111	F203 L204	F203-S207 VanDerWaalsContact O-CB 3.29Å; F203-S207 WeakPolarHBondContact O-CB 3.39Å; F203-S207 PolarHBondContact O-N 3.2Å; L204-S207 PolarHBondContact O-OG 2.68Å
208	T	89.1	Confident	90.5	Very high	50 Å²	50	47.9 Å²	47.9	31%	0.307	25%	0.251	S	S	.	.			trans	-132.7	143.6	174.9	51.6	0	0	0	0	108.8	A206 V210 K211	A206-T208 PolarHBondContact O-N 3.38Å; T208-V210 PolarHBondContact O-N 3.28Å; T208-V210 VanDerWaalsContact O-N 3.13Å; T208-K211 PolarHBondContact O-N 3.5Å; T208-K211 WeakPolarHBondContact OG1-CD 3.45Å; T208-K211 VanDerWaalsContact OG1-CG 3.31Å; T208-K211 WeakPolarHBondContact OG1-CG 3.39Å
209	P	87.5	Confident	90.9	Very high	29 Å²	29	48.1 Å²	48.1	19%	0.188	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-6.9	-178.6	30	-35.8	0	0	0	113.1	L180 I243 P245 L246 V310	L180-P209 HydrophobicContact CD1-CB 4.19Å; P209-I243 HydrophobicContact CB-CD1 3.9Å; P209-P245 WeakPolarHBondContact O-CA 3.42Å; P209-L246 HydrophobicContact CB-CD1 3.94Å; P209-L246 HydrophobicContact CB-CG 4.31Å; P209-L246 HydrophobicContact CG-CD1 4.13Å; P209-L246 PolarHBondContact O-N 3.22Å; P209-V310 HydrophobicContact CB-CG2 4.48Å; P209-V310 HydrophobicContact CG-CG2 3.9Å
210	V	89.3	Confident	91.1	Very high	75 Å²	75	49.2 Å²	49.2	46%	0.455	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-24.8	-179.2	-175.8	0	0	0	0	111.8	T208 P245 L246	T208-V210 PolarHBondContact O-N 3.28Å; T208-V210 VanDerWaalsContact O-N 3.13Å; V210-P245 WeakPolarHBondContact O-CB 3.46Å; V210-L246 HydrophobicContact CG2-CB 4.46Å
211	K	90.5	Very high	91.3	Very high	76 Å²	76	56 Å²	56	33%	0.33	29%	0.285	S	S	.	.	S	Bend	trans	-96.9	135.2	-178	-67.4	179.6	-177.6	176	0	110.4	A178 T208 A215 V216 E219	A178-K211 VanDerWaalsContact CB-O 3.31Å; A178-K211 WeakPolarHBondContact CB-O 3.44Å; T208-K211 PolarHBondContact O-N 3.5Å; T208-K211 WeakPolarHBondContact OG1-CD 3.45Å; T208-K211 VanDerWaalsContact OG1-CG 3.31Å; T208-K211 WeakPolarHBondContact OG1-CG 3.39Å; K211-A215 HydrophobicContact CB-CB 4.49Å; K211-V216 HydrophobicContact CB-CG2 4.06Å; K211-E219 IonicContact NZ-OE1 3.89Å; K211-E219 IonicContact NZ-OE2 2.82Å; K211-E219 PolarHBondContact NZ-OE2 3.08Å
212	P	92.4	Very high	91.6	Very high	44 Å²	44	55.3 Å²	55.3	29%	0.286	28%	0.278	S	S	.	.			trans	-65.7	154.3	168.1	28.6	-33.6	0	0	0	110.9	Y176 H177 L214 A215 V216 P245	Y176-P212 WeakPolarHBondContact O-CB 3.5Å; H177-P212 CarbonylContact O-C 3.58Å; H177-P212 WeakPolarHBondContact O-CA 3.26Å; P212-L214 PolarHBondContact O-N 3.06Å; P212-A215 HydrophobicContact CG-CB 3.97Å; P212-A215 WeakPolarHBondContact O-CB 3.35Å; P212-A215 PolarHBondContact O-N 3.29Å; P212-V216 PolarHBondContact O-N 3.07Å; P212-P245 HydrophobicContact CB-CG 3.81Å; P212-P245 HydrophobicContact CG-CG 4.49Å
213	L	92.3	Very high	91.7	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-34.9	-179.9	-78.5	175.9	0	0	0	111.9	I173 P175 H177 V179 F203 A215 V216 A217 V227 F228 V231	I173-L213 HydrophobicContact CG2-CD1 3.57Å; P175-L213 PolarHBondContact O-N 2.8Å; H177-L213 HydrophobicContact CB-CD1 4.47Å; H177-L213 WeakPolarHBondContact O-CB 3.41Å; H177-L213 WeakPolarHBondContact O-CG 3.3Å; H177-L213 PolarHBondContact O-N 3.45Å; V179-L213 HydrophobicContact CG2-CD1 4.26Å; V179-L213 HydrophobicContact CG2-CD2 3.67Å; V179-L213 HydrophobicContact CG2-CG 4.25Å; F203-L213 HydrophobicContact CE2-CD2 4.07Å; F203-L213 HydrophobicContact CZ-CD2 3.83Å; L213-A215 VanDerWaalsContact C-N 3.31Å; L213-A215 PolarHBondContact O-N 2.99Å; L213-V216 PolarHBondContact O-N 3.07Å; L213-A217 WeakPolarHBondContact O-CB 3.13Å; L213-A217 PolarHBondContact O-N 2.88Å; L213-V227 HydrophobicContact CB-CG1 4.4Å; L213-V227 HydrophobicContact CD2-CG1 3.79Å; L213-F228 HydrophobicContact CD1-CD1 4.39Å; L213-F228 HydrophobicContact CD1-CE1 4.21Å; L213-V231 HydrophobicContact CD1-CG2 4.37Å; L213-V231 HydrophobicContact CD2-CG2 3.91Å
214	L	93.2	Very high	91.7	Very high	42 Å²	42	56.4 Å²	56.4	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-59.8	-39.6	173.9	-176.5	63.5	0	0	0	112.7	P175 P212 R218 F401	P175-L214 HydrophobicContact CB-CB 4.2Å; P175-L214 PolarHBondContact O-N 2.93Å; P212-L214 PolarHBondContact O-N 3.06Å; L214-R218 WeakPolarHBondContact O-CG 3.4Å; L214-R218 PolarHBondContact O-N 3.21Å; L214-R218 VanDerWaalsContact O-N 3.16Å; L214-F401 HydrophobicContact CD2-CE2 3.66Å; L214-F401 HydrophobicContact CD2-CZ 3.99Å
215	A	93.4	Very high	91.8	Very high	36 Å²	36	62.1 Å²	62.1	30%	0.298	32%	0.322	S	S	.	.	H	α-helix	trans	-70.4	-39.5	177.5	0	0	0	0	0	111.2	K211 P212 L213 A217 R218 E219	K211-A215 HydrophobicContact CB-CB 4.49Å; P212-A215 HydrophobicContact CG-CB 3.97Å; P212-A215 WeakPolarHBondContact O-CB 3.35Å; P212-A215 PolarHBondContact O-N 3.29Å; L213-A215 VanDerWaalsContact C-N 3.31Å; L213-A215 PolarHBondContact O-N 2.99Å; A215-A217 VanDerWaalsContact C-N 3.34Å; A215-R218 PolarHBondContact O-N 3.38Å; A215-E219 PolarHBondContact O-N 2.96Å
216	V	93.2	Very high	91.9	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.018	31%	0.311	C	S	.	.	H	α-helix	trans	-64.5	-39.3	175.4	-179.4	0	0	0	0	111.3	F203 A206 K211 P212 L213 E219 L220	F203-V216 HydrophobicContact CD2-CG1 3.96Å; F203-V216 HydrophobicContact CE2-CG1 3.75Å; A206-V216 HydrophobicContact CB-CG1 4.25Å; K211-V216 HydrophobicContact CB-CG2 4.06Å; P212-V216 PolarHBondContact O-N 3.07Å; L213-V216 PolarHBondContact O-N 3.07Å; V216-E219 PolarHBondContact O-N 3.21Å; V216-L220 HydrophobicContact CG1-CD1 3.9Å; V216-L220 WeakPolarHBondContact O-CG 3.41Å; V216-L220 PolarHBondContact O-N 3.28Å; V216-L220 VanDerWaalsContact O-N 3.14Å
217	A	94.4	Very high	92	Very high	5 Å²	5	60 Å²	60	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-60.3	-45.4	175.5	0	0	0	0	0	111.6	L213 A215 L220 D221 Y222 V227	L213-A217 WeakPolarHBondContact O-CB 3.13Å; L213-A217 PolarHBondContact O-N 2.88Å; A215-A217 VanDerWaalsContact C-N 3.34Å; A217-L220 PolarHBondContact O-N 3.35Å; A217-D221 PolarHBondContact O-N 3.07Å; A217-D221 VanDerWaalsContact O-N 3.12Å; A217-Y222 PolarHBondContact O-N 2.92Å; A217-V227 HydrophobicContact CB-CG2 3.86Å
218	R	93.7	Very high	92.2	Very high	181 Å²	181	61 Å²	61	68%	0.683	31%	0.309	S	S	*	.	H	α-helix	trans	-66.2	-34.8	176.6	-70.8	176.3	-179	170.4	1.1	113.3	L214 A215 L220	L214-R218 WeakPolarHBondContact O-CG 3.4Å; L214-R218 PolarHBondContact O-N 3.21Å; L214-R218 VanDerWaalsContact O-N 3.16Å; A215-R218 PolarHBondContact O-N 3.38Å; R218-L220 VanDerWaalsContact C-N 3.35Å
219	E	93.5	Very high	92.2	Very high	106 Å²	106	66.2 Å²	66.2	50%	0.495	32%	0.323	S	S	.	.	H	α-helix	trans	-71.5	-30.7	178.9	-175.9	173.1	173.6	0	0	112.7	K211 A215 V216	K211-E219 IonicContact NZ-OE1 3.89Å; K211-E219 IonicContact NZ-OE2 2.82Å; K211-E219 PolarHBondContact NZ-OE2 3.08Å; A215-E219 PolarHBondContact O-N 2.96Å; V216-E219 PolarHBondContact O-N 3.21Å
220	L	93.1	Very high	92.3	Very high	35 Å²	35	65.4 Å²	65.4	18%	0.183	32%	0.317	C	S	.	.	H	α-helix	trans	-96.4	-2.1	-179	-65.5	174.5	0	0	0	114	R202 F203 A206 V216 A217 R218 Y222	R202-L220 HydrophobicContact CB-CD2 4.33Å; F203-L220 HydrophobicContact CB-CD1 4.2Å; F203-L220 HydrophobicContact CD2-CD1 4.07Å; A206-L220 HydrophobicContact CB-CD1 3.99Å; A206-L220 HydrophobicContact CB-CD2 3.79Å; A206-L220 HydrophobicContact CB-CG 3.99Å; V216-L220 HydrophobicContact CG1-CD1 3.9Å; V216-L220 WeakPolarHBondContact O-CG 3.41Å; V216-L220 PolarHBondContact O-N 3.28Å; V216-L220 VanDerWaalsContact O-N 3.14Å; A217-L220 PolarHBondContact O-N 3.35Å; R218-L220 VanDerWaalsContact C-N 3.35Å; L220-Y222 HydrophobicContact CB-CD1 4.11Å; L220-Y222 HydrophobicContact CB-CD2 3.78Å; L220-Y222 HydrophobicContact CB-CE1 4.25Å; L220-Y222 HydrophobicContact CB-CE2 3.94Å; L220-Y222 HydrophobicContact CB-CG 3.86Å; L220-Y222 HydrophobicContact CD1-CD2 3.84Å; L220-Y222 HydrophobicContact CD1-CE2 3.73Å; L220-Y222 HydrophobicContact CG-CD2 4.49Å; L220-Y222 HydrophobicContact CG-CE2 4.4Å; L220-Y222 VanDerWaalsContact O-CD1 3.25Å; L220-Y222 WeakPolarHBondContact O-CD1 3.39Å; L220-Y222 WeakPolarHBondContact O-CE1 3.45Å; L220-Y222 PolarHBondContact O-N 3.41Å
221	D	93	Very high	92.2	Very high	151 Å²	151	61.8 Å²	61.8	81%	0.807	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	42.1	-168.6	-62.2	-47.2	0	0	0	112.4	A217	A217-D221 PolarHBondContact O-N 3.07Å; A217-D221 VanDerWaalsContact O-N 3.12Å
222	Y	93.8	Very high	91.9	Very high	32 Å²	32	63 Å²	63	13%	0.125	30%	0.302	C	S	.	.			trans	-101.2	145.1	177	-69.4	-9	0	0	0	111.8	A199 R202 A217 L220 V227 I230	A199-Y222 VanDerWaalsContact CA-OH 3.32Å; A199-Y222 WeakPolarHBondContact CA-OH 3.42Å; A199-Y222 HydrophobicContact CB-CE2 4.28Å; R202-Y222 WeakPolarHBondContact CB-OH 3.36Å; R202-Y222 WeakPolarHBondContact CD-OH 3.5Å; A217-Y222 PolarHBondContact O-N 2.92Å; L220-Y222 HydrophobicContact CB-CD1 4.11Å; L220-Y222 HydrophobicContact CB-CD2 3.78Å; L220-Y222 HydrophobicContact CB-CE1 4.25Å; L220-Y222 HydrophobicContact CB-CE2 3.94Å; L220-Y222 HydrophobicContact CB-CG 3.86Å; L220-Y222 HydrophobicContact CD1-CD2 3.84Å; L220-Y222 HydrophobicContact CD1-CE2 3.73Å; L220-Y222 HydrophobicContact CG-CD2 4.49Å; L220-Y222 HydrophobicContact CG-CE2 4.4Å; L220-Y222 VanDerWaalsContact O-CD1 3.25Å; L220-Y222 WeakPolarHBondContact O-CD1 3.39Å; L220-Y222 WeakPolarHBondContact O-CE1 3.45Å; L220-Y222 PolarHBondContact O-N 3.41Å; Y222-V227 HydrophobicContact CD2-CG2 4.25Å; Y222-I230 HydrophobicContact CE2-CD1 4.49Å
223	D	93.6	Very high	91.5	Very high	123 Å²	123	64.2 Å²	64.2	66%	0.658	30%	0.304	S	S	*	.			trans	-65.3	141.6	166.9	-66.5	-38	0	0	0	110.1	E225 Q226 V227	D223-E225 PolarHBondContact O-N 2.87Å; D223-Q226 HydrophobicContact CB-CB 4.42Å; D223-Q226 WeakPolarHBondContact O-CB 3.39Å; D223-Q226 PolarHBondContact O-N 2.85Å; D223-V227 PolarHBondContact O-N 3.13Å
224	L	92.3	Very high	91.1	Very high	56 Å²	56	64.4 Å²	64.4	29%	0.293	30%	0.304	S	S	.	.	H	α-helix	trans	-58.5	-35.1	-179.4	-174.4	67.2	0	0	0	111.8	P175 V227 F228	P175-L224 HydrophobicContact CB-CD1 4.04Å; P175-L224 HydrophobicContact CB-CD2 3.81Å; P175-L224 HydrophobicContact CG-CD2 4.35Å; L224-V227 PolarHBondContact O-N 2.81Å; L224-F228 HydrophobicContact CD1-CD1 4.35Å; L224-F228 HydrophobicContact CD1-CE1 3.64Å; L224-F228 HydrophobicContact CD1-CE2 4.26Å; L224-F228 HydrophobicContact CD1-CZ 3.6Å; L224-F228 HydrophobicContact CD2-CE1 4.5Å; L224-F228 HydrophobicContact CD2-CE2 3.75Å; L224-F228 HydrophobicContact CD2-CZ 3.61Å; L224-F228 HydrophobicContact CG-CD1 4.48Å; L224-F228 HydrophobicContact CG-CD2 4.2Å; L224-F228 HydrophobicContact CG-CE1 3.91Å; L224-F228 HydrophobicContact CG-CE2 3.58Å; L224-F228 HydrophobicContact CG-CZ 3.42Å; L224-F228 VanDerWaalsContact CG-CZ 3.42Å; L224-F228 VanDerWaalsContact O-CG 3.26Å; L224-F228 WeakPolarHBondContact O-CG 3.1Å; L224-F228 PolarHBondContact O-N 3.2Å
225	E	91.8	Very high	90.5	Very high	121 Å²	121	63 Å²	63	57%	0.565	30%	0.297	S	S	*	.	H	α-helix	trans	-64.2	-40.3	175.6	-167.1	-174.6	166	0	0	112	D223 V227 F228 R229	D223-E225 PolarHBondContact O-N 2.87Å; E225-V227 VanDerWaalsContact C-N 3.34Å; E225-F228 PolarHBondContact O-N 2.93Å; E225-R229 WeakPolarHBondContact O-CG 3.21Å; E225-R229 PolarHBondContact O-N 3.03Å; E225-R229 IonicContact OE1-CZ 2.72Å; E225-R229 IonicContact OE1-NE 3.91Å; E225-R229 PolarHBondContact OE1-NE 3.29Å; E225-R229 IonicContact OE1-NH2 2.8Å; E225-R229 PolarHBondContact OE1-NH2 3.33Å
226	Q	91.8	Very high	89.8	Confident	76 Å²	76	65.5 Å²	65.5	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-63.9	-42.9	175.6	-174.7	179.6	7	0	0	110.7	D223 R229 I230	D223-Q226 HydrophobicContact CB-CB 4.42Å; D223-Q226 WeakPolarHBondContact O-CB 3.39Å; D223-Q226 PolarHBondContact O-N 2.85Å; Q226-R229 PolarHBondContact O-N 3.2Å; Q226-I230 HydrophobicContact CG-CD1 4.27Å; Q226-I230 WeakPolarHBondContact O-CG1 3.28Å; Q226-I230 PolarHBondContact O-N 3.1Å
227	V	92.5	Very high	89	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-46.9	174.8	172.5	0	0	0	0	110.7	F203 L213 A217 Y222 D223 L224 E225 R229 I230 V231	F203-V227 HydrophobicContact CD2-CG1 4.4Å; F203-V227 HydrophobicContact CE2-CG1 3.66Å; F203-V227 HydrophobicContact CZ-CG1 4.33Å; L213-V227 HydrophobicContact CB-CG1 4.4Å; L213-V227 HydrophobicContact CD2-CG1 3.79Å; A217-V227 HydrophobicContact CB-CG2 3.86Å; Y222-V227 HydrophobicContact CD2-CG2 4.25Å; D223-V227 PolarHBondContact O-N 3.13Å; L224-V227 PolarHBondContact O-N 2.81Å; E225-V227 VanDerWaalsContact C-N 3.34Å; V227-R229 PolarHBondContact O-N 3.1Å; V227-I230 PolarHBondContact O-N 3.35Å; V227-V231 HydrophobicContact CG1-CG2 4.2Å; V227-V231 WeakPolarHBondContact O-CB 3.34Å; V227-V231 VanDerWaalsContact O-CG2 3.23Å; V227-V231 WeakPolarHBondContact O-CG2 3.25Å; V227-V231 PolarHBondContact O-N 2.88Å
228	F	90.7	Very high	88	Confident	39 Å²	39	68.7 Å²	68.7	17%	0.171	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-42.1	177.3	-66.8	-19.9	0	0	0	112.8	I173 P175 L213 L224 E225 I230 V231 Q232	I173-F228 HydrophobicContact CB-CD1 4.09Å; I173-F228 HydrophobicContact CB-CE1 4.33Å; I173-F228 HydrophobicContact CB-CG 4.5Å; I173-F228 HydrophobicContact CG2-CD1 3.67Å; I173-F228 HydrophobicContact CG2-CE1 3.76Å; I173-F228 WeakPolarHBondContact O-CZ 3.16Å; P175-F228 HydrophobicContact CB-CZ 4.35Å; L213-F228 HydrophobicContact CD1-CD1 4.39Å; L213-F228 HydrophobicContact CD1-CE1 4.21Å; L224-F228 HydrophobicContact CD1-CD1 4.35Å; L224-F228 HydrophobicContact CD1-CE1 3.64Å; L224-F228 HydrophobicContact CD1-CE2 4.26Å; L224-F228 HydrophobicContact CD1-CZ 3.6Å; L224-F228 HydrophobicContact CD2-CE1 4.5Å; L224-F228 HydrophobicContact CD2-CE2 3.75Å; L224-F228 HydrophobicContact CD2-CZ 3.61Å; L224-F228 HydrophobicContact CG-CD1 4.48Å; L224-F228 HydrophobicContact CG-CD2 4.2Å; L224-F228 HydrophobicContact CG-CE1 3.91Å; L224-F228 HydrophobicContact CG-CE2 3.58Å; L224-F228 HydrophobicContact CG-CZ 3.42Å; L224-F228 VanDerWaalsContact CG-CZ 3.42Å; L224-F228 VanDerWaalsContact O-CG 3.26Å; L224-F228 WeakPolarHBondContact O-CG 3.1Å; L224-F228 PolarHBondContact O-N 3.2Å; E225-F228 PolarHBondContact O-N 2.93Å; F228-I230 PolarHBondContact O-N 2.9Å; F228-V231 PolarHBondContact O-N 3.34Å; F228-Q232 VanDerWaalsContact O-CB 3.3Å; F228-Q232 WeakPolarHBondContact O-CB 3.46Å; F228-Q232 WeakPolarHBondContact O-CG 3.44Å; F228-Q232 PolarHBondContact O-N 3.3Å
229	R	89.2	Confident	87.4	Confident	158 Å²	158	61.4 Å²	61.4	60%	0.596	29%	0.29	S	S	*	.	H	α-helix	trans	-61.5	-42.1	175.5	-70.6	175.5	-174.6	-158.4	4.7	112.1	E225 Q226 V227 H233	E225-R229 WeakPolarHBondContact O-CG 3.21Å; E225-R229 PolarHBondContact O-N 3.03Å; E225-R229 IonicContact OE1-CZ 2.72Å; E225-R229 IonicContact OE1-NE 3.91Å; E225-R229 PolarHBondContact OE1-NE 3.29Å; E225-R229 IonicContact OE1-NH2 2.8Å; E225-R229 PolarHBondContact OE1-NH2 3.33Å; Q226-R229 PolarHBondContact O-N 3.2Å; V227-R229 PolarHBondContact O-N 3.1Å; R229-H233 WeakPolarHBondContact O-CB 3.44Å; R229-H233 PolarHBondContact O-N 2.83Å
230	I	90.1	Very high	86.8	Confident	12 Å²	12	56.4 Å²	56.4	6%	0.062	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-46.8	176	-67.9	167.3	0	0	0	110.4	A199 I200 F203 Y222 Q226 V227 F228 H233 L234	A199-I230 HydrophobicContact CB-CD1 4.32Å; I200-I230 HydrophobicContact CG1-CG1 4.18Å; I200-I230 HydrophobicContact CG1-CG2 4.12Å; F203-I230 HydrophobicContact CB-CD1 4.35Å; F203-I230 HydrophobicContact CB-CG2 4.24Å; F203-I230 HydrophobicContact CD1-CG2 3.6Å; F203-I230 HydrophobicContact CE1-CG2 4.15Å; F203-I230 HydrophobicContact CG-CG2 3.91Å; Y222-I230 HydrophobicContact CE2-CD1 4.49Å; Q226-I230 HydrophobicContact CG-CD1 4.27Å; Q226-I230 WeakPolarHBondContact O-CG1 3.28Å; Q226-I230 PolarHBondContact O-N 3.1Å; V227-I230 PolarHBondContact O-N 3.35Å; F228-I230 PolarHBondContact O-N 2.9Å; I230-H233 WeakPolarHBondContact O-CB 3.26Å; I230-H233 PolarHBondContact O-N 3.14Å; I230-L234 HydrophobicContact CG2-CD1 4.18Å; I230-L234 WeakPolarHBondContact O-CG 3.49Å; I230-L234 PolarHBondContact O-N 3.3Å
231	V	87.8	Confident	86.3	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-43.2	-178	176.3	0	0	0	0	111.2	I173 V179 F203 L213 V227 F228 H233 L234 I235 V242	I173-V231 HydrophobicContact CD1-CB 4.03Å; I173-V231 HydrophobicContact CD1-CG1 3.61Å; V179-V231 HydrophobicContact CG2-CB 4.38Å; V179-V231 HydrophobicContact CG2-CG1 3.58Å; V179-V231 HydrophobicContact CG2-CG2 3.77Å; F203-V231 HydrophobicContact CE1-CG2 3.84Å; F203-V231 HydrophobicContact CE2-CG2 4.22Å; F203-V231 HydrophobicContact CZ-CG2 3.41Å; F203-V231 VanDerWaalsContact CZ-CG2 3.41Å; L213-V231 HydrophobicContact CD1-CG2 4.37Å; L213-V231 HydrophobicContact CD2-CG2 3.91Å; V227-V231 HydrophobicContact CG1-CG2 4.2Å; V227-V231 WeakPolarHBondContact O-CB 3.34Å; V227-V231 VanDerWaalsContact O-CG2 3.23Å; V227-V231 WeakPolarHBondContact O-CG2 3.25Å; V227-V231 PolarHBondContact O-N 2.88Å; F228-V231 PolarHBondContact O-N 3.34Å; V231-H233 VanDerWaalsContact C-N 3.27Å; V231-H233 PolarHBondContact O-N 2.82Å; V231-L234 PolarHBondContact O-N 2.83Å; V231-I235 HydrophobicContact CG1-CD1 3.7Å; V231-I235 WeakPolarHBondContact O-CB 3.38Å; V231-I235 WeakPolarHBondContact O-CD1 3.44Å; V231-I235 VanDerWaalsContact O-CG1 3.26Å; V231-I235 WeakPolarHBondContact O-CG1 3.3Å; V231-I235 PolarHBondContact O-N 3.23Å; V231-V242 HydrophobicContact CG1-CG2 3.81Å
232	Q	84.4	Confident	86	Confident	101 Å²	101	48.8 Å²	48.8	47%	0.472	23%	0.226	S	C	.	.	H	α-helix	trans	-57.3	-41	172	-76.3	174	-12.7	0	0	111.6	I173 F228 I235 Y236	I173-Q232 HydrophobicContact CD1-CG 3.6Å; I173-Q232 HydrophobicContact CG1-CG 4.44Å; F228-Q232 VanDerWaalsContact O-CB 3.3Å; F228-Q232 WeakPolarHBondContact O-CB 3.46Å; F228-Q232 WeakPolarHBondContact O-CG 3.44Å; F228-Q232 PolarHBondContact O-N 3.3Å; Q232-I235 PolarHBondContact O-N 3.11Å; Q232-Y236 VanDerWaalsContact O-CB 3.28Å; Q232-Y236 WeakPolarHBondContact O-CB 3.23Å; Q232-Y236 PolarHBondContact O-N 2.87Å
233	H	84.2	Confident	85.7	Confident	70 Å²	70	48.1 Å²	48.1	32%	0.324	23%	0.225	S	C	.	.	H	α-helix	trans	-64.4	-45.1	175.8	-174.1	82.3	0	0	0	112.3	R229 I230 V231 I235 Y236 W237	R229-H233 WeakPolarHBondContact O-CB 3.44Å; R229-H233 PolarHBondContact O-N 2.83Å; I230-H233 WeakPolarHBondContact O-CB 3.26Å; I230-H233 PolarHBondContact O-N 3.14Å; V231-H233 VanDerWaalsContact C-N 3.27Å; V231-H233 PolarHBondContact O-N 2.82Å; H233-I235 VanDerWaalsContact C-N 3.3Å; H233-I235 PolarHBondContact O-N 3.22Å; H233-Y236 WeakPolarHBondContact O-CB 3.32Å; H233-Y236 PolarHBondContact O-N 2.93Å; H233-W237 AromaticContact CD2-CD1 3.62Å; H233-W237 AromaticContact CD2-NE1 3.74Å; H233-W237 AromaticContact CE1-CD1 3.69Å; H233-W237 AromaticContact CE1-NE1 2.99Å; H233-W237 PolarHBondContact CE1-NE1 3.25Å; H233-W237 AromaticContact CG-CD1 3.99Å; H233-W237 AromaticContact ND1-CD1 4Å; H233-W237 AromaticContact ND1-NE1 3.56Å; H233-W237 AromaticContact NE2-CD1 3.4Å; H233-W237 AromaticContact NE2-NE1 3.07Å; H233-W237 PolarHBondContact NE2-NE1 3.48Å; H233-W237 PolarHBondContact O-N 3.05Å; H233-W237 VanDerWaalsContact O-N 3.08Å
234	L	83.3	Confident	85.4	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-63.9	-37	177.8	-68.5	172.2	0	0	0	112.3	F203 L204 I230 V231 W237 G238 K239 A240	F203-L234 HydrophobicContact CD1-CD1 4.15Å; F203-L234 HydrophobicContact CE1-CD1 3.99Å; L204-L234 HydrophobicContact CD2-CD1 3.86Å; L204-L234 HydrophobicContact CD2-CD2 4.25Å; I230-L234 HydrophobicContact CG2-CD1 4.18Å; I230-L234 WeakPolarHBondContact O-CG 3.49Å; I230-L234 PolarHBondContact O-N 3.3Å; V231-L234 PolarHBondContact O-N 2.83Å; L234-W237 PolarHBondContact O-N 3.44Å; L234-G238 PolarHBondContact O-N 2.92Å; L234-K239 HydrophobicContact CD2-CB 4.42Å; L234-K239 PolarHBondContact O-N 2.87Å; L234-A240 HydrophobicContact CB-CB 3.6Å; L234-A240 HydrophobicContact CD1-CB 4.41Å; L234-A240 PolarHBondContact O-N 3.29Å
235	I	80.7	Confident	85.3	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.062	19%	0.186	C	C	.	.	H	α-helix	trans	-67.3	-47.7	173	-71.5	162.5	0	0	0	109.4	Q150 M171 I173 V231 Q232 H233 W237 G238 A240 V242	Q150-I235 WeakPolarHBondContact CG-O 3.17Å; Q150-I235 PolarHBondContact NE2-O 3.09Å; Q150-I235 VanDerWaalsContact OE1-CG2 3.27Å; M171-I235 HydrophobicContact CE-CB 4.23Å; M171-I235 HydrophobicContact CE-CD1 3.22Å; M171-I235 HydrophobicContact CE-CG1 4.02Å; M171-I235 HydrophobicContact CE-CG2 3.44Å; M171-I235 VanDerWaalsContact CE-CG2 3.44Å; I173-I235 HydrophobicContact CD1-CD1 4.03Å; V231-I235 HydrophobicContact CG1-CD1 3.7Å; V231-I235 WeakPolarHBondContact O-CB 3.38Å; V231-I235 WeakPolarHBondContact O-CD1 3.44Å; V231-I235 VanDerWaalsContact O-CG1 3.26Å; V231-I235 WeakPolarHBondContact O-CG1 3.3Å; V231-I235 PolarHBondContact O-N 3.23Å; Q232-I235 PolarHBondContact O-N 3.11Å; H233-I235 VanDerWaalsContact C-N 3.3Å; H233-I235 PolarHBondContact O-N 3.22Å; I235-W237 PolarHBondContact O-N 3.07Å; I235-G238 PolarHBondContact O-N 2.94Å; I235-A240 HydrophobicContact CG1-CB 4.44Å; I235-A240 WeakPolarHBondContact CG1-O 3.42Å; I235-V242 HydrophobicContact CD1-CB 4.44Å; I235-V242 HydrophobicContact CD1-CG2 3.36Å
236	Y	77.8	Confident	85.2	Confident	90 Å²	90	35.3 Å²	35.3	35%	0.353	16%	0.161	S	C	.	.	H	α-helix	trans	-51.8	-38.7	177.9	177.8	-95.9	0	0	0	111.5	N147 Q232 H233	N147-Y236 HydrophobicContact CB-CE1 4.02Å; N147-Y236 VanDerWaalsContact CG-O 3.3Å; N147-Y236 PolarHBondContact ND2-O 3.29Å; Q232-Y236 VanDerWaalsContact O-CB 3.28Å; Q232-Y236 WeakPolarHBondContact O-CB 3.23Å; Q232-Y236 PolarHBondContact O-N 2.87Å; H233-Y236 WeakPolarHBondContact O-CB 3.32Å; H233-Y236 PolarHBondContact O-N 2.93Å
237	W	77.2	Confident	85	Confident	52 Å²	52	34.7 Å²	34.7	20%	0.197	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	2.6	176.1	-66.2	114.3	0	0	0	116.4	S145 N147 H233 L234 I235 K239	S145-W237 VanDerWaalsContact CB-CH2 3.42Å; S145-W237 WeakPolarHBondContact OG-CH2 3.39Å; N147-W237 HydrophobicContact CB-CE3 4.19Å; N147-W237 HydrophobicContact CB-CZ3 4.15Å; N147-W237 WeakPolarHBondContact ND2-CA 3.44Å; H233-W237 AromaticContact CD2-CD1 3.62Å; H233-W237 AromaticContact CD2-NE1 3.74Å; H233-W237 AromaticContact CE1-CD1 3.69Å; H233-W237 AromaticContact CE1-NE1 2.99Å; H233-W237 PolarHBondContact CE1-NE1 3.25Å; H233-W237 AromaticContact CG-CD1 3.99Å; H233-W237 AromaticContact ND1-CD1 4Å; H233-W237 AromaticContact ND1-NE1 3.56Å; H233-W237 AromaticContact NE2-CD1 3.4Å; H233-W237 AromaticContact NE2-NE1 3.07Å; H233-W237 PolarHBondContact NE2-NE1 3.48Å; H233-W237 PolarHBondContact O-N 3.05Å; H233-W237 VanDerWaalsContact O-N 3.08Å; L234-W237 PolarHBondContact O-N 3.44Å; I235-W237 PolarHBondContact O-N 3.07Å; W237-K239 VanDerWaalsContact C-N 3.29Å; W237-K239 HydrophobicContact CB-CG 3.94Å; W237-K239 PolarHBondContact O-N 3.17Å
238	G	74.2	Confident	84.8	Confident	22 Å²	22	39 Å²	39	23%	0.227	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	25.9	-178.2	0	0	0	0	0	113.9	L182 L234 I235	L182-G238 WeakPolarHBondContact CD1-O 3.49Å; L234-G238 PolarHBondContact O-N 2.92Å; I235-G238 PolarHBondContact O-N 2.94Å
239	K	79.9	Confident	84.6	Confident	29 Å²	29	38.8 Å²	38.8	13%	0.126	19%	0.188	C	C	.	.	S	Bend	trans	-99.9	-20.1	-177.8	-58.5	-57.5	-180	176.2	0	113.7	L182 E183 I188 L234 W237	L182-K239 PolarHBondContact N-O 3.34Å; E183-K239 IonicContact OE1-NZ 3.73Å; E183-K239 PolarHBondContact OE1-NZ 3.2Å; E183-K239 IonicContact OE2-NZ 2.62Å; E183-K239 PolarHBondContact OE2-NZ 3.1Å; I188-K239 HydrophobicContact CD1-CB 4.31Å; L234-K239 HydrophobicContact CD2-CB 4.42Å; L234-K239 PolarHBondContact O-N 2.87Å; W237-K239 VanDerWaalsContact C-N 3.29Å; W237-K239 HydrophobicContact CB-CG 3.94Å; W237-K239 PolarHBondContact O-N 3.17Å
240	A	82.1	Confident	84.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.3	-178.8	0	0	0	0	0	111.6	V179 L180 L181 L234 I235	V179-A240 HydrophobicContact CG1-CB 3.76Å; L180-A240 CarbonylContact O-C 3.59Å; L180-A240 WeakPolarHBondContact O-CA 3.43Å; L181-A240 HydrophobicContact CD2-CB 4.17Å; L234-A240 HydrophobicContact CB-CB 3.6Å; L234-A240 HydrophobicContact CD1-CB 4.41Å; L234-A240 PolarHBondContact O-N 3.29Å; I235-A240 HydrophobicContact CG1-CB 4.44Å; I235-A240 WeakPolarHBondContact CG1-O 3.42Å
241	L	82.8	Confident	84.7	Confident	26 Å²	26	32.4 Å²	32.4	14%	0.136	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.6	167.4	-65.9	178	0	0	0	108.7	L180 L182	L180-L241 HydrophobicContact CB-CB 4.37Å; L180-L241 PolarHBondContact N-O 3.13Å; L180-L241 PolarHBondContact O-N 2.85Å; L182-L241 HydrophobicContact CD1-CD1 4.49Å; L182-L241 HydrophobicContact CD1-CD2 4.46Å; L182-L241 HydrophobicContact CD1-CG 4.07Å; L182-L241 HydrophobicContact CD2-CD1 3.71Å; L182-L241 HydrophobicContact CD2-CG 3.94Å; L182-L241 HydrophobicContact CG-CD1 4.44Å; L182-L241 HydrophobicContact CG-CG 4.14Å
242	V	86	Confident	84.9	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.9	164.8	174.2	0	0	0	0	107.9	M171 I173 H177 A178 V231 I235 R434	M171-V242 HydrophobicContact CE-CG2 4.4Å; M171-V242 HydrophobicContact SD-CB 4.44Å; I173-V242 HydrophobicContact CD1-CG2 4.23Å; I173-V242 HydrophobicContact CG1-CG2 4.38Å; I173-V242 HydrophobicContact CG2-CG2 4.37Å; H177-V242 HydrophobicContact CB-CG1 3.47Å; H177-V242 VanDerWaalsContact CB-CG1 3.47Å; A178-V242 WeakPolarHBondContact O-CA 3.45Å; V231-V242 HydrophobicContact CG1-CG2 3.81Å; I235-V242 HydrophobicContact CD1-CB 4.44Å; I235-V242 HydrophobicContact CD1-CG2 3.36Å; V242-R434 PolarHBondContact O-NH1 3.22Å; V242-R434 PolarHBondContact O-NH2 3.26Å; V242-R434 VanDerWaalsContact O-NH2 3.13Å
243	I	87.3	Confident	85.3	Confident	17 Å²	17	28.7 Å²	28.7	9%	0.087	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	175.8	176	60.5	162	0	0	0	108.3	H177 A178 L180 P209 L246	H177-I243 CarbonylContact C-O 3.53Å; A178-I243 CarbonylContact C-O 3.59Å; A178-I243 HydrophobicContact CB-CG1 4.17Å; A178-I243 PolarHBondContact N-O 3.41Å; A178-I243 PolarHBondContact O-N 2.96Å; L180-I243 HydrophobicContact CB-CD1 3.86Å; L180-I243 HydrophobicContact CB-CG1 3.97Å; L180-I243 HydrophobicContact CB-CG2 3.93Å; L180-I243 HydrophobicContact CD1-CD1 4.43Å; L180-I243 HydrophobicContact CD2-CD1 4.46Å; L180-I243 HydrophobicContact CD2-CG2 4.03Å; L180-I243 HydrophobicContact CG-CD1 4.49Å; P209-I243 HydrophobicContact CB-CD1 3.9Å; I243-L246 HydrophobicContact CD1-CD2 4.29Å; I243-L246 HydrophobicContact CD1-CG 4.37Å
244	F	87.8	Confident	85.5	Confident	3 Å²	3	27 Å²	27	1%	0.013	15%	0.146	C	C	.	.			trans	-84.4	151.1	164.4	-69.7	-98.7	0	0	0	110.6	Y176 H177 L246 H322 H395 D428 L431	Y176-F244 HydrophobicContact CD2-CD1 4.19Å; Y176-F244 AromaticContact CD2-CE1 3.82Å; Y176-F244 HydrophobicContact CD2-CE1 3.82Å; Y176-F244 HydrophobicContact CE2-CD1 4.29Å; Y176-F244 AromaticContact CE2-CE1 3.47Å; Y176-F244 HydrophobicContact CE2-CE1 3.47Å; Y176-F244 VanDerWaalsContact CE2-CE1 3.47Å; Y176-F244 HydrophobicContact CE2-CZ 4.15Å; H177-F244 AromaticContact CD2-CE1 3.78Å; H177-F244 AromaticContact CD2-CZ 3.88Å; H177-F244 AromaticContact NE2-CZ 3.75Å; F244-L246 PolarHBondContact O-N 2.7Å; F244-H322 AromaticContact CD1-CE1 3.6Å; F244-H322 AromaticContact CD2-CE1 3.5Å; F244-H322 VanDerWaalsContact CD2-CE1 3.5Å; F244-H322 WeakPolarHBondContact CD2-CE1 3.48Å; F244-H322 AromaticContact CD2-NE2 3.14Å; F244-H322 WeakPolarHBondContact CD2-NE2 3.47Å; F244-H322 AromaticContact CE1-CE1 3.64Å; F244-H322 AromaticContact CE2-CE1 3.58Å; F244-H322 AromaticContact CE2-NE2 3.15Å; F244-H322 WeakPolarHBondContact CE2-NE2 3.5Å; F244-H322 AromaticContact CG-CE1 3.52Å; F244-H322 AromaticContact CG-NE2 3.67Å; F244-H322 AromaticContact CZ-CE1 3.65Å; F244-H322 AromaticContact CZ-NE2 3.66Å; F244-H395 AromaticContact CE1-CE1 3.8Å; F244-H395 AromaticContact CE1-NE2 3.25Å; F244-H395 VanDerWaalsContact CE1-NE2 3.25Å; F244-H395 WeakPolarHBondContact CE1-NE2 3.38Å; F244-H395 AromaticContact CZ-CE1 3.67Å; F244-H395 AromaticContact CZ-NE2 3.6Å; F244-D428 HydrophobicContact CE2-CB 4.41Å; F244-D428 WeakPolarHBondContact CZ-OD2 3.28Å; F244-L431 HydrophobicContact CD2-CD1 3.9Å; F244-L431 HydrophobicContact CE2-CD1 3.58Å; F244-L431 HydrophobicContact CE2-CG 4.38Å
245	P	89.5	Confident	85.5	Confident	19 Å²	19	27.6 Å²	27.6	12%	0.123	15%	0.149	C	C	.	.			trans	-54.8	130.4	175.4	-19.1	28.8	0	0	0	110.1	Y176 A178 P209 V210 P212 T247 N250	Y176-P245 WeakPolarHBondContact O-CD 3.28Å; Y176-P245 WeakPolarHBondContact O-CG 3.39Å; A178-P245 HydrophobicContact CB-CB 4.18Å; A178-P245 HydrophobicContact CB-CG 4Å; P209-P245 WeakPolarHBondContact O-CA 3.42Å; V210-P245 WeakPolarHBondContact O-CB 3.46Å; P212-P245 HydrophobicContact CB-CG 3.81Å; P212-P245 HydrophobicContact CG-CG 4.49Å; P245-T247 PolarHBondContact O-N 3.01Å; P245-N250 PolarHBondContact O-ND2 3.5Å
246	L	89.1	Confident	85.5	Confident	10 Å²	10	32.4 Å²	32.4	5%	0.052	18%	0.181	C	C	.	.			trans	-68.1	104.3	-179	-60.7	177	0	0	0	110	P209 V210 I243 F244 Y252 I306 V310 L313	P209-L246 HydrophobicContact CB-CD1 3.94Å; P209-L246 HydrophobicContact CB-CG 4.31Å; P209-L246 HydrophobicContact CG-CD1 4.13Å; P209-L246 PolarHBondContact O-N 3.22Å; V210-L246 HydrophobicContact CG2-CB 4.46Å; I243-L246 HydrophobicContact CD1-CD2 4.29Å; I243-L246 HydrophobicContact CD1-CG 4.37Å; F244-L246 PolarHBondContact O-N 2.7Å; L246-Y252 HydrophobicContact CD2-CE1 4.43Å; L246-Y252 WeakPolarHBondContact CD2-OH 3.34Å; L246-I306 HydrophobicContact CD1-CG2 4.11Å; L246-V310 HydrophobicContact CD1-CG2 3.34Å; L246-L313 HydrophobicContact CD2-CD1 3.66Å
247	T	88.2	Confident	85.3	Confident	62 Å²	62	33.1 Å²	33.1	38%	0.38	19%	0.188	S	C	.	.			trans	-110.8	155.6	173	85.2	0	0	0	0	111.1	P245 A249 N250 L291	P245-T247 PolarHBondContact O-N 3.01Å; T247-A249 PolarHBondContact O-N 2.94Å; T247-A249 VanDerWaalsContact O-N 3.14Å; T247-A249 PolarHBondContact OG1-N 3.47Å; T247-N250 PolarHBondContact N-ND2 2.71Å; T247-N250 PolarHBondContact O-N 3.46Å; T247-N250 VanDerWaalsContact O-N 3.15Å; T247-N250 PolarHBondContact OG1-N 2.93Å; T247-N250 PolarHBondContact OG1-OD1 3.35Å; T247-L291 WeakPolarHBondContact O-CD2 3.22Å
248	E	87.6	Confident	85.2	Confident	91 Å²	91	31.5 Å²	31.5	43%	0.425	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.5	177.3	-66.4	-172.5	176.5	0	0	113.1	S292 I295 R302	E248-S292 WeakPolarHBondContact O-CB 3.48Å; E248-S292 PolarHBondContact O-N 3.26Å; E248-S292 PolarHBondContact O-OG 3.43Å; E248-S292 VanDerWaalsContact O-OG 3.1Å; E248-I295 HydrophobicContact CG-CD1 4.22Å; E248-R302 IonicContact OE1-CZ 3.59Å; E248-R302 IonicContact OE1-NH1 2.66Å; E248-R302 PolarHBondContact OE1-NH1 2.76Å
249	A	88.1	Confident	85.1	Confident	35 Å²	35	34 Å²	34	29%	0.289	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-17.6	178.7	0	0	0	0	0	113.7	T247	T247-A249 PolarHBondContact O-N 2.94Å; T247-A249 VanDerWaalsContact O-N 3.14Å; T247-A249 PolarHBondContact OG1-N 3.47Å
250	N	89.9	Confident	84.9	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	22%	0.215	C	C	.	.			trans	-64.2	138.9	-179.7	-64.6	4.4	0	0	0	110.1	P245 T247 Y252 P290 L291 Q320	P245-N250 PolarHBondContact O-ND2 3.5Å; T247-N250 PolarHBondContact N-ND2 2.71Å; T247-N250 PolarHBondContact O-N 3.46Å; T247-N250 VanDerWaalsContact O-N 3.15Å; T247-N250 PolarHBondContact OG1-N 2.93Å; T247-N250 PolarHBondContact OG1-OD1 3.35Å; N250-Y252 HydrophobicContact CB-CE2 3.71Å; N250-Y252 WeakPolarHBondContact CB-OH 3.39Å; N250-Y252 PolarHBondContact ND2-OH 2.93Å; N250-P290 WeakPolarHBondContact O-CA 3.32Å; N250-L291 PolarHBondContact O-N 2.84Å; N250-Q320 VanDerWaalsContact CG-NE2 3.27Å; N250-Q320 PolarHBondContact ND2-NE2 3.34Å
251	V	91.8	Very high	84.4	Confident	32 Å²	32	43.2 Å²	43.2	19%	0.194	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.1	-179.5	-177.6	0	0	0	0	109.1	P288 P290 L321	V251-P288 HydrophobicContact CG1-CB 3.52Å; V251-P290 HydrophobicContact CG2-CB 4.39Å; V251-L321 HydrophobicContact CB-CB 4.46Å; V251-L321 HydrophobicContact CG1-CB 4.47Å; V251-L321 HydrophobicContact CG1-CD1 4.45Å; V251-L321 PolarHBondContact O-N 3.41Å
252	Y	91.3	Very high	83.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.9	178.1	-60.5	-81.6	0	0	0	110.9	L246 N250 V289 L291 V309 L313 M319 Q320	L246-Y252 HydrophobicContact CD2-CE1 4.43Å; L246-Y252 WeakPolarHBondContact CD2-OH 3.34Å; N250-Y252 HydrophobicContact CB-CE2 3.71Å; N250-Y252 WeakPolarHBondContact CB-OH 3.39Å; N250-Y252 PolarHBondContact ND2-OH 2.93Å; Y252-V289 PolarHBondContact N-O 3.4Å; Y252-V289 PolarHBondContact O-N 3.2Å; Y252-L291 HydrophobicContact CD2-CB 4.38Å; Y252-L291 HydrophobicContact CE2-CB 4.05Å; Y252-L291 HydrophobicContact CE2-CD1 4.42Å; Y252-L291 HydrophobicContact CE2-CD2 4.42Å; Y252-V309 HydrophobicContact CD2-CG1 4.44Å; Y252-V309 HydrophobicContact CE2-CG1 4.3Å; Y252-L313 HydrophobicContact CD1-CD2 4.17Å; Y252-L313 HydrophobicContact CE1-CD1 3.98Å; Y252-L313 HydrophobicContact CE1-CD2 4.12Å; Y252-M319 WeakPolarHBondContact CA-O 3.41Å; Y252-Q320 HydrophobicContact CD1-CB 4.05Å; Y252-Q320 HydrophobicContact CD1-CG 4.48Å; Y252-Q320 HydrophobicContact CE1-CB 3.83Å; Y252-Q320 HydrophobicContact CE1-CG 4.08Å
253	V	91.5	Very high	83.3	Confident	23 Å²	23	52.6 Å²	52.6	14%	0.139	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	158.3	172.9	68.5	0	0	0	0	109.2	D255 L318 M319 L321	V253-D255 PolarHBondContact O-N 3.38Å; V253-L318 WeakPolarHBondContact O-CA 3.35Å; V253-L318 WeakPolarHBondContact O-CD2 3.43Å; V253-M319 HydrophobicContact CG1-CG 3.3Å; V253-M319 HydrophobicContact CG1-SD 3.73Å; V253-M319 PolarHBondContact N-O 3.19Å; V253-M319 PolarHBondContact O-N 3.44Å; V253-L321 HydrophobicContact CB-CD1 4.08Å; V253-L321 HydrophobicContact CG1-CD1 3.79Å; V253-L321 HydrophobicContact CG1-CD2 3.99Å; V253-L321 HydrophobicContact CG1-CG 3.82Å
254	V	89.4	Confident	82.9	Confident	35 Å²	35	55 Å²	55	21%	0.212	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129.5	171.2	178	0	0	0	0	109.5	L282 F285 F317 L318	V254-L282 HydrophobicContact CG2-CB 4.28Å; V254-L282 HydrophobicContact CG2-CD2 4.03Å; V254-L282 WeakPolarHBondContact CG2-O 3.38Å; V254-F285 HydrophobicContact CG2-CB 3.93Å; V254-F285 PolarHBondContact N-O 2.98Å; V254-F285 VanDerWaalsContact N-O 3.1Å; V254-F317 WeakPolarHBondContact CA-O 3.27Å; V254-L318 HydrophobicContact CG2-CD2 4.24Å
255	D	83.9	Confident	82.4	Confident	16 Å²	16	55.4 Å²	55.4	9%	0.086	31%	0.313	C	S	.	.			trans	-63.9	124.2	175.6	175.8	-9.2	0	0	0	109.5	V253 E257 A258 F317 M319	V253-D255 PolarHBondContact O-N 3.38Å; D255-E257 PolarHBondContact O-N 3.16Å; D255-E257 PolarHBondContact OD1-N 3.18Å; D255-A258 HydrophobicContact CB-CB 4.13Å; D255-A258 WeakPolarHBondContact O-CB 3.26Å; D255-A258 PolarHBondContact O-N 3.42Å; D255-A258 VanDerWaalsContact O-N 3.12Å; D255-F317 PolarHBondContact N-O 2.99Å; D255-M319 HydrophobicContact CB-CB 4.37Å; D255-M319 HydrophobicContact CB-CG 4.49Å; D255-M319 HydrophobicContact CB-SD 4.46Å
256	P	80.7	Confident	81.9	Confident	113 Å²	113	60.8 Å²	60.8	73%	0.734	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.4	-179.2	26.3	-34.9	0	0	0	113.2	A258 M319	P256-A258 VanDerWaalsContact C-N 3.34Å; P256-M319 WeakPolarHBondContact CD-SD 3.34Å
257	E	73.8	Confident	81.5	Confident	106 Å²	106	66.7 Å²	66.7	50%	0.495	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-0.9	178.6	-59.9	-167.7	165.7	0	0	113.1	D255 D259	D255-E257 PolarHBondContact O-N 3.16Å; D255-E257 PolarHBondContact OD1-N 3.18Å; E257-D259 PolarHBondContact O-N 2.86Å; E257-D259 VanDerWaalsContact O-N 3.15Å
258	A	74.3	Confident	81.3	Confident	17 Å²	17	69.3 Å²	69.3	14%	0.14	36%	0.362	C	S	.	.			trans	-62.1	119.5	-176.2	0	0	0	0	0	112	D255 P256 L260 F317	D255-A258 HydrophobicContact CB-CB 4.13Å; D255-A258 WeakPolarHBondContact O-CB 3.26Å; D255-A258 PolarHBondContact O-N 3.42Å; D255-A258 VanDerWaalsContact O-N 3.12Å; P256-A258 VanDerWaalsContact C-N 3.34Å; A258-L260 HydrophobicContact CB-CD2 4.46Å; A258-L260 PolarHBondContact O-N 2.99Å; A258-F317 HydrophobicContact CB-CD1 4.04Å
259	D	73.1	Confident	81.1	Confident	76 Å²	76	65 Å²	65	41%	0.406	34%	0.342	S	S	.	.			trans	-72.8	88.8	174.2	-177.7	11.8	0	0	0	111.3	E257 T261 R262	E257-D259 PolarHBondContact O-N 2.86Å; E257-D259 VanDerWaalsContact O-N 3.15Å; D259-T261 PolarHBondContact O-N 3.41Å; D259-T261 VanDerWaalsContact OD1-CB 3.26Å; D259-T261 WeakPolarHBondContact OD1-CB 3.35Å; D259-T261 WeakPolarHBondContact OD1-CG2 3.46Å; D259-T261 PolarHBondContact OD1-N 3.33Å; D259-T261 PolarHBondContact OD1-OG1 2.89Å; D259-T261 PolarHBondContact OD2-OG1 2.95Å; D259-R262 HydrophobicContact CB-CG 4.16Å; D259-R262 WeakPolarHBondContact O-CG 3.23Å; D259-R262 WeakPolarHBondContact OD2-CG 3.49Å
260	L	74.6	Confident	81	Confident	110 Å²	110	66.6 Å²	66.6	58%	0.576	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-9.3	176	-59.3	179.9	0	0	0	113.1	A258 R262 L282 F317	A258-L260 HydrophobicContact CB-CD2 4.46Å; A258-L260 PolarHBondContact O-N 2.99Å; L260-R262 PolarHBondContact O-N 3.32Å; L260-L282 HydrophobicContact CD2-CD1 3.65Å; L260-F317 HydrophobicContact CD2-CD1 3.95Å; L260-F317 HydrophobicContact CD2-CE1 4.2Å
261	T	72.8	Confident	80.7	Confident	111 Å²	111	72.1 Å²	72.1	68%	0.681	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-9.7	-178.9	76.3	0	0	0	0	112.9	D259 T263	D259-T261 PolarHBondContact O-N 3.41Å; D259-T261 VanDerWaalsContact OD1-CB 3.26Å; D259-T261 WeakPolarHBondContact OD1-CB 3.35Å; D259-T261 WeakPolarHBondContact OD1-CG2 3.46Å; D259-T261 PolarHBondContact OD1-N 3.33Å; D259-T261 PolarHBondContact OD1-OG1 2.89Å; D259-T261 PolarHBondContact OD2-OG1 2.95Å; T261-T263 VanDerWaalsContact C-N 3.28Å; T261-T263 PolarHBondContact O-N 3.2Å
262	R	71.5	Confident	80.3	Confident	122 Å²	122	74.4 Å²	74.4	46%	0.46	38%	0.383	S	S	.	.			trans	-71.6	76.6	-176.8	-60.6	-176.9	69	147	1.4	112.6	D259 L260 S264 L265 R266	D259-R262 HydrophobicContact CB-CG 4.16Å; D259-R262 WeakPolarHBondContact O-CG 3.23Å; D259-R262 WeakPolarHBondContact OD2-CG 3.49Å; L260-R262 PolarHBondContact O-N 3.32Å; R262-S264 PolarHBondContact O-N 3.3Å; R262-S264 VanDerWaalsContact O-N 3.09Å; R262-L265 HydrophobicContact CB-CB 4.34Å; R262-L265 HydrophobicContact CB-CD1 4.09Å; R262-L265 HydrophobicContact CB-CG 4.27Å; R262-L265 PolarHBondContact O-N 2.91Å; R262-R266 PolarHBondContact O-N 3.21Å
263	T	72.5	Confident	79.9	Confident	102 Å²	102	75.2 Å²	75.2	63%	0.626	39%	0.387	S	S	*	.	H	α-helix	trans	-53.9	-31.7	178.9	57.1	0	0	0	0	113.5	T261 L265 R266 K267	T261-T263 VanDerWaalsContact C-N 3.28Å; T261-T263 PolarHBondContact O-N 3.2Å; T263-L265 PolarHBondContact O-N 3.04Å; T263-R266 PolarHBondContact O-N 2.96Å; T263-K267 WeakPolarHBondContact O-CG 3.35Å; T263-K267 PolarHBondContact O-N 2.88Å; T263-K267 VanDerWaalsContact O-N 3.09Å
264	S	78.8	Confident	78.6	Confident	67 Å²	67	84.1 Å²	84.1	47%	0.469	42%	0.42	S	S	.	.	H	α-helix	trans	-64.3	-38.2	177	60.6	0	0	0	0	113	R262 K268	R262-S264 PolarHBondContact O-N 3.3Å; R262-S264 VanDerWaalsContact O-N 3.09Å; S264-K268 WeakPolarHBondContact O-CG 2.92Å; S264-K268 PolarHBondContact O-N 3.06Å
265	L	78.3	Confident	77.6	Confident	13 Å²	13	87.3 Å²	87.3	7%	0.068	44%	0.443	C	S	.	.	H	α-helix	trans	-74.6	-39.5	179.7	-69.8	179.5	0	0	0	110.6	R262 T263 K267 K268 F269 W311 H315 F317	R262-L265 HydrophobicContact CB-CB 4.34Å; R262-L265 HydrophobicContact CB-CD1 4.09Å; R262-L265 HydrophobicContact CB-CG 4.27Å; R262-L265 PolarHBondContact O-N 2.91Å; T263-L265 PolarHBondContact O-N 3.04Å; L265-K267 VanDerWaalsContact C-N 3.35Å; L265-K267 PolarHBondContact O-N 2.91Å; L265-K268 HydrophobicContact CD2-CD 4.44Å; L265-K268 WeakPolarHBondContact O-CB 3.48Å; L265-K268 PolarHBondContact O-N 3.46Å; L265-K268 VanDerWaalsContact O-N 3.13Å; L265-F269 PolarHBondContact O-N 2.99Å; L265-W311 HydrophobicContact CB-CH2 4.27Å; L265-W311 WeakPolarHBondContact O-CH2 3.5Å; L265-H315 HydrophobicContact CD1-CB 4.36Å; L265-F317 HydrophobicContact CB-CE2 4.5Å; L265-F317 HydrophobicContact CB-CZ 4.3Å; L265-F317 HydrophobicContact CD1-CE2 4.17Å; L265-F317 HydrophobicContact CD1-CZ 3.9Å
266	R	78.6	Confident	77.2	Confident	131 Å²	131	88.4 Å²	88.4	49%	0.494	45%	0.452	S	S	.	.	H	α-helix	trans	-57.8	-45.9	174.3	-177.2	175.2	172.9	176.8	0.5	112.4	R262 T263 K268 F269 E270 M278	R262-R266 PolarHBondContact O-N 3.21Å; T263-R266 PolarHBondContact O-N 2.96Å; R266-K268 VanDerWaalsContact C-N 3.34Å; R266-K268 PolarHBondContact O-N 3.05Å; R266-F269 WeakPolarHBondContact O-CB 3.39Å; R266-F269 PolarHBondContact O-N 3.28Å; R266-E270 IonicContact CZ-OE1 3.79Å; R266-E270 IonicContact NE-OE1 2.76Å; R266-E270 PolarHBondContact NE-OE1 3.07Å; R266-E270 VanDerWaalsContact NE-OE1 3.07Å; R266-E270 IonicContact NH2-OE1 3.97Å; R266-E270 WeakPolarHBondContact O-CG 3.25Å; R266-E270 PolarHBondContact O-N 3.1Å; R266-M278 HydrophobicContact CB-SD 4.12Å; R266-M278 HydrophobicContact CG-CB 4.36Å; R266-M278 HydrophobicContact CG-SD 4.28Å
267	K	81.7	Confident	77.3	Confident	135 Å²	135	85.7 Å²	85.7	59%	0.587	44%	0.435	S	S	*	.	H	α-helix	trans	-61.9	-40.8	175.3	-72.4	-178.7	-179.8	-177.7	0	112	T263 L265 F269 E270 Q271	T263-K267 WeakPolarHBondContact O-CG 3.35Å; T263-K267 PolarHBondContact O-N 2.88Å; T263-K267 VanDerWaalsContact O-N 3.09Å; L265-K267 VanDerWaalsContact C-N 3.35Å; L265-K267 PolarHBondContact O-N 2.91Å; K267-F269 VanDerWaalsContact C-N 3.33Å; K267-F269 PolarHBondContact O-N 2.82Å; K267-E270 PolarHBondContact O-N 3.19Å; K267-Q271 WeakPolarHBondContact O-CB 3.26Å; K267-Q271 WeakPolarHBondContact O-CG 3.47Å; K267-Q271 PolarHBondContact O-N 2.66Å
268	K	83.7	Confident	77.7	Confident	116 Å²	116	81.2 Å²	81.2	50%	0.504	41%	0.414	S	S	.	.	H	α-helix	trans	-63.8	-38.2	175.4	-74.7	178.5	-179.9	-173.8	0	112.2	S264 L265 R266 Q271 T272 W311	S264-K268 WeakPolarHBondContact O-CG 2.92Å; S264-K268 PolarHBondContact O-N 3.06Å; L265-K268 HydrophobicContact CD2-CD 4.44Å; L265-K268 WeakPolarHBondContact O-CB 3.48Å; L265-K268 PolarHBondContact O-N 3.46Å; L265-K268 VanDerWaalsContact O-N 3.13Å; R266-K268 VanDerWaalsContact C-N 3.34Å; R266-K268 PolarHBondContact O-N 3.05Å; K268-Q271 PolarHBondContact O-N 3.09Å; K268-T272 WeakPolarHBondContact O-CB 3.48Å; K268-T272 PolarHBondContact O-N 3.13Å; K268-T272 PolarHBondContact O-OG1 3.2Å; K268-W311 HydrophobicContact CB-CZ2 4.45Å
269	F	83.4	Confident	78.2	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-62.3	-51.4	175	-173	-93.6	0	0	0	111	L265 R266 K267 Q271 T272 F273 M278 I281 M308 W311 L312	L265-F269 PolarHBondContact O-N 2.99Å; R266-F269 WeakPolarHBondContact O-CB 3.39Å; R266-F269 PolarHBondContact O-N 3.28Å; K267-F269 VanDerWaalsContact C-N 3.33Å; K267-F269 PolarHBondContact O-N 2.82Å; F269-Q271 VanDerWaalsContact C-N 3.25Å; F269-Q271 PolarHBondContact O-N 3.25Å; F269-T272 PolarHBondContact O-N 3.21Å; F269-F273 HydrophobicContact CD1-CD2 4.25Å; F269-F273 AromaticContact CD2-CD2 3.52Å; F269-F273 HydrophobicContact CD2-CD2 3.52Å; F269-F273 AromaticContact CD2-CE2 3.74Å; F269-F273 HydrophobicContact CD2-CE2 3.74Å; F269-F273 HydrophobicContact CE1-CB 4.22Å; F269-F273 HydrophobicContact CE1-CD2 4.03Å; F269-F273 HydrophobicContact CE1-CG 4.45Å; F269-F273 AromaticContact CE2-CD2 3.31Å; F269-F273 HydrophobicContact CE2-CD2 3.31Å; F269-F273 AromaticContact CE2-CE2 3.46Å; F269-F273 HydrophobicContact CE2-CE2 3.46Å; F269-F273 VanDerWaalsContact CE2-CE2 3.46Å; F269-F273 HydrophobicContact CE2-CG 4.28Å; F269-F273 HydrophobicContact CG-CD2 4.03Å; F269-F273 HydrophobicContact CZ-CB 4.36Å; F269-F273 AromaticContact CZ-CD2 3.58Å; F269-F273 HydrophobicContact CZ-CD2 3.58Å; F269-F273 HydrophobicContact CZ-CE2 4.12Å; F269-F273 HydrophobicContact CZ-CG 4.14Å; F269-F273 PolarHBondContact O-N 3.06Å; F269-M278 HydrophobicContact CB-CB 4.44Å; F269-M278 HydrophobicContact CB-SD 4.27Å; F269-M278 HydrophobicContact CD1-CB 3.65Å; F269-M278 HydrophobicContact CD1-CG 4.28Å; F269-M278 HydrophobicContact CE1-CB 4.15Å; F269-M278 HydrophobicContact CG-CB 4.11Å; F269-M278 HydrophobicContact CG-CG 4.32Å; F269-M278 HydrophobicContact CG-SD 4.5Å; F269-I281 HydrophobicContact CE1-CD1 3.71Å; F269-I281 HydrophobicContact CZ-CD1 3.55Å; F269-M308 HydrophobicContact CZ-CB 4.48Å; F269-M308 HydrophobicContact CZ-CG 4.13Å; F269-W311 HydrophobicContact CB-CH2 3.59Å; F269-W311 HydrophobicContact CB-CZ2 3.84Å; F269-W311 HydrophobicContact CB-CZ3 3.97Å; F269-W311 AromaticContact CD2-CD2 3.59Å; F269-W311 HydrophobicContact CD2-CD2 3.59Å; F269-W311 AromaticContact CD2-CE2 4Å; F269-W311 AromaticContact CD2-CE3 3.28Å; F269-W311 HydrophobicContact CD2-CE3 3.28Å; F269-W311 HydrophobicContact CD2-CG 4.32Å; F269-W311 AromaticContact CD2-CH2 3.89Å; F269-W311 HydrophobicContact CD2-CH2 3.89Å; F269-W311 HydrophobicContact CD2-CZ2 4.14Å; F269-W311 AromaticContact CD2-CZ3 3.44Å; F269-W311 HydrophobicContact CD2-CZ3 3.44Å; F269-W311 VanDerWaalsContact CD2-CZ3 3.44Å; F269-W311 HydrophobicContact CE2-CD2 4.2Å; F269-W311 AromaticContact CE2-CE3 3.83Å; F269-W311 HydrophobicContact CE2-CE3 3.83Å; F269-W311 HydrophobicContact CE2-CZ3 4.3Å; F269-W311 HydrophobicContact CG-CE3 4.32Å; F269-W311 HydrophobicContact CG-CH2 4.2Å; F269-W311 HydrophobicContact CG-CZ3 4.08Å; F269-L312 HydrophobicContact CE2-CD2 4.44Å; F269-L312 HydrophobicContact CE2-CG 4.48Å
270	E	84.4	Confident	78.8	Confident	69 Å²	69	85.9 Å²	85.9	32%	0.322	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-31.2	-179.5	-69.1	169.8	-176.8	0	0	111.9	R266 K267 F273 Y274	R266-E270 IonicContact CZ-OE1 3.79Å; R266-E270 IonicContact NE-OE1 2.76Å; R266-E270 PolarHBondContact NE-OE1 3.07Å; R266-E270 VanDerWaalsContact NE-OE1 3.07Å; R266-E270 IonicContact NH2-OE1 3.97Å; R266-E270 WeakPolarHBondContact O-CG 3.25Å; R266-E270 PolarHBondContact O-N 3.1Å; K267-E270 PolarHBondContact O-N 3.19Å; E270-F273 CarbonylContact O-C 3.51Å; E270-Y274 WeakPolarHBondContact O-CA 3.48Å
271	Q	84.8	Confident	79.4	Confident	121 Å²	121	81.1 Å²	81.1	57%	0.565	41%	0.414	S	S	*	.	H	α-helix	trans	-72.5	-32.3	170.8	-74.8	172.8	-10.7	0	0	113.5	K267 K268 F269 Y274	K267-Q271 WeakPolarHBondContact O-CB 3.26Å; K267-Q271 WeakPolarHBondContact O-CG 3.47Å; K267-Q271 PolarHBondContact O-N 2.66Å; K268-Q271 PolarHBondContact O-N 3.09Å; F269-Q271 VanDerWaalsContact C-N 3.25Å; F269-Q271 PolarHBondContact O-N 3.25Å; Q271-Y274 VanDerWaalsContact O-CE1 3.3Å; Q271-Y274 WeakPolarHBondContact O-CE1 3.28Å; Q271-Y274 WeakPolarHBondContact O-CE2 3.42Å; Q271-Y274 PolarHBondContact O-OH 3.06Å
272	T	83	Confident	80.1	Confident	79 Å²	79	76.7 Å²	76.7	49%	0.485	39%	0.386	S	S	.	.	H	α-helix	trans	-81	-39.9	-179.1	-54.5	0	0	0	0	110.7	K268 F269	K268-T272 WeakPolarHBondContact O-CB 3.48Å; K268-T272 PolarHBondContact O-N 3.13Å; K268-T272 PolarHBondContact O-OG1 3.2Å; F269-T272 PolarHBondContact O-N 3.21Å
273	F	82.3	Confident	80.8	Confident	17 Å²	17	74.3 Å²	74.3	8%	0.075	39%	0.388	C	S	.	.	S	Bend	trans	-116	77.9	-178.7	-55.5	-78.4	0	0	0	108.5	F269 E270 S275 C276 R307 M308 W311	F269-F273 HydrophobicContact CD1-CD2 4.25Å; F269-F273 AromaticContact CD2-CD2 3.52Å; F269-F273 HydrophobicContact CD2-CD2 3.52Å; F269-F273 AromaticContact CD2-CE2 3.74Å; F269-F273 HydrophobicContact CD2-CE2 3.74Å; F269-F273 HydrophobicContact CE1-CB 4.22Å; F269-F273 HydrophobicContact CE1-CD2 4.03Å; F269-F273 HydrophobicContact CE1-CG 4.45Å; F269-F273 AromaticContact CE2-CD2 3.31Å; F269-F273 HydrophobicContact CE2-CD2 3.31Å; F269-F273 AromaticContact CE2-CE2 3.46Å; F269-F273 HydrophobicContact CE2-CE2 3.46Å; F269-F273 VanDerWaalsContact CE2-CE2 3.46Å; F269-F273 HydrophobicContact CE2-CG 4.28Å; F269-F273 HydrophobicContact CG-CD2 4.03Å; F269-F273 HydrophobicContact CZ-CB 4.36Å; F269-F273 AromaticContact CZ-CD2 3.58Å; F269-F273 HydrophobicContact CZ-CD2 3.58Å; F269-F273 HydrophobicContact CZ-CE2 4.12Å; F269-F273 HydrophobicContact CZ-CG 4.14Å; F269-F273 PolarHBondContact O-N 3.06Å; E270-F273 CarbonylContact O-C 3.51Å; F273-S275 PolarHBondContact O-N 3.45Å; F273-C276 PolarHBondContact O-N 3.47Å; F273-R307 HydrophobicContact CE1-CB 4.1Å; F273-R307 HydrophobicContact CZ-CB 4.32Å; F273-M308 HydrophobicContact CB-CE 3.95Å; F273-M308 HydrophobicContact CD1-CE 3.81Å; F273-M308 HydrophobicContact CD1-CG 3.68Å; F273-M308 HydrophobicContact CD2-CG 4.37Å; F273-M308 HydrophobicContact CE1-CG 3.63Å; F273-M308 HydrophobicContact CE2-CG 4.33Å; F273-M308 HydrophobicContact CG-CE 4.04Å; F273-M308 HydrophobicContact CG-CG 4.06Å; F273-M308 HydrophobicContact CZ-CB 4.49Å; F273-M308 HydrophobicContact CZ-CG 3.97Å; F273-W311 HydrophobicContact CE2-CB 3.99Å; F273-W311 AromaticContact CE2-CG 3.94Å; F273-W311 HydrophobicContact CE2-CG 3.94Å; F273-W311 HydrophobicContact CZ-CB 4.18Å
274	Y	65.4	Low	81.6	Confident	210 Å²	210	70.6 Å²	70.6	82%	0.824	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-1.6	-172.3	-68.9	-79.2	0	0	0	116.8	E270 Q271	E270-Y274 WeakPolarHBondContact O-CA 3.48Å; Q271-Y274 VanDerWaalsContact O-CE1 3.3Å; Q271-Y274 WeakPolarHBondContact O-CE1 3.28Å; Q271-Y274 WeakPolarHBondContact O-CE2 3.42Å; Q271-Y274 PolarHBondContact O-OH 3.06Å
275	S	68.6	Low	82.1	Confident	102 Å²	102	67.4 Å²	67.4	71%	0.713	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-5	-174.7	57	0	0	0	0	115	F273	F273-S275 PolarHBondContact O-N 3.45Å
276	C	75.4	Confident	82.5	Confident	39 Å²	39	70.6 Å²	70.6	26%	0.264	37%	0.368	S	S	.	.			trans	-130.9	126.7	-170.4	-61.3	0	0	0	0	113.5	F273 M278 I281 M308	F273-C276 PolarHBondContact O-N 3.47Å; C276-M278 PolarHBondContact O-N 2.73Å; C276-I281 HydrophobicContact CB-CD1 3.59Å; C276-I281 HydrophobicContact CB-CG1 4.38Å; C276-M308 HydrophobicContact CB-CE 3.97Å; C276-M308 VanDerWaalsContact SG-CE 3.55Å
277	C	81.4	Confident	83	Confident	57 Å²	57	70.8 Å²	70.8	39%	0.385	38%	0.375	S	S	.	.			trans	-73	123.4	169.4	-56.1	0	0	0	0	109.6	G279 K280 I281	C277-G279 PolarHBondContact O-N 3.46Å; C277-G279 VanDerWaalsContact O-N 3.16Å; C277-K280 HydrophobicContact CB-CB 4.4Å; C277-K280 HydrophobicContact CB-CD 4.3Å; C277-K280 HydrophobicContact CB-CG 4.12Å; C277-K280 PolarHBondContact O-N 2.64Å; C277-I281 PolarHBondContact O-N 2.77Å
278	M	83.8	Confident	83.4	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.054	37%	0.367	C	S	.	.	H	α-helix	trans	-51.2	-41.1	177	-177	179.3	158	0	0	112.2	R266 F269 C276 K280 I281 L282 W311 F317	R266-M278 HydrophobicContact CB-SD 4.12Å; R266-M278 HydrophobicContact CG-CB 4.36Å; R266-M278 HydrophobicContact CG-SD 4.28Å; F269-M278 HydrophobicContact CB-CB 4.44Å; F269-M278 HydrophobicContact CB-SD 4.27Å; F269-M278 HydrophobicContact CD1-CB 3.65Å; F269-M278 HydrophobicContact CD1-CG 4.28Å; F269-M278 HydrophobicContact CE1-CB 4.15Å; F269-M278 HydrophobicContact CG-CB 4.11Å; F269-M278 HydrophobicContact CG-CG 4.32Å; F269-M278 HydrophobicContact CG-SD 4.5Å; C276-M278 PolarHBondContact O-N 2.73Å; M278-K280 VanDerWaalsContact C-N 3.34Å; M278-K280 PolarHBondContact O-N 3.09Å; M278-I281 PolarHBondContact O-N 2.93Å; M278-L282 HydrophobicContact CE-CD1 3.64Å; M278-L282 HydrophobicContact CG-CD1 4.04Å; M278-L282 HydrophobicContact CG-CG 4.32Å; M278-L282 WeakPolarHBondContact O-CG 3.38Å; M278-L282 PolarHBondContact O-N 2.77Å; M278-W311 HydrophobicContact SD-CZ3 4.35Å; M278-F317 HydrophobicContact CE-CD1 3.7Å; M278-F317 HydrophobicContact CE-CD2 3.76Å; M278-F317 HydrophobicContact CE-CE1 3.54Å; M278-F317 HydrophobicContact CE-CE2 3.56Å; M278-F317 HydrophobicContact CE-CG 3.83Å; M278-F317 HydrophobicContact CE-CZ 3.47Å; M278-F317 VanDerWaalsContact CE-CZ 3.47Å
279	G	84.1	Confident	83.8	Confident	39 Å²	39	62.2 Å²	62.2	40%	0.402	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-34.6	178.8	0	0	0	0	0	114.2	C277 S283	C277-G279 PolarHBondContact O-N 3.46Å; C277-G279 VanDerWaalsContact O-N 3.16Å; G279-S283 WeakPolarHBondContact O-CB 3.41Å; G279-S283 PolarHBondContact O-N 2.87Å; G279-S283 PolarHBondContact O-OG 3.41Å
280	K	85	Confident	84.2	Confident	152 Å²	152	64 Å²	64	66%	0.661	36%	0.357	S	S	*	.	H	α-helix	trans	-68.3	-41	174.7	-70.2	-176.2	179.3	-178.7	0	110.7	C277 M278 S283 S284	C277-K280 HydrophobicContact CB-CB 4.4Å; C277-K280 HydrophobicContact CB-CD 4.3Å; C277-K280 HydrophobicContact CB-CG 4.12Å; C277-K280 PolarHBondContact O-N 2.64Å; M278-K280 VanDerWaalsContact C-N 3.34Å; M278-K280 PolarHBondContact O-N 3.09Å; K280-S283 WeakPolarHBondContact CA-OG 3.48Å; K280-S283 PolarHBondContact O-N 2.84Å; K280-S283 PolarHBondContact O-OG 3.22Å; K280-S284 PolarHBondContact O-N 2.86Å
281	I	86.8	Confident	84.5	Confident	11 Å²	11	60.9 Å²	60.9	6%	0.056	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-48.2	177.2	-67.1	171.9	0	0	0	110.4	F269 C276 C277 M278 S283 S284 F285 F294 M308 L312	F269-I281 HydrophobicContact CE1-CD1 3.71Å; F269-I281 HydrophobicContact CZ-CD1 3.55Å; C276-I281 HydrophobicContact CB-CD1 3.59Å; C276-I281 HydrophobicContact CB-CG1 4.38Å; C277-I281 PolarHBondContact O-N 2.77Å; M278-I281 PolarHBondContact O-N 2.93Å; I281-S283 VanDerWaalsContact C-N 3.29Å; I281-S283 PolarHBondContact O-N 2.92Å; I281-S284 WeakPolarHBondContact O-CA 3.3Å; I281-S284 WeakPolarHBondContact O-CB 3.15Å; I281-S284 PolarHBondContact O-N 3.28Å; I281-S284 PolarHBondContact O-OG 3.43Å; I281-F285 HydrophobicContact CG2-CD2 4.09Å; I281-F285 HydrophobicContact CG2-CE2 3.78Å; I281-F285 VanDerWaalsContact O-CD2 3.28Å; I281-F285 WeakPolarHBondContact O-CD2 3.14Å; I281-F285 PolarHBondContact O-N 3.26Å; I281-F294 HydrophobicContact CG2-CE2 3.95Å; I281-F294 HydrophobicContact CG2-CZ 3.85Å; I281-M308 HydrophobicContact CD1-CE 4.22Å; I281-M308 HydrophobicContact CD1-CG 4.5Å; I281-M308 HydrophobicContact CD1-SD 3.67Å; I281-L312 HydrophobicContact CG2-CD1 3.74Å
282	L	87.5	Confident	84.7	Confident	17 Å²	17	57.6 Å²	57.6	9%	0.089	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-38.9	176.4	-70.3	176.8	0	0	0	112.2	V254 L260 M278 S284 F285 S286 L312 F317 L318	V254-L282 HydrophobicContact CG2-CB 4.28Å; V254-L282 HydrophobicContact CG2-CD2 4.03Å; V254-L282 WeakPolarHBondContact CG2-O 3.38Å; L260-L282 HydrophobicContact CD2-CD1 3.65Å; M278-L282 HydrophobicContact CE-CD1 3.64Å; M278-L282 HydrophobicContact CG-CD1 4.04Å; M278-L282 HydrophobicContact CG-CG 4.32Å; M278-L282 WeakPolarHBondContact O-CG 3.38Å; M278-L282 PolarHBondContact O-N 2.77Å; L282-S284 PolarHBondContact O-N 3.36Å; L282-F285 CarbonylContact O-C 3.5Å; L282-F285 PolarHBondContact O-N 2.75Å; L282-S286 PolarHBondContact O-N 2.88Å; L282-L312 HydrophobicContact CD2-CD2 4.1Å; L282-F317 HydrophobicContact CD2-CB 4.06Å; L282-L318 HydrophobicContact CD2-CD2 4.45Å
283	S	87.6	Confident	85.1	Confident	73 Å²	73	57.8 Å²	57.8	51%	0.51	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-28.6	174.9	73.8	0	0	0	0	112.8	G279 K280 I281 F285 S286	G279-S283 WeakPolarHBondContact O-CB 3.41Å; G279-S283 PolarHBondContact O-N 2.87Å; G279-S283 PolarHBondContact O-OG 3.41Å; K280-S283 WeakPolarHBondContact CA-OG 3.48Å; K280-S283 PolarHBondContact O-N 2.84Å; K280-S283 PolarHBondContact O-OG 3.22Å; I281-S283 VanDerWaalsContact C-N 3.29Å; I281-S283 PolarHBondContact O-N 2.92Å; S283-F285 VanDerWaalsContact C-N 3.29Å; S283-F285 PolarHBondContact O-N 3.28Å; S283-S286 WeakPolarHBondContact O-CB 3.5Å; S283-S286 PolarHBondContact O-N 3.43Å; S283-S286 PolarHBondContact O-OG 3.02Å
284	S	88.1	Confident	85.4	Confident	24 Å²	24	57.1 Å²	57.1	17%	0.168	33%	0.326	C	S	.	.	H	α-helix	trans	-72.5	-22.2	176.2	81.5	0	0	0	0	113.6	K280 I281 L282 V289 F294 R297	K280-S284 PolarHBondContact O-N 2.86Å; I281-S284 WeakPolarHBondContact O-CA 3.3Å; I281-S284 WeakPolarHBondContact O-CB 3.15Å; I281-S284 PolarHBondContact O-N 3.28Å; I281-S284 PolarHBondContact O-OG 3.43Å; L282-S284 PolarHBondContact O-N 3.36Å; S284-V289 WeakPolarHBondContact O-CG2 3.34Å; S284-F294 WeakPolarHBondContact OG-CE2 3.41Å; S284-R297 PolarHBondContact O-NH1 2.89Å
285	F	89.5	Confident	86.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	12.9	174.9	-66.4	-72.3	0	0	0	113	V254 I281 L282 S283 M287 V289 F294 V309 L312 L318	V254-F285 HydrophobicContact CG2-CB 3.93Å; V254-F285 PolarHBondContact N-O 2.98Å; V254-F285 VanDerWaalsContact N-O 3.1Å; I281-F285 HydrophobicContact CG2-CD2 4.09Å; I281-F285 HydrophobicContact CG2-CE2 3.78Å; I281-F285 VanDerWaalsContact O-CD2 3.28Å; I281-F285 WeakPolarHBondContact O-CD2 3.14Å; I281-F285 PolarHBondContact O-N 3.26Å; L282-F285 CarbonylContact O-C 3.5Å; L282-F285 PolarHBondContact O-N 2.75Å; S283-F285 VanDerWaalsContact C-N 3.29Å; S283-F285 PolarHBondContact O-N 3.28Å; F285-M287 CarbonylContact C-O 3.57Å; F285-M287 PolarHBondContact O-N 3.16Å; F285-V289 HydrophobicContact CD1-CB 4.3Å; F285-F294 HydrophobicContact CD2-CE2 4.47Å; F285-F294 HydrophobicContact CE1-CB 4.11Å; F285-F294 HydrophobicContact CE1-CD2 4.14Å; F285-F294 HydrophobicContact CE1-CG 4.03Å; F285-F294 HydrophobicContact CE2-CD1 4.35Å; F285-F294 AromaticContact CE2-CD2 3.64Å; F285-F294 HydrophobicContact CE2-CD2 3.64Å; F285-F294 HydrophobicContact CE2-CE1 4.23Å; F285-F294 AromaticContact CE2-CE2 3.52Å; F285-F294 HydrophobicContact CE2-CE2 3.52Å; F285-F294 HydrophobicContact CE2-CG 4.07Å; F285-F294 AromaticContact CE2-CZ 3.83Å; F285-F294 HydrophobicContact CE2-CZ 3.83Å; F285-F294 HydrophobicContact CZ-CB 3.95Å; F285-F294 AromaticContact CZ-CD1 3.68Å; F285-F294 HydrophobicContact CZ-CD1 3.68Å; F285-F294 AromaticContact CZ-CD2 3.39Å; F285-F294 HydrophobicContact CZ-CD2 3.39Å; F285-F294 AromaticContact CZ-CE1 3.98Å; F285-F294 HydrophobicContact CZ-CE1 3.98Å; F285-F294 AromaticContact CZ-CE2 3.73Å; F285-F294 HydrophobicContact CZ-CE2 3.73Å; F285-F294 AromaticContact CZ-CG 3.37Å; F285-F294 HydrophobicContact CZ-CG 3.37Å; F285-F294 AromaticContact CZ-CZ 4Å; F285-F294 HydrophobicContact CZ-CZ 4Å; F285-V309 HydrophobicContact CZ-CG2 3.9Å; F285-L312 HydrophobicContact CE2-CD1 4.41Å; F285-L318 HydrophobicContact CB-CD2 3.68Å; F285-L318 HydrophobicContact CD1-CD2 4.31Å; F285-L318 HydrophobicContact CD2-CD1 4.2Å; F285-L318 HydrophobicContact CD2-CD2 3.91Å; F285-L318 HydrophobicContact CE2-CD1 4.11Å; F285-L318 HydrophobicContact CG-CD1 4.47Å; F285-L318 HydrophobicContact CG-CD2 3.72Å; F285-L318 HydrophobicContact CZ-CD1 4.31Å
286	S	88.1	Confident	87.4	Confident	80 Å²	80	46.4 Å²	46.4	56%	0.559	29%	0.285	S	S	*	.	S	Bend	trans	-61.4	-29.2	177.5	53.9	0	0	0	0	112.8	L282 S283	L282-S286 PolarHBondContact O-N 2.88Å; S283-S286 WeakPolarHBondContact O-CB 3.5Å; S283-S286 PolarHBondContact O-N 3.43Å; S283-S286 PolarHBondContact O-OG 3.02Å
287	M	88.7	Confident	87.8	Confident	134 Å²	134	50.8 Å²	50.8	66%	0.66	30%	0.296	S	S	*	.	S	Bend	trans	-111.2	158.1	168.6	-64.9	-61.4	-68.4	0	0	109.1	F285 V289	F285-M287 CarbonylContact C-O 3.57Å; F285-M287 PolarHBondContact O-N 3.16Å; M287-V289 WeakPolarHBondContact O-CG2 3.29Å; M287-V289 PolarHBondContact O-N 3.02Å
288	P	90.1	Very high	87.6	Confident	64 Å²	64	50.4 Å²	50.4	42%	0.416	29%	0.293	S	S	.	.			trans	-52.2	113.8	172.3	-27.3	36.4	0	0	0	111	V251 L321	V251-P288 HydrophobicContact CG1-CB 3.52Å; P288-L321 HydrophobicContact CB-CD1 3.83Å; P288-L321 HydrophobicContact CG-CD1 3.69Å
289	V	91.3	Very high	87.1	Confident	7 Å²	7	51.6 Å²	51.6	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127	-179.1	168.5	0	0	0	0	109.9	Y252 S284 F285 M287 Q293 F294	Y252-V289 PolarHBondContact N-O 3.4Å; Y252-V289 PolarHBondContact O-N 3.2Å; S284-V289 WeakPolarHBondContact O-CG2 3.34Å; F285-V289 HydrophobicContact CD1-CB 4.3Å; M287-V289 WeakPolarHBondContact O-CG2 3.29Å; M287-V289 PolarHBondContact O-N 3.02Å; V289-Q293 HydrophobicContact CG1-CB 4.1Å; V289-Q293 HydrophobicContact CG1-CG 4.42Å; V289-F294 HydrophobicContact CG1-CB 4.31Å
290	P	91.9	Very high	86.2	Confident	38 Å²	38	56.9 Å²	56.9	25%	0.247	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	144.6	172.9	28.5	-33.5	0	0	0	110.5	N250 V251 S292 Q293 F294	N250-P290 WeakPolarHBondContact O-CA 3.32Å; V251-P290 HydrophobicContact CG2-CB 4.39Å; P290-S292 PolarHBondContact O-N 3Å; P290-Q293 HydrophobicContact CG-CB 3.86Å; P290-Q293 PolarHBondContact O-N 3.15Å; P290-F294 PolarHBondContact O-N 2.93Å
291	L	90.3	Very high	86.1	Confident	3 Å²	3	55 Å²	55	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-36.9	-176.9	-176.3	61.8	0	0	0	112.8	T247 N250 Y252 Q293 F294 I295 V309	T247-L291 WeakPolarHBondContact O-CD2 3.22Å; N250-L291 PolarHBondContact O-N 2.84Å; Y252-L291 HydrophobicContact CD2-CB 4.38Å; Y252-L291 HydrophobicContact CE2-CB 4.05Å; Y252-L291 HydrophobicContact CE2-CD1 4.42Å; Y252-L291 HydrophobicContact CE2-CD2 4.42Å; L291-Q293 VanDerWaalsContact C-N 3.32Å; L291-Q293 PolarHBondContact O-N 3.35Å; L291-F294 HydrophobicContact CD1-CD1 4.38Å; L291-F294 PolarHBondContact O-N 3.2Å; L291-F294 VanDerWaalsContact O-N 3.17Å; L291-I295 HydrophobicContact CD1-CG1 4.49Å; L291-I295 HydrophobicContact CG-CD1 3.95Å; L291-I295 HydrophobicContact CG-CG1 4.38Å; L291-I295 VanDerWaalsContact O-CG1 3.3Å; L291-I295 WeakPolarHBondContact O-CG1 3.08Å; L291-I295 PolarHBondContact O-N 3.01Å; L291-V309 HydrophobicContact CD1-CB 4.38Å; L291-V309 HydrophobicContact CD1-CG1 4.44Å; L291-V309 HydrophobicContact CD1-CG2 3.74Å
292	S	90.3	Very high	85.9	Confident	52 Å²	52	61 Å²	61	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-53.3	-44.8	173	47.9	0	0	0	0	113	E248 P290 I295 A296	E248-S292 WeakPolarHBondContact O-CB 3.48Å; E248-S292 PolarHBondContact O-N 3.26Å; E248-S292 PolarHBondContact O-OG 3.43Å; E248-S292 VanDerWaalsContact O-OG 3.1Å; P290-S292 PolarHBondContact O-N 3Å; S292-I295 PolarHBondContact O-N 3.04Å; S292-A296 WeakPolarHBondContact O-CB 3.41Å; S292-A296 PolarHBondContact O-N 3.47Å
293	Q	91.2	Very high	85.8	Confident	84 Å²	84	65.9 Å²	65.9	39%	0.393	37%	0.373	S	S	.	.	H	α-helix	trans	-70	-36.2	179.1	-173.8	-178.1	18.7	0	0	111.4	V289 P290 L291 A296 R297	V289-Q293 HydrophobicContact CG1-CB 4.1Å; V289-Q293 HydrophobicContact CG1-CG 4.42Å; P290-Q293 HydrophobicContact CG-CB 3.86Å; P290-Q293 PolarHBondContact O-N 3.15Å; L291-Q293 VanDerWaalsContact C-N 3.32Å; L291-Q293 PolarHBondContact O-N 3.35Å; Q293-A296 PolarHBondContact O-N 2.99Å; Q293-R297 WeakPolarHBondContact O-CG 3.31Å; Q293-R297 PolarHBondContact O-N 2.81Å; Q293-R297 VanDerWaalsContact O-N 3.12Å
294	F	88.4	Confident	85.8	Confident	3 Å²	3	64.5 Å²	64.5	1%	0.013	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-44.5	174	179	-106.9	0	0	0	111.8	I281 S284 F285 V289 P290 L291 A296 R297 C298 A305 V309	I281-F294 HydrophobicContact CG2-CE2 3.95Å; I281-F294 HydrophobicContact CG2-CZ 3.85Å; S284-F294 WeakPolarHBondContact OG-CE2 3.41Å; F285-F294 HydrophobicContact CD2-CE2 4.47Å; F285-F294 HydrophobicContact CE1-CB 4.11Å; F285-F294 HydrophobicContact CE1-CD2 4.14Å; F285-F294 HydrophobicContact CE1-CG 4.03Å; F285-F294 HydrophobicContact CE2-CD1 4.35Å; F285-F294 AromaticContact CE2-CD2 3.64Å; F285-F294 HydrophobicContact CE2-CD2 3.64Å; F285-F294 HydrophobicContact CE2-CE1 4.23Å; F285-F294 AromaticContact CE2-CE2 3.52Å; F285-F294 HydrophobicContact CE2-CE2 3.52Å; F285-F294 HydrophobicContact CE2-CG 4.07Å; F285-F294 AromaticContact CE2-CZ 3.83Å; F285-F294 HydrophobicContact CE2-CZ 3.83Å; F285-F294 HydrophobicContact CZ-CB 3.95Å; F285-F294 AromaticContact CZ-CD1 3.68Å; F285-F294 HydrophobicContact CZ-CD1 3.68Å; F285-F294 AromaticContact CZ-CD2 3.39Å; F285-F294 HydrophobicContact CZ-CD2 3.39Å; F285-F294 AromaticContact CZ-CE1 3.98Å; F285-F294 HydrophobicContact CZ-CE1 3.98Å; F285-F294 AromaticContact CZ-CE2 3.73Å; F285-F294 HydrophobicContact CZ-CE2 3.73Å; F285-F294 AromaticContact CZ-CG 3.37Å; F285-F294 HydrophobicContact CZ-CG 3.37Å; F285-F294 AromaticContact CZ-CZ 4Å; F285-F294 HydrophobicContact CZ-CZ 4Å; V289-F294 HydrophobicContact CG1-CB 4.31Å; P290-F294 PolarHBondContact O-N 2.93Å; L291-F294 HydrophobicContact CD1-CD1 4.38Å; L291-F294 PolarHBondContact O-N 3.2Å; L291-F294 VanDerWaalsContact O-N 3.17Å; F294-A296 VanDerWaalsContact C-N 3.3Å; F294-A296 PolarHBondContact O-N 2.61Å; F294-R297 WeakPolarHBondContact O-CB 3.36Å; F294-R297 PolarHBondContact O-N 3Å; F294-C298 WeakPolarHBondContact CZ-SG 3.28Å; F294-C298 PolarHBondContact O-N 3.32Å; F294-A305 HydrophobicContact CD1-CB 4.11Å; F294-A305 HydrophobicContact CE1-CB 3.92Å; F294-V309 HydrophobicContact CD1-CG2 3.98Å; F294-V309 HydrophobicContact CE1-CG2 3.9Å
295	I	88.1	Confident	85.8	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.056	35%	0.353	C	S	.	.	H	α-helix	trans	-56.8	-46.2	174.5	-69.8	167	0	0	0	110.2	E248 L291 S292 R297 C298 R302 A305	E248-I295 HydrophobicContact CG-CD1 4.22Å; L291-I295 HydrophobicContact CD1-CG1 4.49Å; L291-I295 HydrophobicContact CG-CD1 3.95Å; L291-I295 HydrophobicContact CG-CG1 4.38Å; L291-I295 VanDerWaalsContact O-CG1 3.3Å; L291-I295 WeakPolarHBondContact O-CG1 3.08Å; L291-I295 PolarHBondContact O-N 3.01Å; S292-I295 PolarHBondContact O-N 3.04Å; I295-R297 VanDerWaalsContact C-N 3.26Å; I295-R297 PolarHBondContact O-N 3.3Å; I295-C298 PolarHBondContact O-N 3.23Å; I295-C298 VanDerWaalsContact O-N 3.16Å; I295-R302 HydrophobicContact CG2-CB 4.39Å; I295-R302 HydrophobicContact CG2-CG 3.82Å; I295-A305 HydrophobicContact CG1-CB 3.91Å
296	A	87.4	Confident	85.8	Confident	75 Å²	75	65.4 Å²	65.4	62%	0.62	36%	0.364	S	S	*	.	H	α-helix	trans	-59.9	-33.8	177.1	0	0	0	0	0	113	S292 Q293 F294	S292-A296 WeakPolarHBondContact O-CB 3.41Å; S292-A296 PolarHBondContact O-N 3.47Å; Q293-A296 PolarHBondContact O-N 2.99Å; F294-A296 VanDerWaalsContact C-N 3.3Å; F294-A296 PolarHBondContact O-N 2.61Å
297	R	84.2	Confident	85.8	Confident	131 Å²	131	68.4 Å²	68.4	49%	0.494	36%	0.363	S	S	.	.	H	α-helix	trans	-75.2	-30.7	176.7	-70.4	174.4	-172.9	172	4.3	113.4	S284 Q293 F294 I295 G299	S284-R297 PolarHBondContact O-NH1 2.89Å; Q293-R297 WeakPolarHBondContact O-CG 3.31Å; Q293-R297 PolarHBondContact O-N 2.81Å; Q293-R297 VanDerWaalsContact O-N 3.12Å; F294-R297 WeakPolarHBondContact O-CB 3.36Å; F294-R297 PolarHBondContact O-N 3Å; I295-R297 VanDerWaalsContact C-N 3.26Å; I295-R297 PolarHBondContact O-N 3.3Å; R297-G299 VanDerWaalsContact C-N 3.26Å; R297-G299 PolarHBondContact O-N 2.97Å
298	C	77	Confident	85.8	Confident	50 Å²	50	62.2 Å²	62.2	34%	0.338	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-3.1	-178.9	-81.7	0	0	0	0	114.3	F294 I295 A305	F294-C298 WeakPolarHBondContact CZ-SG 3.28Å; F294-C298 PolarHBondContact O-N 3.32Å; I295-C298 PolarHBondContact O-N 3.23Å; I295-C298 VanDerWaalsContact O-N 3.16Å; C298-A305 HydrophobicContact CB-CB 4.17Å
299	G	72.8	Confident	85.8	Confident	36 Å²	36	59.1 Å²	59.1	37%	0.371	31%	0.312	S	S	.	.			trans	74.7	159.1	-166.6	0	0	0	0	0	110.7	R297 N301	R297-G299 VanDerWaalsContact C-N 3.26Å; R297-G299 PolarHBondContact O-N 2.97Å; G299-N301 PolarHBondContact O-N 3.19Å
300	D	65.8	Low	85.7	Confident	150 Å²	150	59.9 Å²	59.9	80%	0.802	32%	0.317	S	S	*	.	S	Bend	trans	-56.2	7.6	-167	-69.5	-39.9	0	0	0	117.6	R302	D300-R302 PolarHBondContact O-N 2.66Å
301	N	82.2	Confident	85.6	Confident	112 Å²	112	59.2 Å²	59.2	60%	0.599	31%	0.309	S	S	*	.			trans	-76.3	68.9	171.5	-66.5	-30.7	0	0	0	111.9	G299 D303 V304 A305	G299-N301 PolarHBondContact O-N 3.19Å; N301-D303 PolarHBondContact O-N 3.2Å; N301-V304 HydrophobicContact CB-CB 4.06Å; N301-V304 HydrophobicContact CB-CG2 3.92Å; N301-V304 PolarHBondContact O-N 2.81Å; N301-A305 PolarHBondContact O-N 3.25Å
302	R	83.8	Confident	85.4	Confident	136 Å²	136	59 Å²	59	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-50.1	-44.3	178.4	-54.7	-165.2	-175.7	-170	6.7	112.5	E248 I295 D300 V304 A305 I306	E248-R302 IonicContact OE1-CZ 3.59Å; E248-R302 IonicContact OE1-NH1 2.66Å; E248-R302 PolarHBondContact OE1-NH1 2.76Å; I295-R302 HydrophobicContact CG2-CB 4.39Å; I295-R302 HydrophobicContact CG2-CG 3.82Å; D300-R302 PolarHBondContact O-N 2.66Å; R302-V304 VanDerWaalsContact C-N 3.28Å; R302-V304 PolarHBondContact O-N 3.28Å; R302-A305 PolarHBondContact O-N 3.19Å; R302-I306 VanDerWaalsContact O-CG1 3.31Å; R302-I306 WeakPolarHBondContact O-CG1 3.32Å; R302-I306 PolarHBondContact O-N 3.38Å
303	D	85.6	Confident	85.3	Confident	120 Å²	120	57.5 Å²	57.5	64%	0.642	30%	0.296	S	S	*	.	H	α-helix	trans	-65	-30.2	-178.3	-61.7	-36.8	0	0	0	113.6	N301 R307	N301-D303 PolarHBondContact O-N 3.2Å; D303-R307 WeakPolarHBondContact O-CB 3.48Å; D303-R307 WeakPolarHBondContact O-CG 3.49Å; D303-R307 PolarHBondContact O-N 2.87Å; D303-R307 PolarHBondContact O-NE 3.3Å
304	V	87.5	Confident	85	Confident	44 Å²	44	55.7 Å²	55.7	27%	0.267	29%	0.288	S	S	.	.	H	α-helix	trans	-75.1	-45.9	177	178.8	0	0	0	0	109.3	N301 R302 R307 M308	N301-V304 HydrophobicContact CB-CB 4.06Å; N301-V304 HydrophobicContact CB-CG2 3.92Å; N301-V304 PolarHBondContact O-N 2.81Å; R302-V304 VanDerWaalsContact C-N 3.28Å; R302-V304 PolarHBondContact O-N 3.28Å; V304-R307 PolarHBondContact O-N 2.97Å; V304-M308 HydrophobicContact CG1-CE 3.61Å; V304-M308 HydrophobicContact CG1-SD 4.26Å; V304-M308 WeakPolarHBondContact O-CG 3.49Å; V304-M308 PolarHBondContact O-N 3.03Å
305	A	88.2	Confident	84.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-46.2	177.8	0	0	0	0	0	111.7	F294 I295 C298 N301 R302 R307 M308 V309	F294-A305 HydrophobicContact CD1-CB 4.11Å; F294-A305 HydrophobicContact CE1-CB 3.92Å; I295-A305 HydrophobicContact CG1-CB 3.91Å; C298-A305 HydrophobicContact CB-CB 4.17Å; N301-A305 PolarHBondContact O-N 3.25Å; R302-A305 PolarHBondContact O-N 3.19Å; A305-R307 PolarHBondContact O-N 3.3Å; A305-M308 WeakPolarHBondContact O-CB 3.3Å; A305-M308 PolarHBondContact O-N 3.36Å; A305-V309 WeakPolarHBondContact O-CG2 3.14Å; A305-V309 PolarHBondContact O-N 2.98Å
306	I	89	Confident	84.2	Confident	44 Å²	44	59.2 Å²	59.2	23%	0.226	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-45.3	176.6	-66.6	167.1	0	0	0	110.4	L246 R302 M308 V309 V310	L246-I306 HydrophobicContact CD1-CG2 4.11Å; R302-I306 VanDerWaalsContact O-CG1 3.31Å; R302-I306 WeakPolarHBondContact O-CG1 3.32Å; R302-I306 PolarHBondContact O-N 3.38Å; I306-M308 VanDerWaalsContact C-N 3.29Å; I306-M308 PolarHBondContact O-N 3Å; I306-V309 PolarHBondContact O-N 2.88Å; I306-V310 HydrophobicContact CG2-CG2 4.13Å; I306-V310 WeakPolarHBondContact O-CB 3.39Å; I306-V310 WeakPolarHBondContact O-CG2 3.49Å; I306-V310 PolarHBondContact O-N 3.23Å
307	R	88.7	Confident	84	Confident	142 Å²	142	55.9 Å²	55.9	54%	0.536	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-35.3	176.6	-78.6	-177.4	-68.3	158.6	-7.3	113.1	F273 D303 V304 A305 W311	F273-R307 HydrophobicContact CE1-CB 4.1Å; F273-R307 HydrophobicContact CZ-CB 4.32Å; D303-R307 WeakPolarHBondContact O-CB 3.48Å; D303-R307 WeakPolarHBondContact O-CG 3.49Å; D303-R307 PolarHBondContact O-N 2.87Å; D303-R307 PolarHBondContact O-NE 3.3Å; V304-R307 PolarHBondContact O-N 2.97Å; A305-R307 PolarHBondContact O-N 3.3Å; R307-W311 WeakPolarHBondContact O-CB 3.33Å; R307-W311 PolarHBondContact O-N 2.97Å
308	M	88.5	Confident	84.2	Confident	4 Å²	4	50 Å²	50	2%	0.02	26%	0.259	C	S	.	.	H	α-helix	trans	-64.7	-46.8	174	-71.8	171.3	174.7	0	0	111.2	F269 F273 C276 I281 V304 A305 I306 W311 L312	F269-M308 HydrophobicContact CZ-CB 4.48Å; F269-M308 HydrophobicContact CZ-CG 4.13Å; F273-M308 HydrophobicContact CB-CE 3.95Å; F273-M308 HydrophobicContact CD1-CE 3.81Å; F273-M308 HydrophobicContact CD1-CG 3.68Å; F273-M308 HydrophobicContact CD2-CG 4.37Å; F273-M308 HydrophobicContact CE1-CG 3.63Å; F273-M308 HydrophobicContact CE2-CG 4.33Å; F273-M308 HydrophobicContact CG-CE 4.04Å; F273-M308 HydrophobicContact CG-CG 4.06Å; F273-M308 HydrophobicContact CZ-CB 4.49Å; F273-M308 HydrophobicContact CZ-CG 3.97Å; C276-M308 HydrophobicContact CB-CE 3.97Å; C276-M308 VanDerWaalsContact SG-CE 3.55Å; I281-M308 HydrophobicContact CD1-CE 4.22Å; I281-M308 HydrophobicContact CD1-CG 4.5Å; I281-M308 HydrophobicContact CD1-SD 3.67Å; V304-M308 HydrophobicContact CG1-CE 3.61Å; V304-M308 HydrophobicContact CG1-SD 4.26Å; V304-M308 WeakPolarHBondContact O-CG 3.49Å; V304-M308 PolarHBondContact O-N 3.03Å; A305-M308 WeakPolarHBondContact O-CB 3.3Å; A305-M308 PolarHBondContact O-N 3.36Å; I306-M308 VanDerWaalsContact C-N 3.29Å; I306-M308 PolarHBondContact O-N 3Å; M308-W311 PolarHBondContact O-N 2.99Å; M308-L312 VanDerWaalsContact O-CG 3.31Å; M308-L312 WeakPolarHBondContact O-CG 3.39Å; M308-L312 PolarHBondContact O-N 2.69Å
309	V	89.9	Confident	84.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-45.2	178.4	173.9	0	0	0	0	111.2	Y252 F285 L291 F294 A305 I306 W311 L312 L313 L318	Y252-V309 HydrophobicContact CD2-CG1 4.44Å; Y252-V309 HydrophobicContact CE2-CG1 4.3Å; F285-V309 HydrophobicContact CZ-CG2 3.9Å; L291-V309 HydrophobicContact CD1-CB 4.38Å; L291-V309 HydrophobicContact CD1-CG1 4.44Å; L291-V309 HydrophobicContact CD1-CG2 3.74Å; F294-V309 HydrophobicContact CD1-CG2 3.98Å; F294-V309 HydrophobicContact CE1-CG2 3.9Å; A305-V309 WeakPolarHBondContact O-CG2 3.14Å; A305-V309 PolarHBondContact O-N 2.98Å; I306-V309 PolarHBondContact O-N 2.88Å; V309-W311 VanDerWaalsContact C-N 3.29Å; V309-W311 PolarHBondContact O-N 3.21Å; V309-L312 PolarHBondContact O-N 3Å; V309-L312 VanDerWaalsContact O-N 3.15Å; V309-L313 HydrophobicContact CG1-CD1 3.87Å; V309-L313 HydrophobicContact CG1-CG 4.3Å; V309-L313 WeakPolarHBondContact O-CB 3.25Å; V309-L313 WeakPolarHBondContact O-CG 3.38Å; V309-L313 PolarHBondContact O-N 3.14Å; V309-L318 HydrophobicContact CG1-CD1 4.31Å
310	V	89.6	Confident	85.4	Confident	22 Å²	22	47.8 Å²	47.8	13%	0.133	24%	0.235	C	C	.	.	H	α-helix	trans	-52.7	-48	172.4	167.4	0	0	0	0	110.8	L180 P209 L246 I306 L313 Q314	L180-V310 HydrophobicContact CD1-CG1 3.71Å; P209-V310 HydrophobicContact CB-CG2 4.48Å; P209-V310 HydrophobicContact CG-CG2 3.9Å; L246-V310 HydrophobicContact CD1-CG2 3.34Å; I306-V310 HydrophobicContact CG2-CG2 4.13Å; I306-V310 WeakPolarHBondContact O-CB 3.39Å; I306-V310 WeakPolarHBondContact O-CG2 3.49Å; I306-V310 PolarHBondContact O-N 3.23Å; V310-L313 PolarHBondContact O-N 2.95Å; V310-Q314 VanDerWaalsContact O-CG 3.26Å; V310-Q314 WeakPolarHBondContact O-CG 3.34Å; V310-Q314 PolarHBondContact O-N 3.47Å
311	W	88.5	Confident	86.5	Confident	24 Å²	24	41.7 Å²	41.7	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-42.9	179.3	-171	100.5	0	0	0	111.8	L265 K268 F269 F273 M278 R307 M308 V309 Q314 H315 F317	L265-W311 HydrophobicContact CB-CH2 4.27Å; L265-W311 WeakPolarHBondContact O-CH2 3.5Å; K268-W311 HydrophobicContact CB-CZ2 4.45Å; F269-W311 HydrophobicContact CB-CH2 3.59Å; F269-W311 HydrophobicContact CB-CZ2 3.84Å; F269-W311 HydrophobicContact CB-CZ3 3.97Å; F269-W311 AromaticContact CD2-CD2 3.59Å; F269-W311 HydrophobicContact CD2-CD2 3.59Å; F269-W311 AromaticContact CD2-CE2 4Å; F269-W311 AromaticContact CD2-CE3 3.28Å; F269-W311 HydrophobicContact CD2-CE3 3.28Å; F269-W311 HydrophobicContact CD2-CG 4.32Å; F269-W311 AromaticContact CD2-CH2 3.89Å; F269-W311 HydrophobicContact CD2-CH2 3.89Å; F269-W311 HydrophobicContact CD2-CZ2 4.14Å; F269-W311 AromaticContact CD2-CZ3 3.44Å; F269-W311 HydrophobicContact CD2-CZ3 3.44Å; F269-W311 VanDerWaalsContact CD2-CZ3 3.44Å; F269-W311 HydrophobicContact CE2-CD2 4.2Å; F269-W311 AromaticContact CE2-CE3 3.83Å; F269-W311 HydrophobicContact CE2-CE3 3.83Å; F269-W311 HydrophobicContact CE2-CZ3 4.3Å; F269-W311 HydrophobicContact CG-CE3 4.32Å; F269-W311 HydrophobicContact CG-CH2 4.2Å; F269-W311 HydrophobicContact CG-CZ3 4.08Å; F273-W311 HydrophobicContact CE2-CB 3.99Å; F273-W311 AromaticContact CE2-CG 3.94Å; F273-W311 HydrophobicContact CE2-CG 3.94Å; F273-W311 HydrophobicContact CZ-CB 4.18Å; M278-W311 HydrophobicContact SD-CZ3 4.35Å; R307-W311 WeakPolarHBondContact O-CB 3.33Å; R307-W311 PolarHBondContact O-N 2.97Å; M308-W311 PolarHBondContact O-N 2.99Å; V309-W311 VanDerWaalsContact C-N 3.29Å; V309-W311 PolarHBondContact O-N 3.21Å; W311-Q314 WeakPolarHBondContact O-CB 3.32Å; W311-Q314 PolarHBondContact O-N 2.94Å; W311-H315 AromaticContact CD2-CD2 3.47Å; W311-H315 VanDerWaalsContact CD2-CD2 3.47Å; W311-H315 AromaticContact CD2-NE2 3.87Å; W311-H315 AromaticContact CE2-CD2 3.38Å; W311-H315 AromaticContact CE2-NE2 3.38Å; W311-H315 AromaticContact CE3-CD2 3.61Å; W311-H315 AromaticContact CH2-CD2 3.63Å; W311-H315 AromaticContact CZ2-CD2 3.49Å; W311-H315 VanDerWaalsContact CZ2-CD2 3.49Å; W311-H315 WeakPolarHBondContact CZ2-CD2 3.37Å; W311-H315 AromaticContact CZ2-NE2 3.57Å; W311-H315 AromaticContact CZ3-CD2 3.7Å; W311-H315 AromaticContact NE1-CD2 3.99Å; W311-H315 AromaticContact NE1-NE2 3.58Å; W311-H315 PolarHBondContact O-CD2 2.83Å; W311-H315 PolarHBondContact O-N 3.23Å; W311-F317 HydrophobicContact CH2-CE2 4.17Å; W311-F317 AromaticContact CZ3-CD2 3.99Å; W311-F317 HydrophobicContact CZ3-CD2 3.99Å; W311-F317 AromaticContact CZ3-CE2 3.81Å; W311-F317 HydrophobicContact CZ3-CE2 3.81Å
312	L	87.8	Confident	86.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-38.7	179.1	-70.6	171	0	0	0	112.1	F269 I281 L282 F285 M308 V309 H315 G316 F317 L318	F269-L312 HydrophobicContact CE2-CD2 4.44Å; F269-L312 HydrophobicContact CE2-CG 4.48Å; I281-L312 HydrophobicContact CG2-CD1 3.74Å; L282-L312 HydrophobicContact CD2-CD2 4.1Å; F285-L312 HydrophobicContact CE2-CD1 4.41Å; M308-L312 VanDerWaalsContact O-CG 3.31Å; M308-L312 WeakPolarHBondContact O-CG 3.39Å; M308-L312 PolarHBondContact O-N 2.69Å; V309-L312 PolarHBondContact O-N 3Å; V309-L312 VanDerWaalsContact O-N 3.15Å; L312-H315 PolarHBondContact O-N 3.39Å; L312-G316 PolarHBondContact O-N 3.25Å; L312-F317 HydrophobicContact CB-CB 4.4Å; L312-F317 HydrophobicContact CD2-CB 4.01Å; L312-F317 HydrophobicContact CD2-CD2 4.03Å; L312-F317 HydrophobicContact CD2-CG 4.31Å; L312-F317 PolarHBondContact O-N 2.82Å; L312-L318 HydrophobicContact CB-CB 4.49Å; L312-L318 HydrophobicContact CB-CD1 3.62Å; L312-L318 HydrophobicContact CB-CG 3.8Å; L312-L318 HydrophobicContact CD1-CD1 3.71Å; L312-L318 HydrophobicContact CD1-CG 4.2Å; L312-L318 HydrophobicContact CG-CD1 4.32Å
313	L	86.7	Confident	87	Confident	19 Å²	19	31.1 Å²	31.1	10%	0.099	16%	0.158	C	C	.	.	H	α-helix	trans	-65.7	-40.4	173	-69.9	169.4	0	0	0	111.8	L180 L246 Y252 V309 V310 H315 G316 L318	L180-L313 HydrophobicContact CD2-CB 3.73Å; L246-L313 HydrophobicContact CD2-CD1 3.66Å; Y252-L313 HydrophobicContact CD1-CD2 4.17Å; Y252-L313 HydrophobicContact CE1-CD1 3.98Å; Y252-L313 HydrophobicContact CE1-CD2 4.12Å; V309-L313 HydrophobicContact CG1-CD1 3.87Å; V309-L313 HydrophobicContact CG1-CG 4.3Å; V309-L313 WeakPolarHBondContact O-CB 3.25Å; V309-L313 WeakPolarHBondContact O-CG 3.38Å; V309-L313 PolarHBondContact O-N 3.14Å; V310-L313 PolarHBondContact O-N 2.95Å; L313-H315 PolarHBondContact O-N 2.72Å; L313-G316 PolarHBondContact O-N 3.41Å; L313-G316 VanDerWaalsContact O-N 3.14Å; L313-L318 HydrophobicContact CD2-CB 3.89Å; L313-L318 WeakPolarHBondContact CD2-O 3.42Å; L313-L318 HydrophobicContact CG-CB 4.41Å
314	Q	84.7	Confident	87.2	Confident	47 Å²	47	25.4 Å²	25.4	22%	0.22	13%	0.127	C	C	.	.	H	α-helix	trans	-58.2	-36.6	178.3	-79.3	169.9	-15.4	0	0	112.5	L180 L181 L182 V310 W311	L180-Q314 HydrophobicContact CD1-CG 3.84Å; L180-Q314 HydrophobicContact CD2-CB 4.47Å; L180-Q314 HydrophobicContact CD2-CG 3.82Å; L180-Q314 HydrophobicContact CG-CG 3.76Å; L181-Q314 PolarHBondContact O-NE2 3.26Å; L182-Q314 HydrophobicContact CD2-CB 4.18Å; L182-Q314 HydrophobicContact CD2-CG 4.37Å; L182-Q314 VanDerWaalsContact CD2-O 3.23Å; L182-Q314 WeakPolarHBondContact CD2-O 3.42Å; V310-Q314 VanDerWaalsContact O-CG 3.26Å; V310-Q314 WeakPolarHBondContact O-CG 3.34Å; V310-Q314 PolarHBondContact O-N 3.47Å; W311-Q314 WeakPolarHBondContact O-CB 3.32Å; W311-Q314 PolarHBondContact O-N 2.94Å
315	H	80.4	Confident	87.1	Confident	66 Å²	66	23.3 Å²	23.3	31%	0.306	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-1.5	-179.2	-64.8	-65.6	0	0	0	114	L265 W311 L312 L313 F317	L265-H315 HydrophobicContact CD1-CB 4.36Å; W311-H315 AromaticContact CD2-CD2 3.47Å; W311-H315 VanDerWaalsContact CD2-CD2 3.47Å; W311-H315 AromaticContact CD2-NE2 3.87Å; W311-H315 AromaticContact CE2-CD2 3.38Å; W311-H315 AromaticContact CE2-NE2 3.38Å; W311-H315 AromaticContact CE3-CD2 3.61Å; W311-H315 AromaticContact CH2-CD2 3.63Å; W311-H315 AromaticContact CZ2-CD2 3.49Å; W311-H315 VanDerWaalsContact CZ2-CD2 3.49Å; W311-H315 WeakPolarHBondContact CZ2-CD2 3.37Å; W311-H315 AromaticContact CZ2-NE2 3.57Å; W311-H315 AromaticContact CZ3-CD2 3.7Å; W311-H315 AromaticContact NE1-CD2 3.99Å; W311-H315 AromaticContact NE1-NE2 3.58Å; W311-H315 PolarHBondContact O-CD2 2.83Å; W311-H315 PolarHBondContact O-N 3.23Å; L312-H315 PolarHBondContact O-N 3.39Å; L313-H315 PolarHBondContact O-N 2.72Å; H315-F317 HydrophobicContact CB-CD2 3.58Å; H315-F317 HydrophobicContact CB-CE2 3.36Å; H315-F317 HydrophobicContact CB-CZ 4.34Å
316	G	79.8	Confident	87	Confident	22 Å²	22	27.4 Å²	27.4	23%	0.227	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	39.2	-179.9	0	0	0	0	0	113.4	L312 L313	L312-G316 PolarHBondContact O-N 3.25Å; L313-G316 PolarHBondContact O-N 3.41Å; L313-G316 VanDerWaalsContact O-N 3.14Å
317	F	84.3	Confident	86.6	Confident	5 Å²	5	27.2 Å²	27.2	2%	0.022	13%	0.13	C	C	.	.	S	Bend	trans	-94.6	-21	172.2	-66.8	-67.1	0	0	0	113	V254 D255 A258 L260 L265 M278 L282 W311 L312 H315	V254-F317 WeakPolarHBondContact CA-O 3.27Å; D255-F317 PolarHBondContact N-O 2.99Å; A258-F317 HydrophobicContact CB-CD1 4.04Å; L260-F317 HydrophobicContact CD2-CD1 3.95Å; L260-F317 HydrophobicContact CD2-CE1 4.2Å; L265-F317 HydrophobicContact CB-CE2 4.5Å; L265-F317 HydrophobicContact CB-CZ 4.3Å; L265-F317 HydrophobicContact CD1-CE2 4.17Å; L265-F317 HydrophobicContact CD1-CZ 3.9Å; M278-F317 HydrophobicContact CE-CD1 3.7Å; M278-F317 HydrophobicContact CE-CD2 3.76Å; M278-F317 HydrophobicContact CE-CE1 3.54Å; M278-F317 HydrophobicContact CE-CE2 3.56Å; M278-F317 HydrophobicContact CE-CG 3.83Å; M278-F317 HydrophobicContact CE-CZ 3.47Å; M278-F317 VanDerWaalsContact CE-CZ 3.47Å; L282-F317 HydrophobicContact CD2-CB 4.06Å; W311-F317 HydrophobicContact CH2-CE2 4.17Å; W311-F317 AromaticContact CZ3-CD2 3.99Å; W311-F317 HydrophobicContact CZ3-CD2 3.99Å; W311-F317 AromaticContact CZ3-CE2 3.81Å; W311-F317 HydrophobicContact CZ3-CE2 3.81Å; L312-F317 HydrophobicContact CB-CB 4.4Å; L312-F317 HydrophobicContact CD2-CB 4.01Å; L312-F317 HydrophobicContact CD2-CD2 4.03Å; L312-F317 HydrophobicContact CD2-CG 4.31Å; L312-F317 PolarHBondContact O-N 2.82Å; H315-F317 HydrophobicContact CB-CD2 3.58Å; H315-F317 HydrophobicContact CB-CE2 3.36Å; H315-F317 HydrophobicContact CB-CZ 4.34Å
318	L	87	Confident	86.1	Confident	7 Å²	7	23.2 Å²	23.2	4%	0.037	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.7	178.5	-67.7	178.5	0	0	0	109.1	V253 V254 L282 F285 V309 L312 L313	V253-L318 WeakPolarHBondContact O-CA 3.35Å; V253-L318 WeakPolarHBondContact O-CD2 3.43Å; V254-L318 HydrophobicContact CG2-CD2 4.24Å; L282-L318 HydrophobicContact CD2-CD2 4.45Å; F285-L318 HydrophobicContact CB-CD2 3.68Å; F285-L318 HydrophobicContact CD1-CD2 4.31Å; F285-L318 HydrophobicContact CD2-CD1 4.2Å; F285-L318 HydrophobicContact CD2-CD2 3.91Å; F285-L318 HydrophobicContact CE2-CD1 4.11Å; F285-L318 HydrophobicContact CG-CD1 4.47Å; F285-L318 HydrophobicContact CG-CD2 3.72Å; F285-L318 HydrophobicContact CZ-CD1 4.31Å; V309-L318 HydrophobicContact CG1-CD1 4.31Å; L312-L318 HydrophobicContact CB-CB 4.49Å; L312-L318 HydrophobicContact CB-CD1 3.62Å; L312-L318 HydrophobicContact CB-CG 3.8Å; L312-L318 HydrophobicContact CD1-CD1 3.71Å; L312-L318 HydrophobicContact CD1-CG 4.2Å; L312-L318 HydrophobicContact CG-CD1 4.32Å; L313-L318 HydrophobicContact CD2-CB 3.89Å; L313-L318 WeakPolarHBondContact CD2-O 3.42Å; L313-L318 HydrophobicContact CG-CB 4.41Å
319	M	86.3	Confident	85.1	Confident	24 Å²	24	23.9 Å²	23.9	12%	0.118	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.4	169.4	63.4	-170.3	-72.9	0	0	109	Y252 V253 D255 P256 L321 E427	Y252-M319 WeakPolarHBondContact CA-O 3.41Å; V253-M319 HydrophobicContact CG1-CG 3.3Å; V253-M319 HydrophobicContact CG1-SD 3.73Å; V253-M319 PolarHBondContact N-O 3.19Å; V253-M319 PolarHBondContact O-N 3.44Å; D255-M319 HydrophobicContact CB-CB 4.37Å; D255-M319 HydrophobicContact CB-CG 4.49Å; D255-M319 HydrophobicContact CB-SD 4.46Å; P256-M319 WeakPolarHBondContact CD-SD 3.34Å; M319-L321 HydrophobicContact CE-CD2 4.09Å; M319-E427 HydrophobicContact CE-CB 3.62Å; M319-E427 HydrophobicContact CE-CG 3.97Å; M319-E427 WeakPolarHBondContact CE-OE2 3.29Å
320	Q	89.3	Confident	83.6	Confident	16 Å²	16	28.7 Å²	28.7	8%	0.075	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.5	176.9	-178.8	170.3	-19.1	0	0	109.6	N250 Y252 H322	N250-Q320 VanDerWaalsContact CG-NE2 3.27Å; N250-Q320 PolarHBondContact ND2-NE2 3.34Å; Y252-Q320 HydrophobicContact CD1-CB 4.05Å; Y252-Q320 HydrophobicContact CD1-CG 4.48Å; Y252-Q320 HydrophobicContact CE1-CB 3.83Å; Y252-Q320 HydrophobicContact CE1-CG 4.08Å; Q320-H322 PolarHBondContact NE2-CE1 3.37Å; Q320-H322 VanDerWaalsContact NE2-CE1 3.26Å; Q320-H322 PolarHBondContact NE2-NE2 3.1Å
321	L	89.6	Confident	81.9	Confident	22 Å²	22	29.2 Å²	29.2	12%	0.115	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	140.3	173.4	-60.4	177.2	0	0	0	110	V251 V253 P288 M319 V425	V251-L321 HydrophobicContact CB-CB 4.46Å; V251-L321 HydrophobicContact CG1-CB 4.47Å; V251-L321 HydrophobicContact CG1-CD1 4.45Å; V251-L321 PolarHBondContact O-N 3.41Å; V253-L321 HydrophobicContact CB-CD1 4.08Å; V253-L321 HydrophobicContact CG1-CD1 3.79Å; V253-L321 HydrophobicContact CG1-CD2 3.99Å; V253-L321 HydrophobicContact CG1-CG 3.82Å; P288-L321 HydrophobicContact CB-CD1 3.83Å; P288-L321 HydrophobicContact CG-CD1 3.69Å; M319-L321 HydrophobicContact CE-CD2 4.09Å; L321-V425 HydrophobicContact CB-CG1 3.68Å; L321-V425 HydrophobicContact CD1-CG1 4.11Å; L321-V425 HydrophobicContact CG-CG1 4.46Å
322	H	88.6	Confident	80	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	150.2	177.1	-73.4	-82.3	0	0	0	110.4	F244 Q320 F324 H395 E397 V425 H426	F244-H322 AromaticContact CD1-CE1 3.6Å; F244-H322 AromaticContact CD2-CE1 3.5Å; F244-H322 VanDerWaalsContact CD2-CE1 3.5Å; F244-H322 WeakPolarHBondContact CD2-CE1 3.48Å; F244-H322 AromaticContact CD2-NE2 3.14Å; F244-H322 WeakPolarHBondContact CD2-NE2 3.47Å; F244-H322 AromaticContact CE1-CE1 3.64Å; F244-H322 AromaticContact CE2-CE1 3.58Å; F244-H322 AromaticContact CE2-NE2 3.15Å; F244-H322 WeakPolarHBondContact CE2-NE2 3.5Å; F244-H322 AromaticContact CG-CE1 3.52Å; F244-H322 AromaticContact CG-NE2 3.67Å; F244-H322 AromaticContact CZ-CE1 3.65Å; F244-H322 AromaticContact CZ-NE2 3.66Å; Q320-H322 PolarHBondContact NE2-CE1 3.37Å; Q320-H322 VanDerWaalsContact NE2-CE1 3.26Å; Q320-H322 PolarHBondContact NE2-NE2 3.1Å; H322-F324 HydrophobicContact CB-CD2 4.41Å; H322-F324 HydrophobicContact CB-CE2 3.65Å; H322-F324 HydrophobicContact CB-CZ 4.04Å; H322-H395 HydrophobicContact CB-CB 3.74Å; H322-H395 AromaticContact ND1-CD2 3.66Å; H322-H395 AromaticContact ND1-CG 3.95Å; H322-E397 IonicContact CE1-OE2 2.88Å; H322-E397 IonicContact CG-OE2 3.07Å; H322-E397 IonicContact ND1-OE2 3.83Å; H322-E397 PolarHBondContact ND1-OE2 3.18Å; H322-V425 VanDerWaalsContact O-CA 3.29Å; H322-V425 WeakPolarHBondContact O-CA 3.5Å; H322-H426 PolarHBondContact N-O 2.87Å; H322-H426 PolarHBondContact O-N 3.27Å; H322-H426 VanDerWaalsContact O-N 3.11Å
323	S	88.2	Confident	78	Confident	25 Å²	25	39 Å²	39	18%	0.175	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	125.8	175.5	-58.9	0	0	0	0	109.3	H395 I396 S424	S323-H395 VanDerWaalsContact O-CA 3.3Å; S323-H395 WeakPolarHBondContact O-CA 3.47Å; S323-I396 PolarHBondContact O-N 2.88Å; S323-S424 CarbonylContact C-O 3.46Å; S323-S424 WeakPolarHBondContact CA-O 3.39Å
324	F	88.5	Confident	76	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	147	177.6	-61.1	-99.2	0	0	0	109.1	H322 Y326 G392 E393 H395 L423 S424 H426	H322-F324 HydrophobicContact CB-CD2 4.41Å; H322-F324 HydrophobicContact CB-CE2 3.65Å; H322-F324 HydrophobicContact CB-CZ 4.04Å; F324-Y326 HydrophobicContact CB-CE2 4.18Å; F324-G392 VanDerWaalsContact CD1-O 3.28Å; F324-G392 WeakPolarHBondContact CD1-O 3.46Å; F324-E393 WeakPolarHBondContact CE1-O 3.42Å; F324-H395 HydrophobicContact CD1-CB 4.01Å; F324-H395 HydrophobicContact CE1-CB 3.73Å; F324-H395 HydrophobicContact CE2-CB 4.29Å; F324-H395 HydrophobicContact CG-CB 4.42Å; F324-H395 HydrophobicContact CZ-CB 3.88Å; F324-L423 WeakPolarHBondContact O-CA 3.25Å; F324-S424 PolarHBondContact N-O 3.18Å; F324-S424 PolarHBondContact O-N 3.36Å; F324-H426 AromaticContact CD1-CE1 3.97Å; F324-H426 AromaticContact CD2-CD2 3.73Å; F324-H426 AromaticContact CD2-CE1 3.16Å; F324-H426 WeakPolarHBondContact CD2-CE1 3.5Å; F324-H426 AromaticContact CD2-CG 3.92Å; F324-H426 AromaticContact CD2-ND1 3.6Å; F324-H426 AromaticContact CD2-NE2 3.25Å; F324-H426 WeakPolarHBondContact CD2-NE2 3.38Å; F324-H426 AromaticContact CE1-CE1 3.91Å; F324-H426 AromaticContact CE2-CE1 3.1Å; F324-H426 WeakPolarHBondContact CE2-CE1 3.45Å; F324-H426 AromaticContact CE2-CG 3.87Å; F324-H426 AromaticContact CE2-ND1 3.21Å; F324-H426 WeakPolarHBondContact CE2-ND1 3.24Å; F324-H426 AromaticContact CE2-NE2 3.71Å; F324-H426 AromaticContact CG-CE1 3.62Å; F324-H426 AromaticContact CG-NE2 3.58Å; F324-H426 AromaticContact CZ-CE1 3.5Å; F324-H426 AromaticContact CZ-ND1 3.8Å
325	V	86.8	Confident	73.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128	-175	-169	0	0	0	0	109	F390 G392 I396 M399 I414 L421 L423	V325-F390 HydrophobicContact CB-CD1 3.67Å; V325-F390 HydrophobicContact CB-CE1 4.08Å; V325-F390 HydrophobicContact CG1-CD1 3.52Å; V325-F390 HydrophobicContact CG1-CE1 3.76Å; V325-F390 HydrophobicContact CG1-CG 4.19Å; V325-F390 HydrophobicContact CG2-CD1 4.37Å; V325-F390 HydrophobicContact CG2-CE1 4.37Å; V325-F390 CarbonylContact O-C 3.57Å; V325-F390 VanDerWaalsContact O-C 3.26Å; V325-F390 VanDerWaalsContact O-CA 3.32Å; V325-F390 WeakPolarHBondContact O-CA 3.22Å; V325-G392 PolarHBondContact O-N 3.47Å; V325-I396 HydrophobicContact CG2-CG1 4.38Å; V325-M399 HydrophobicContact CG2-SD 4.37Å; V325-I414 HydrophobicContact CG2-CD1 3.8Å; V325-I414 HydrophobicContact CG2-CG1 4.39Å; V325-L421 HydrophobicContact CG1-CB 4.08Å; V325-L421 HydrophobicContact CG1-CD1 4.21Å; V325-L421 HydrophobicContact CG1-CD2 3.94Å; V325-L421 HydrophobicContact CG1-CG 4.3Å; V325-L423 HydrophobicContact CB-CD2 4.41Å; V325-L423 HydrophobicContact CG1-CD2 4.42Å; V325-L423 HydrophobicContact CG2-CD2 3.74Å
326	Y	85.2	Confident	71.8	Confident	86 Å²	86	52 Å²	52	34%	0.337	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131	176.3	-68.3	-100.2	0	0	0	110	F324 C328 G392 L421 V422 S424	F324-Y326 HydrophobicContact CB-CE2 4.18Å; Y326-C328 PolarHBondContact O-N 3.38Å; Y326-G392 VanDerWaalsContact CE1-CA 3.49Å; Y326-G392 PolarHBondContact OH-O 3.07Å; Y326-L421 CarbonylContact O-C 3.41Å; Y326-L421 WeakPolarHBondContact O-CA 3.33Å; Y326-V422 PolarHBondContact N-O 2.9Å; Y326-V422 PolarHBondContact O-N 3.12Å; Y326-S424 WeakPolarHBondContact CE2-OG 3.18Å
327	L	81.3	Confident	69.6	Low	40 Å²	40	58.8 Å²	58.8	21%	0.209	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	112.7	170.2	-174.2	67.8	0	0	0	110.7	L359 L387 F390 L421	L327-L359 HydrophobicContact CD2-CD2 3.57Å; L327-L387 HydrophobicContact CD2-CD2 4.45Å; L327-F390 HydrophobicContact CB-CB 4Å; L327-F390 PolarHBondContact N-O 3.49Å; L327-F390 VanDerWaalsContact N-O 3.1Å; L327-L421 HydrophobicContact CD1-CD2 3.86Å
328	C	77.3	Confident	67.4	Low	57 Å²	57	62.7 Å²	62.7	39%	0.385	34%	0.34	S	S	.	.			trans	-113.2	74.7	176	-69.9	0	0	0	0	110.4	Y326 T330 M420 V422	Y326-C328 PolarHBondContact O-N 3.38Å; C328-T330 PolarHBondContact O-N 3.15Å; C328-M420 CarbonylContact C-O 3.42Å; C328-M420 WeakPolarHBondContact CA-O 3.27Å; C328-M420 PolarHBondContact N-O 2.93Å; C328-V422 HydrophobicContact CB-CG2 3.97Å; C328-V422 WeakPolarHBondContact SG-CG2 3.46Å
329	C	66.6	Low	65.1	Low	19 Å²	19	67.7 Å²	67.7	13%	0.128	37%	0.371	C	S	.	.			trans	-76.4	106.8	169	-65	0	0	0	0	109.7	G331 Q363	C329-G331 PolarHBondContact O-N 3.29Å; C329-G331 VanDerWaalsContact O-N 3.09Å; C329-Q363 HydrophobicContact CB-CB 3.74Å; C329-Q363 HydrophobicContact CB-CG 3.58Å
330	T	60	Low	63	Low	101 Å²	101	69.1 Å²	69.1	62%	0.62	38%	0.382	S	S	*	.			trans	-75.9	94.1	168.3	64.9	0	0	0	0	108.1	C328 T332 D366	C328-T330 PolarHBondContact O-N 3.15Å; T330-T332 PolarHBondContact O-N 3.21Å; T330-D366 VanDerWaalsContact O-OD2 3.13Å
331	G	53	Low	60.7	Low	33 Å²	33	77 Å²	77	34%	0.34	42%	0.417	S	S	.	.			trans	-65.1	59.4	-179.7	0	0	0	0	0	113.4	C329 E333 D366	C329-G331 PolarHBondContact O-N 3.29Å; C329-G331 VanDerWaalsContact O-N 3.09Å; G331-E333 PolarHBondContact O-N 3.01Å; G331-D366 WeakPolarHBondContact CA-OD2 3.36Å
332	T	48.5	Very low	58.4	Low	74 Å²	74	83.5 Å²	83.5	45%	0.454	45%	0.451	S	S	.	.			trans	-78.9	117.6	-179.7	56	0	0	0	0	108.1	T330 K334	T330-T332 PolarHBondContact O-N 3.21Å; T332-K334 PolarHBondContact O-N 3.38Å
333	E	45.3	Very low	56.3	Low	155 Å²	155	85.8 Å²	85.8	72%	0.724	46%	0.463	S	S	*	.			trans	-57.9	10.3	-178.9	-60.8	-180	147.4	0	0	115.2	G331 T335	G331-E333 PolarHBondContact O-N 3.01Å; E333-T335 PolarHBondContact O-N 3.32Å; E333-T335 VanDerWaalsContact O-N 3.08Å
334	K	44.8	Very low	54.3	Low	188 Å²	188	90.7 Å²	90.7	82%	0.817	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	2.6	-167.5	-68.8	-175.6	178.2	176.2	0	114.7	T332	T332-K334 PolarHBondContact O-N 3.38Å
335	T	40.7	Very low	52.5	Low	59 Å²	59	91.5 Å²	91.5	36%	0.362	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	45.3	178.5	-33.1	0	0	0	0	113.4	E333 M337 L369	E333-T335 PolarHBondContact O-N 3.32Å; E333-T335 VanDerWaalsContact O-N 3.08Å; T335-M337 PolarHBondContact O-N 3.15Å; T335-L369 HydrophobicContact CG2-CD1 3.98Å; T335-L369 HydrophobicContact CG2-CD2 4.09Å; T335-L369 WeakPolarHBondContact OG1-CD1 3.44Å
336	L	36.4	Very low	50.8	Low	159 Å²	159	95.4 Å²	95.4	83%	0.832	53%	0.527	S	S	*	.			trans	-75.5	8.9	163.7	-89.2	157.9	0	0	0	113.8
337	M	33.1	Very low	49.4	Very low	164 Å²	164	97.3 Å²	97.3	81%	0.808	54%	0.539	S	S	*	.	S	Bend	trans	-113.7	119.6	177.5	-64.6	-151.2	76.8	0	0	111.4	T335	T335-M337 PolarHBondContact O-N 3.15Å
338	S	40	Very low	48.1	Very low	86 Å²	86	98.6 Å²	98.6	60%	0.601	55%	0.552	S	S	*	*			trans	78.4	85.6	-175.3	75	0	0	0	0	115.1	P340	S338-P340 WeakPolarHBondContact O-CD 3.19Å; S338-P340 VanDerWaalsContact O-N 3.11Å
339	T	38.5	Very low	47	Very low	112 Å²	112	96.4 Å²	96.4	69%	0.687	54%	0.537	S	S	*	.			trans	-49.3	117.7	151.1	46.2	0	0	0	0	107.8	K341	T339-K341 VanDerWaalsContact C-N 3.3Å; T339-K341 PolarHBondContact O-N 2.9Å
340	P	41.3	Very low	46.6	Very low	54 Å²	54	100.1 Å²	100.1	35%	0.351	55%	0.549	S	S	.	.			trans	-70	92.5	173.3	-17.3	34.1	0	0	0	107.6	S338 D342 I343	S338-P340 WeakPolarHBondContact O-CD 3.19Å; S338-P340 VanDerWaalsContact O-N 3.11Å; P340-D342 PolarHBondContact O-N 3.24Å; P340-I343 HydrophobicContact CB-CD1 3.39Å; P340-I343 HydrophobicContact CB-CG1 3.53Å; P340-I343 HydrophobicContact CG-CD1 3.81Å; P340-I343 HydrophobicContact CG-CG1 4.48Å
341	K	41.1	Very low	46.6	Very low	183 Å²	183	102.4 Å²	102.4	80%	0.796	55%	0.546	S	S	*	.	S	Bend	trans	-71	-8.9	177.2	-79.5	-173.7	175.5	-179.6	0	113.1	T339	T339-K341 VanDerWaalsContact C-N 3.3Å; T339-K341 PolarHBondContact O-N 2.9Å
342	D	40.6	Very low	46.8	Very low	158 Å²	158	103.5 Å²	103.5	85%	0.845	54%	0.543	S	S	*	.			trans	-134.2	83.5	176.4	-62.6	-53	0	0	0	110	P340	P340-D342 PolarHBondContact O-N 3.24Å
343	I	46.1	Very low	47.2	Very low	48 Å²	48	100.1 Å²	100.1	25%	0.246	52%	0.522	C	S	.	.			trans	-119.5	114	157.5	-55	172.5	0	0	0	104.5	P340 F345	P340-I343 HydrophobicContact CB-CD1 3.39Å; P340-I343 HydrophobicContact CB-CG1 3.53Å; P340-I343 HydrophobicContact CG-CD1 3.81Å; P340-I343 HydrophobicContact CG-CG1 4.48Å; I343-F345 HydrophobicContact CG2-CB 3.9Å; I343-F345 HydrophobicContact CG2-CD2 4.05Å; I343-F345 HydrophobicContact CG2-CG 4.49Å; I343-F345 PolarHBondContact O-N 2.86Å
344	S	45.2	Very low	47.9	Very low	128 Å²	128	101.5 Å²	101.5	90%	0.895	52%	0.521	S	S	*	.			trans	-69.3	58.6	162.5	63.5	0	0	0	0	108.9	C346	S344-C346 PolarHBondContact O-N 3.08Å
345	F	51.1	Low	48.5	Very low	17 Å²	17	98.7 Å²	98.7	8%	0.075	51%	0.513	C	S	.	.			trans	-68.6	122.8	167.2	-149.1	-105.5	0	0	0	104.1	I343 E347 A349 R350 L353 L368 L380 I384	I343-F345 HydrophobicContact CG2-CB 3.9Å; I343-F345 HydrophobicContact CG2-CD2 4.05Å; I343-F345 HydrophobicContact CG2-CG 4.49Å; I343-F345 PolarHBondContact O-N 2.86Å; F345-E347 PolarHBondContact O-N 2.71Å; F345-A349 HydrophobicContact CD1-CB 3.65Å; F345-A349 HydrophobicContact CE1-CB 3.22Å; F345-A349 HydrophobicContact CZ-CB 3.74Å; F345-R350 HydrophobicContact CD1-CB 3.8Å; F345-R350 HydrophobicContact CD1-CG 3.44Å; F345-R350 VanDerWaalsContact CD1-CG 3.44Å; F345-R350 HydrophobicContact CE1-CB 4.1Å; F345-R350 HydrophobicContact CE1-CG 3.8Å; F345-R350 HydrophobicContact CG-CG 4.34Å; F345-L353 HydrophobicContact CE1-CD1 4.09Å; F345-L353 HydrophobicContact CZ-CD1 3.82Å; F345-L368 HydrophobicContact CD2-CD2 3.88Å; F345-L368 HydrophobicContact CE2-CD2 3.45Å; F345-L368 VanDerWaalsContact CE2-CD2 3.45Å; F345-L368 HydrophobicContact CZ-CD2 3.83Å; F345-L380 HydrophobicContact CD2-CD2 4.26Å; F345-L380 HydrophobicContact CE2-CD2 3.45Å; F345-L380 VanDerWaalsContact CE2-CD2 3.45Å; F345-L380 HydrophobicContact CZ-CD2 3.84Å; F345-I384 HydrophobicContact CZ-CD1 4.42Å
346	C	51.4	Low	49.1	Very low	83 Å²	83	100.4 Å²	100.4	56%	0.561	52%	0.52	S	S	*	.			trans	-53.1	121.3	171.1	-161.7	0	0	0	0	105.9	S344 S348 A349 R350	S344-C346 PolarHBondContact O-N 3.08Å; C346-S348 CarbonylContact O-C 3.55Å; C346-S348 PolarHBondContact O-N 3.05Å; C346-S348 PolarHBondContact SG-OG 2.71Å; C346-A349 PolarHBondContact O-N 3.28Å; C346-R350 PolarHBondContact O-N 2.95Å
347	E	54.8	Low	50.1	Low	125 Å²	125	93.5 Å²	93.5	58%	0.584	49%	0.485	S	S	*	.	H	α-helix	trans	-48.3	-28.5	177.3	-86.5	-168.4	156.6	0	0	110.7	F345 R350 R351	F345-E347 PolarHBondContact O-N 2.71Å; E347-R350 PolarHBondContact O-N 3.22Å; E347-R351 WeakPolarHBondContact O-CB 3.38Å; E347-R351 VanDerWaalsContact O-CG 3.27Å; E347-R351 WeakPolarHBondContact O-CG 3.32Å; E347-R351 PolarHBondContact O-N 3.35Å; E347-R351 IonicContact OE2-CZ 3.89Å; E347-R351 IonicContact OE2-NH2 2.91Å; E347-R351 PolarHBondContact OE2-NH2 3.2Å
348	S	53.7	Low	51.4	Low	68 Å²	68	94 Å²	94	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-52.6	-50	169.3	-47.4	0	0	0	0	114	C346 R350 R351 M352	C346-S348 CarbonylContact O-C 3.55Å; C346-S348 PolarHBondContact O-N 3.05Å; C346-S348 PolarHBondContact SG-OG 2.71Å; S348-R350 PolarHBondContact O-N 3.01Å; S348-R351 PolarHBondContact O-N 2.79Å; S348-M352 WeakPolarHBondContact O-CB 3.48Å; S348-M352 VanDerWaalsContact O-CG 3.27Å; S348-M352 WeakPolarHBondContact O-CG 3.48Å; S348-M352 PolarHBondContact O-N 2.66Å
349	A	54.8	Low	52.6	Low	10 Å²	10	91.6 Å²	91.6	8%	0.083	47%	0.471	C	S	.	.	H	α-helix	trans	-68.3	-35.9	179.4	0	0	0	0	0	111.7	F345 C346 R351 M352 L353 I384	F345-A349 HydrophobicContact CD1-CB 3.65Å; F345-A349 HydrophobicContact CE1-CB 3.22Å; F345-A349 HydrophobicContact CZ-CB 3.74Å; C346-A349 PolarHBondContact O-N 3.28Å; A349-R351 VanDerWaalsContact C-N 3.34Å; A349-M352 PolarHBondContact O-N 3.28Å; A349-L353 WeakPolarHBondContact O-CB 3.29Å; A349-L353 WeakPolarHBondContact O-CG 3.24Å; A349-L353 PolarHBondContact O-N 3.17Å; A349-I384 HydrophobicContact CB-CD1 3.63Å
350	R	58.8	Low	53.8	Low	98 Å²	98	91.5 Å²	91.5	37%	0.37	47%	0.467	S	S	.	.	H	α-helix	trans	-68	-37.7	176.5	-107.2	167.2	-162.9	173.5	6.1	110.8	F345 C346 E347 S348 R354 F364	F345-R350 HydrophobicContact CD1-CB 3.8Å; F345-R350 HydrophobicContact CD1-CG 3.44Å; F345-R350 VanDerWaalsContact CD1-CG 3.44Å; F345-R350 HydrophobicContact CE1-CB 4.1Å; F345-R350 HydrophobicContact CE1-CG 3.8Å; F345-R350 HydrophobicContact CG-CG 4.34Å; C346-R350 PolarHBondContact O-N 2.95Å; E347-R350 PolarHBondContact O-N 3.22Å; S348-R350 PolarHBondContact O-N 3.01Å; R350-R354 WeakPolarHBondContact O-CB 3.25Å; R350-R354 PolarHBondContact O-N 3.15Å; R350-F364 HydrophobicContact CG-CZ 3.87Å
351	R	59.5	Low	54.8	Low	149 Å²	149	94.1 Å²	94.1	56%	0.562	47%	0.474	S	S	*	.	H	α-helix	trans	-69.3	-44.7	172.7	-73.7	178	-168.3	172.9	10.3	111	E347 S348 A349 L353 R354 I355	E347-R351 WeakPolarHBondContact O-CB 3.38Å; E347-R351 VanDerWaalsContact O-CG 3.27Å; E347-R351 WeakPolarHBondContact O-CG 3.32Å; E347-R351 PolarHBondContact O-N 3.35Å; E347-R351 IonicContact OE2-CZ 3.89Å; E347-R351 IonicContact OE2-NH2 2.91Å; E347-R351 PolarHBondContact OE2-NH2 3.2Å; S348-R351 PolarHBondContact O-N 2.79Å; A349-R351 VanDerWaalsContact C-N 3.34Å; R351-L353 PolarHBondContact O-N 3.13Å; R351-R354 PolarHBondContact O-N 3.34Å; R351-I355 HydrophobicContact CB-CD1 4.26Å; R351-I355 WeakPolarHBondContact O-CB 3.17Å; R351-I355 WeakPolarHBondContact O-CD1 3.31Å; R351-I355 WeakPolarHBondContact O-CG1 3.42Å; R351-I355 PolarHBondContact O-N 3.12Å
352	M	56.3	Low	55.9	Low	56 Å²	56	89 Å²	89	28%	0.276	46%	0.455	S	S	.	.	H	α-helix	trans	-60.7	-47.2	179.1	-76.7	-167.4	-65.2	0	0	112	S348 A349 R354 I355 N356 I384	S348-M352 WeakPolarHBondContact O-CB 3.48Å; S348-M352 VanDerWaalsContact O-CG 3.27Å; S348-M352 WeakPolarHBondContact O-CG 3.48Å; S348-M352 PolarHBondContact O-N 2.66Å; A349-M352 PolarHBondContact O-N 3.28Å; M352-R354 VanDerWaalsContact C-N 3.3Å; M352-R354 PolarHBondContact O-N 2.93Å; M352-I355 PolarHBondContact O-N 3.35Å; M352-N356 WeakPolarHBondContact O-CB 3.48Å; M352-N356 PolarHBondContact O-N 2.88Å; M352-I384 HydrophobicContact CB-CG2 3.82Å; M352-I384 HydrophobicContact CE-CG2 4.42Å
353	L	58.6	Low	57.1	Low	3 Å²	3	83.8 Å²	83.8	2%	0.016	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-31.8	177	-78.2	166.9	0	0	0	113.5	F345 A349 R351 C357 L359 F364 I384 L387	F345-L353 HydrophobicContact CE1-CD1 4.09Å; F345-L353 HydrophobicContact CZ-CD1 3.82Å; A349-L353 WeakPolarHBondContact O-CB 3.29Å; A349-L353 WeakPolarHBondContact O-CG 3.24Å; A349-L353 PolarHBondContact O-N 3.17Å; R351-L353 PolarHBondContact O-N 3.13Å; L353-C357 WeakPolarHBondContact O-CB 3.36Å; L353-C357 PolarHBondContact O-SG 3.42Å; L353-C357 VanDerWaalsContact O-SG 3.38Å; L353-L359 HydrophobicContact CD2-CD1 4.2Å; L353-F364 HydrophobicContact CB-CD2 4.16Å; L353-F364 HydrophobicContact CB-CE2 3.78Å; L353-F364 HydrophobicContact CD1-CD2 4.13Å; L353-F364 HydrophobicContact CD1-CE2 3.56Å; L353-F364 HydrophobicContact CG-CE2 4.29Å; L353-I384 HydrophobicContact CD1-CD1 3.86Å; L353-I384 HydrophobicContact CD1-CG1 4.05Å; L353-I384 HydrophobicContact CD2-CG1 3.91Å; L353-I384 HydrophobicContact CD2-CG2 4.21Å; L353-I384 HydrophobicContact CG-CD1 3.98Å; L353-I384 HydrophobicContact CG-CG1 3.88Å; L353-I384 HydrophobicContact CG-CG2 4.1Å; L353-L387 HydrophobicContact CD2-CD1 3.96Å
354	R	59.5	Low	58.1	Low	183 Å²	183	82.5 Å²	82.5	69%	0.691	42%	0.418	S	S	*	.	H	α-helix	trans	-79.9	-27.1	176.3	-84	-174.9	168.2	176.2	-2.5	113.9	R350 R351 M352	R350-R354 WeakPolarHBondContact O-CB 3.25Å; R350-R354 PolarHBondContact O-N 3.15Å; R351-R354 PolarHBondContact O-N 3.34Å; M352-R354 VanDerWaalsContact C-N 3.3Å; M352-R354 PolarHBondContact O-N 2.93Å
355	I	56.8	Low	59	Low	130 Å²	130	80.1 Å²	80.1	67%	0.667	39%	0.393	S	S	*	.	H	α-helix	trans	-88.8	-38.4	-174.9	-67.3	165.9	0	0	0	110.9	R351 M352	R351-I355 HydrophobicContact CB-CD1 4.26Å; R351-I355 WeakPolarHBondContact O-CB 3.17Å; R351-I355 WeakPolarHBondContact O-CD1 3.31Å; R351-I355 WeakPolarHBondContact O-CG1 3.42Å; R351-I355 PolarHBondContact O-N 3.12Å; M352-I355 PolarHBondContact O-N 3.35Å
356	N	53.9	Low	59.8	Low	95 Å²	95	80.1 Å²	80.1	51%	0.508	39%	0.394	S	S	.	.	H	α-helix	trans	-99.4	-7.4	-170.2	-68.5	-11.4	0	0	0	114.1	M352 P388	M352-N356 WeakPolarHBondContact O-CB 3.48Å; M352-N356 PolarHBondContact O-N 2.88Å; N356-P388 HydrophobicContact CB-CG 4.41Å
357	C	57.9	Low	60.5	Low	13 Å²	13	76.2 Å²	76.2	9%	0.088	37%	0.367	C	S	.	.			trans	-137.9	117.9	-166.9	-27.1	0	0	0	0	109.2	L353 L359 L387	L353-C357 WeakPolarHBondContact O-CB 3.36Å; L353-C357 PolarHBondContact O-SG 3.42Å; L353-C357 VanDerWaalsContact O-SG 3.38Å; C357-L359 HydrophobicContact CB-CB 4.43Å; C357-L359 HydrophobicContact CB-CD1 3.54Å; C357-L359 HydrophobicContact CB-CG 3.53Å; C357-L359 PolarHBondContact O-N 3.21Å; C357-L387 HydrophobicContact CB-CD2 3.57Å; C357-L387 VanDerWaalsContact SG-CD2 3.51Å
358	N	60.3	Low	61.1	Low	175 Å²	175	71.5 Å²	71.5	94%	0.936	35%	0.346	S	S	*	.			trans	-73.5	50	170.7	-77.3	-24.3	0	0	0	110.9
359	L	64.1	Low	61.8	Low	36 Å²	36	70.9 Å²	70.9	19%	0.188	34%	0.337	C	S	.	.			trans	-79.9	134.7	-178	-66.3	169.8	0	0	0	110	L327 L353 C357 Q363 I367 L387	L327-L359 HydrophobicContact CD2-CD2 3.57Å; L353-L359 HydrophobicContact CD2-CD1 4.2Å; C357-L359 HydrophobicContact CB-CB 4.43Å; C357-L359 HydrophobicContact CB-CD1 3.54Å; C357-L359 HydrophobicContact CB-CG 3.53Å; C357-L359 PolarHBondContact O-N 3.21Å; L359-Q363 HydrophobicContact CB-CB 4.38Å; L359-Q363 HydrophobicContact CD2-CB 4.21Å; L359-I367 HydrophobicContact CD1-CD1 3.56Å; L359-I367 HydrophobicContact CD2-CD1 4.38Å; L359-L387 HydrophobicContact CD1-CD1 4.08Å; L359-L387 HydrophobicContact CD1-CD2 3.81Å; L359-L387 HydrophobicContact CD2-CD2 4.23Å; L359-L387 HydrophobicContact CG-CD2 4.24Å
360	N	63.4	Low	62.3	Low	110 Å²	110	71.2 Å²	71.2	59%	0.588	34%	0.34	S	S	*	.			trans	-67.3	149.7	169.4	-68.7	-24.2	0	0	0	109.7	L362 Q363 F364	N360-L362 PolarHBondContact O-N 3.28Å; N360-Q363 HydrophobicContact CB-CG 4.15Å; N360-Q363 VanDerWaalsContact N-OE1 3.13Å; N360-Q363 WeakPolarHBondContact O-CA 3.15Å; N360-Q363 WeakPolarHBondContact O-CB 3.39Å; N360-Q363 PolarHBondContact O-N 3.48Å; N360-F364 PolarHBondContact O-N 2.93Å
361	E	63.5	Low	62.6	Low	108 Å²	108	68.3 Å²	68.3	51%	0.505	33%	0.33	S	S	.	.	H	α-helix	trans	-54.9	-29.7	-179.3	-168	71.5	-156.2	0	0	112.7	Q365	E361-Q365 WeakPolarHBondContact O-CG 3.41Å; E361-Q365 PolarHBondContact O-N 3.17Å
362	L	63.3	Low	62.7	Low	75 Å²	75	67.4 Å²	67.4	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-66.7	-46.3	172.9	-70.1	167.4	0	0	0	112.4	N360 F364 Q365 D366	N360-L362 PolarHBondContact O-N 3.28Å; L362-F364 PolarHBondContact O-N 3.01Å; L362-Q365 PolarHBondContact O-N 3.5Å; L362-Q365 VanDerWaalsContact O-N 3.12Å; L362-D366 VanDerWaalsContact O-CG 3.32Å; L362-D366 PolarHBondContact O-N 2.96Å
363	Q	66.8	Low	62.9	Low	50 Å²	50	69 Å²	69	23%	0.234	35%	0.349	C	S	.	.	H	α-helix	trans	-63.8	-36.6	176.9	-57	-179.5	-37.2	0	0	110.6	C329 L359 N360 D366 I367	C329-Q363 HydrophobicContact CB-CB 3.74Å; C329-Q363 HydrophobicContact CB-CG 3.58Å; L359-Q363 HydrophobicContact CB-CB 4.38Å; L359-Q363 HydrophobicContact CD2-CB 4.21Å; N360-Q363 HydrophobicContact CB-CG 4.15Å; N360-Q363 VanDerWaalsContact N-OE1 3.13Å; N360-Q363 WeakPolarHBondContact O-CA 3.15Å; N360-Q363 WeakPolarHBondContact O-CB 3.39Å; N360-Q363 PolarHBondContact O-N 3.48Å; Q363-D366 PolarHBondContact O-N 3.23Å; Q363-I367 WeakPolarHBondContact O-CD1 3.39Å; Q363-I367 VanDerWaalsContact O-CG1 3.24Å; Q363-I367 WeakPolarHBondContact O-CG1 3.4Å; Q363-I367 PolarHBondContact O-N 3.24Å
364	F	65.9	Low	63	Low	20 Å²	20	69.3 Å²	69.3	9%	0.088	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-42.3	173.2	-177	-101.9	0	0	0	112.2	R350 L353 N360 L362 I367 L368	R350-F364 HydrophobicContact CG-CZ 3.87Å; L353-F364 HydrophobicContact CB-CD2 4.16Å; L353-F364 HydrophobicContact CB-CE2 3.78Å; L353-F364 HydrophobicContact CD1-CD2 4.13Å; L353-F364 HydrophobicContact CD1-CE2 3.56Å; L353-F364 HydrophobicContact CG-CE2 4.29Å; N360-F364 PolarHBondContact O-N 2.93Å; L362-F364 PolarHBondContact O-N 3.01Å; F364-I367 PolarHBondContact O-N 2.94Å; F364-L368 HydrophobicContact CD1-CD1 3.71Å; F364-L368 HydrophobicContact CD1-CG 4.33Å; F364-L368 HydrophobicContact CE1-CD1 3.29Å; F364-L368 HydrophobicContact CE1-CG 4.02Å; F364-L368 HydrophobicContact CZ-CD1 3.87Å; F364-L368 HydrophobicContact CZ-CD2 4.35Å; F364-L368 HydrophobicContact CZ-CG 4.18Å; F364-L368 WeakPolarHBondContact O-CB 3.2Å; F364-L368 VanDerWaalsContact O-CG 3.29Å; F364-L368 WeakPolarHBondContact O-CG 3.39Å; F364-L368 PolarHBondContact O-N 3.33Å
365	Q	64.1	Low	63.2	Low	78 Å²	78	65.1 Å²	65.1	36%	0.364	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-40.5	174.4	-76.4	179.7	27.5	0	0	112.2	E361 L362 L368 L369	E361-Q365 WeakPolarHBondContact O-CG 3.41Å; E361-Q365 PolarHBondContact O-N 3.17Å; L362-Q365 PolarHBondContact O-N 3.5Å; L362-Q365 VanDerWaalsContact O-N 3.12Å; Q365-L368 PolarHBondContact O-N 3.34Å; Q365-L369 VanDerWaalsContact O-CG 3.27Å; Q365-L369 WeakPolarHBondContact O-CG 3.46Å; Q365-L369 PolarHBondContact O-N 3.12Å
366	D	67.9	Low	64	Low	18 Å²	18	61.7 Å²	61.7	10%	0.096	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-51.3	175	-67.2	-25	0	0	0	110	T330 G331 L362 Q363 L368 L369 A370 M420	T330-D366 VanDerWaalsContact O-OD2 3.13Å; G331-D366 WeakPolarHBondContact CA-OD2 3.36Å; L362-D366 VanDerWaalsContact O-CG 3.32Å; L362-D366 PolarHBondContact O-N 2.96Å; Q363-D366 PolarHBondContact O-N 3.23Å; D366-L368 VanDerWaalsContact C-N 3.29Å; D366-L368 PolarHBondContact O-N 3.16Å; D366-L369 CarbonylContact O-C 3.53Å; D366-L369 WeakPolarHBondContact O-CA 3.01Å; D366-L369 WeakPolarHBondContact O-CB 3.47Å; D366-L369 PolarHBondContact O-N 3.42Å; D366-A370 PolarHBondContact O-N 2.99Å; D366-M420 VanDerWaalsContact C-CE 3.49Å; D366-M420 HydrophobicContact CB-CE 3.97Å; D366-M420 WeakPolarHBondContact O-CE 3.17Å
367	I	67.8	Low	64.9	Low	1 Å²	1	61.9 Å²	61.9	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-57.3	-42	177.3	-68	160.2	0	0	0	111.7	L359 Q363 F364 L369 A370 H371 F383 L387 M420	L359-I367 HydrophobicContact CD1-CD1 3.56Å; L359-I367 HydrophobicContact CD2-CD1 4.38Å; Q363-I367 WeakPolarHBondContact O-CD1 3.39Å; Q363-I367 VanDerWaalsContact O-CG1 3.24Å; Q363-I367 WeakPolarHBondContact O-CG1 3.4Å; Q363-I367 PolarHBondContact O-N 3.24Å; F364-I367 PolarHBondContact O-N 2.94Å; I367-L369 VanDerWaalsContact C-N 3.3Å; I367-L369 PolarHBondContact O-N 3.39Å; I367-A370 PolarHBondContact O-N 3.38Å; I367-H371 PolarHBondContact O-N 2.77Å; I367-F383 HydrophobicContact CG1-CE1 4.29Å; I367-F383 HydrophobicContact CG2-CD1 4.36Å; I367-F383 HydrophobicContact CG2-CE1 3.73Å; I367-L387 HydrophobicContact CD1-CD1 3.85Å; I367-M420 HydrophobicContact CG1-SD 4.46Å
368	L	66.4	Low	65.9	Low	26 Å²	26	63.7 Å²	63.7	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-63.6	-35.6	175.7	-75.8	175.4	0	0	0	112.6	F345 F364 Q365 D366 R372	F345-L368 HydrophobicContact CD2-CD2 3.88Å; F345-L368 HydrophobicContact CE2-CD2 3.45Å; F345-L368 VanDerWaalsContact CE2-CD2 3.45Å; F345-L368 HydrophobicContact CZ-CD2 3.83Å; F364-L368 HydrophobicContact CD1-CD1 3.71Å; F364-L368 HydrophobicContact CD1-CG 4.33Å; F364-L368 HydrophobicContact CE1-CD1 3.29Å; F364-L368 HydrophobicContact CE1-CG 4.02Å; F364-L368 HydrophobicContact CZ-CD1 3.87Å; F364-L368 HydrophobicContact CZ-CD2 4.35Å; F364-L368 HydrophobicContact CZ-CG 4.18Å; F364-L368 WeakPolarHBondContact O-CB 3.2Å; F364-L368 VanDerWaalsContact O-CG 3.29Å; F364-L368 WeakPolarHBondContact O-CG 3.39Å; F364-L368 PolarHBondContact O-N 3.33Å; Q365-L368 PolarHBondContact O-N 3.34Å; D366-L368 VanDerWaalsContact C-N 3.29Å; D366-L368 PolarHBondContact O-N 3.16Å; L368-R372 PolarHBondContact O-N 2.94Å
369	L	67.7	Low	66.7	Low	55 Å²	55	59.4 Å²	59.4	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-71	-41.3	175.6	-71.7	164.4	0	0	0	111.4	T335 Q365 D366 I367 H371 R372	T335-L369 HydrophobicContact CG2-CD1 3.98Å; T335-L369 HydrophobicContact CG2-CD2 4.09Å; T335-L369 WeakPolarHBondContact OG1-CD1 3.44Å; Q365-L369 VanDerWaalsContact O-CG 3.27Å; Q365-L369 WeakPolarHBondContact O-CG 3.46Å; Q365-L369 PolarHBondContact O-N 3.12Å; D366-L369 CarbonylContact O-C 3.53Å; D366-L369 WeakPolarHBondContact O-CA 3.01Å; D366-L369 WeakPolarHBondContact O-CB 3.47Å; D366-L369 PolarHBondContact O-N 3.42Å; I367-L369 VanDerWaalsContact C-N 3.3Å; I367-L369 PolarHBondContact O-N 3.39Å; L369-H371 VanDerWaalsContact C-N 3.32Å; L369-H371 PolarHBondContact O-N 3.14Å; L369-R372 WeakPolarHBondContact O-CB 3.33Å; L369-R372 PolarHBondContact O-N 2.88Å
370	A	66.1	Low	67.2	Low	17 Å²	17	58.2 Å²	58.2	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-37.5	172.6	0	0	0	0	0	112.2	D366 I367 R372 A373 S374 Y417 M420	D366-A370 PolarHBondContact O-N 2.99Å; I367-A370 PolarHBondContact O-N 3.38Å; A370-R372 PolarHBondContact O-N 3.47Å; A370-A373 WeakPolarHBondContact O-CA 3.38Å; A370-A373 VanDerWaalsContact O-CB 3.29Å; A370-A373 WeakPolarHBondContact O-CB 3.21Å; A370-A373 PolarHBondContact O-N 2.95Å; A370-S374 PolarHBondContact O-N 3.48Å; A370-Y417 HydrophobicContact CB-CD1 3.67Å; A370-Y417 HydrophobicContact CB-CE1 3.76Å; A370-M420 HydrophobicContact CB-CE 3.29Å; A370-M420 HydrophobicContact CB-SD 3.51Å; A370-M420 VanDerWaalsContact CB-SD 3.51Å
371	H	65.8	Low	67.9	Low	36 Å²	36	58 Å²	58	17%	0.167	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-33.3	175.5	-177.3	50.2	0	0	0	112.5	I367 L369 A373 S374 L380	I367-H371 PolarHBondContact O-N 2.77Å; L369-H371 VanDerWaalsContact C-N 3.32Å; L369-H371 PolarHBondContact O-N 3.14Å; H371-A373 PolarHBondContact O-N 3.27Å; H371-A373 VanDerWaalsContact O-N 3.12Å; H371-S374 PolarHBondContact CE1-O 3.33Å; H371-S374 VanDerWaalsContact CE1-O 3.22Å; H371-S374 PolarHBondContact ND1-O 3.27Å; H371-S374 CarbonylContact O-C 3.27Å; H371-S374 VanDerWaalsContact O-C 3.27Å; H371-S374 PolarHBondContact O-N 3.04Å; H371-S374 VanDerWaalsContact O-N 3.08Å; H371-L380 HydrophobicContact CB-CD1 4.03Å; H371-L380 VanDerWaalsContact CE1-CB 3.44Å; H371-L380 WeakPolarHBondContact CE1-CB 3.48Å
372	R	59.9	Low	68.8	Low	130 Å²	130	54.6 Å²	54.6	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-59.6	-23.2	173	-74.5	173.2	159.5	-172.9	-12.8	112.8	L368 L369 A370	L368-R372 PolarHBondContact O-N 2.94Å; L369-R372 WeakPolarHBondContact O-CB 3.33Å; L369-R372 PolarHBondContact O-N 2.88Å; A370-R372 PolarHBondContact O-N 3.47Å
373	A	60.5	Low	69.7	Low	89 Å²	89	51 Å²	51	74%	0.736	29%	0.287	S	S	*	.	H	α-helix	trans	-83.1	-38.4	173.3	0	0	0	0	0	112.4	A370 H371 A375	A370-A373 WeakPolarHBondContact O-CA 3.38Å; A370-A373 VanDerWaalsContact O-CB 3.29Å; A370-A373 WeakPolarHBondContact O-CB 3.21Å; A370-A373 PolarHBondContact O-N 2.95Å; H371-A373 PolarHBondContact O-N 3.27Å; H371-A373 VanDerWaalsContact O-N 3.12Å; A373-A375 PolarHBondContact O-N 3.12Å
374	S	62.4	Low	70.3	Confident	10 Å²	10	48.8 Å²	48.8	7%	0.07	28%	0.276	C	S	.	.	S	Bend	trans	-93.5	85.6	176.4	-169.7	0	0	0	0	111	A370 H371 D376 D416	A370-S374 PolarHBondContact O-N 3.48Å; H371-S374 PolarHBondContact CE1-O 3.33Å; H371-S374 VanDerWaalsContact CE1-O 3.22Å; H371-S374 PolarHBondContact ND1-O 3.27Å; H371-S374 CarbonylContact O-C 3.27Å; H371-S374 VanDerWaalsContact O-C 3.27Å; H371-S374 PolarHBondContact O-N 3.04Å; H371-S374 VanDerWaalsContact O-N 3.08Å; S374-D376 PolarHBondContact O-N 3.46Å; S374-D416 PolarHBondContact OG-OD2 3.12Å; S374-D416 VanDerWaalsContact OG-OD2 3.1Å
375	A	62.6	Low	71.1	Confident	95 Å²	95	51.2 Å²	51.2	79%	0.785	29%	0.288	S	S	*	.			trans	-63.9	2	-171	0	0	0	0	0	116.7	A373	A373-A375 PolarHBondContact O-N 3.12Å
376	D	73.1	Confident	72.1	Confident	59 Å²	59	47.5 Å²	47.5	32%	0.316	27%	0.271	S	S	.	.			trans	-97.9	113.8	-173.8	-169.2	-8	0	0	0	111.3	S374 A378 R379 L380	S374-D376 PolarHBondContact O-N 3.46Å; D376-A378 PolarHBondContact O-N 2.99Å; D376-A378 PolarHBondContact OD1-N 3.19Å; D376-R379 HydrophobicContact CB-CB 4.21Å; D376-R379 HydrophobicContact CB-CG 3.82Å; D376-R379 PolarHBondContact O-N 3.3Å; D376-R379 IonicContact OD2-CZ 3.91Å; D376-R379 IonicContact OD2-NE 3.08Å; D376-R379 PolarHBondContact OD2-NE 2.95Å; D376-R379 VanDerWaalsContact OD2-NE 3.08Å; D376-R379 IonicContact OD2-NH2 4Å; D376-L380 PolarHBondContact O-N 3.44Å
377	P	74	Confident	72.7	Confident	99 Å²	99	47.2 Å²	47.2	64%	0.643	27%	0.269	S	S	*	.	H	α-helix	trans	-62.5	-29.7	-177.5	25.4	-34.6	0	0	0	113.1	R379 L380 E381	P377-R379 VanDerWaalsContact C-N 3.35Å; P377-L380 PolarHBondContact O-N 3.32Å; P377-E381 PolarHBondContact O-N 3.31Å
378	A	78.8	Confident	73.4	Confident	50 Å²	50	49.9 Å²	49.9	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-68.9	-35.2	178.4	0	0	0	0	0	111.9	D376 E381 M382	D376-A378 PolarHBondContact O-N 2.99Å; D376-A378 PolarHBondContact OD1-N 3.19Å; A378-E381 PolarHBondContact O-N 2.97Å; A378-M382 WeakPolarHBondContact O-CG 3.32Å; A378-M382 PolarHBondContact O-N 3.28Å; A378-M382 VanDerWaalsContact O-N 3.08Å
379	R	76.1	Confident	74.2	Confident	85 Å²	85	50.4 Å²	50.4	32%	0.321	29%	0.287	S	S	.	.	H	α-helix	trans	-71.3	-34.1	178.2	-62.7	-176.4	-159.1	-173	-3.5	112.6	D376 P377 E381 M382 F383 D416	D376-R379 HydrophobicContact CB-CB 4.21Å; D376-R379 HydrophobicContact CB-CG 3.82Å; D376-R379 PolarHBondContact O-N 3.3Å; D376-R379 IonicContact OD2-CZ 3.91Å; D376-R379 IonicContact OD2-NE 3.08Å; D376-R379 PolarHBondContact OD2-NE 2.95Å; D376-R379 VanDerWaalsContact OD2-NE 3.08Å; D376-R379 IonicContact OD2-NH2 4Å; P377-R379 VanDerWaalsContact C-N 3.35Å; R379-E381 VanDerWaalsContact C-N 3.33Å; R379-M382 HydrophobicContact CB-CE 4.33Å; R379-M382 HydrophobicContact CG-CE 3.96Å; R379-M382 PolarHBondContact O-N 3.35Å; R379-F383 WeakPolarHBondContact O-CB 3.37Å; R379-F383 PolarHBondContact O-N 2.89Å; R379-D416 WeakPolarHBondContact CD-OD2 3.32Å; R379-D416 IonicContact CZ-OD2 3.79Å; R379-D416 IonicContact NE-OD2 3.6Å; R379-D416 IonicContact NH1-OD1 3.05Å; R379-D416 IonicContact NH1-OD2 2.9Å; R379-D416 PolarHBondContact NH1-OD2 2.92Å
380	L	74.6	Confident	74.9	Confident	12 Å²	12	48.2 Å²	48.2	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-44.5	171.4	179.2	65.3	0	0	0	111.1	F345 H371 D376 P377 M382 F383 I384	F345-L380 HydrophobicContact CD2-CD2 4.26Å; F345-L380 HydrophobicContact CE2-CD2 3.45Å; F345-L380 VanDerWaalsContact CE2-CD2 3.45Å; F345-L380 HydrophobicContact CZ-CD2 3.84Å; H371-L380 HydrophobicContact CB-CD1 4.03Å; H371-L380 VanDerWaalsContact CE1-CB 3.44Å; H371-L380 WeakPolarHBondContact CE1-CB 3.48Å; D376-L380 PolarHBondContact O-N 3.44Å; P377-L380 PolarHBondContact O-N 3.32Å; L380-M382 VanDerWaalsContact C-N 3.32Å; L380-M382 PolarHBondContact O-N 2.93Å; L380-F383 PolarHBondContact O-N 2.96Å; L380-I384 HydrophobicContact CD1-CD1 3.99Å; L380-I384 HydrophobicContact CD1-CG1 4.16Å; L380-I384 HydrophobicContact CD2-CD1 4.27Å; L380-I384 HydrophobicContact CG-CD1 3.77Å; L380-I384 HydrophobicContact CG-CG1 4.33Å; L380-I384 VanDerWaalsContact O-CG1 3.22Å; L380-I384 WeakPolarHBondContact O-CG1 3.27Å; L380-I384 PolarHBondContact O-N 3.46Å
381	E	78.7	Confident	75.7	Confident	104 Å²	104	50.6 Å²	50.6	49%	0.486	29%	0.286	S	S	.	.	H	α-helix	trans	-60.8	-44.3	178.7	-169.4	167.6	-165.4	0	0	111.1	P377 A378 R379 I384 Q385	P377-E381 PolarHBondContact O-N 3.31Å; A378-E381 PolarHBondContact O-N 2.97Å; R379-E381 VanDerWaalsContact C-N 3.33Å; E381-I384 PolarHBondContact O-N 3.33Å; E381-Q385 VanDerWaalsContact O-CG 3.32Å; E381-Q385 WeakPolarHBondContact O-CG 3.45Å; E381-Q385 PolarHBondContact O-N 2.66Å
382	M	82.2	Confident	76.3	Confident	38 Å²	38	49.1 Å²	49.1	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-42.5	173	-69	-173	-68	0	0	112.8	A378 R379 L380 I384 Q385 L386 L405 E409 V413	A378-M382 WeakPolarHBondContact O-CG 3.32Å; A378-M382 PolarHBondContact O-N 3.28Å; A378-M382 VanDerWaalsContact O-N 3.08Å; R379-M382 HydrophobicContact CB-CE 4.33Å; R379-M382 HydrophobicContact CG-CE 3.96Å; R379-M382 PolarHBondContact O-N 3.35Å; L380-M382 VanDerWaalsContact C-N 3.32Å; L380-M382 PolarHBondContact O-N 2.93Å; M382-I384 VanDerWaalsContact C-N 3.34Å; M382-I384 PolarHBondContact O-N 3.13Å; M382-Q385 PolarHBondContact O-N 2.88Å; M382-L386 WeakPolarHBondContact O-CG 3.37Å; M382-L386 PolarHBondContact O-N 2.9Å; M382-L405 HydrophobicContact SD-CD2 4.32Å; M382-E409 HydrophobicContact SD-CB 4.46Å; M382-V413 HydrophobicContact CB-CG2 4.02Å; M382-V413 HydrophobicContact CE-CG2 4.33Å
383	F	83	Confident	77.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-42.7	176.5	179.1	-97.6	0	0	0	111.8	I367 R379 L380 Q385 L386 L387 F390 V413 Y417 L421	I367-F383 HydrophobicContact CG1-CE1 4.29Å; I367-F383 HydrophobicContact CG2-CD1 4.36Å; I367-F383 HydrophobicContact CG2-CE1 3.73Å; R379-F383 WeakPolarHBondContact O-CB 3.37Å; R379-F383 PolarHBondContact O-N 2.89Å; L380-F383 PolarHBondContact O-N 2.96Å; F383-Q385 VanDerWaalsContact C-N 3.33Å; F383-Q385 PolarHBondContact O-N 3.14Å; F383-L386 PolarHBondContact O-N 3.26Å; F383-L387 HydrophobicContact CD1-CD1 4.3Å; F383-L387 HydrophobicContact CE1-CD1 3.64Å; F383-L387 HydrophobicContact CZ-CD1 4.17Å; F383-L387 WeakPolarHBondContact O-CB 3.45Å; F383-L387 PolarHBondContact O-N 3.43Å; F383-F390 AromaticContact CD2-CE2 3.87Å; F383-F390 HydrophobicContact CD2-CE2 3.87Å; F383-F390 HydrophobicContact CD2-CZ 4.38Å; F383-F390 HydrophobicContact CE2-CD2 4.38Å; F383-F390 AromaticContact CE2-CE2 3.56Å; F383-F390 HydrophobicContact CE2-CE2 3.56Å; F383-F390 HydrophobicContact CE2-CZ 4.34Å; F383-F390 HydrophobicContact CZ-CE2 4.19Å; F383-V413 HydrophobicContact CB-CG1 3.88Å; F383-V413 HydrophobicContact CD2-CG1 3.69Å; F383-V413 HydrophobicContact CG-CG1 4.29Å; F383-Y417 HydrophobicContact CB-CD2 4.38Å; F383-Y417 HydrophobicContact CB-CE2 3.77Å; F383-Y417 HydrophobicContact CD1-CE1 4.32Å; F383-Y417 HydrophobicContact CD1-CE2 4.42Å; F383-Y417 HydrophobicContact CD2-CD1 4.16Å; F383-Y417 AromaticContact CD2-CD2 3.34Å; F383-Y417 HydrophobicContact CD2-CD2 3.34Å; F383-Y417 HydrophobicContact CD2-CE1 4.36Å; F383-Y417 AromaticContact CD2-CE2 3.58Å; F383-Y417 HydrophobicContact CD2-CE2 3.58Å; F383-Y417 AromaticContact CD2-CG 3.68Å; F383-Y417 HydrophobicContact CD2-CG 3.68Å; F383-Y417 HydrophobicContact CE1-CD1 4.44Å; F383-Y417 HydrophobicContact CE1-CE1 4.36Å; F383-Y417 AromaticContact CE2-CD1 3.87Å; F383-Y417 HydrophobicContact CE2-CD1 3.87Å; F383-Y417 AromaticContact CE2-CD2 3.72Å; F383-Y417 HydrophobicContact CE2-CD2 3.72Å; F383-Y417 HydrophobicContact CE2-CE1 4.39Å; F383-Y417 HydrophobicContact CE2-CE2 4.26Å; F383-Y417 AromaticContact CE2-CG 3.52Å; F383-Y417 HydrophobicContact CE2-CG 3.52Å; F383-Y417 AromaticContact CG-CD2 3.94Å; F383-Y417 HydrophobicContact CG-CD2 3.94Å; F383-Y417 HydrophobicContact CG-CE1 4.32Å; F383-Y417 AromaticContact CG-CE2 3.66Å; F383-Y417 HydrophobicContact CG-CE2 3.66Å; F383-Y417 HydrophobicContact CG-CG 4.41Å; F383-Y417 AromaticContact CG-CZ 3.87Å; F383-Y417 HydrophobicContact CZ-CD1 4.03Å; F383-Y417 HydrophobicContact CZ-CE1 4.39Å; F383-Y417 HydrophobicContact CZ-CG 4.15Å; F383-L421 HydrophobicContact CE2-CD1 4.35Å
384	I	78.8	Confident	78.4	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-38.2	177.3	-66.5	170.2	0	0	0	111	F345 A349 M352 L353 L380 E381 M382	F345-I384 HydrophobicContact CZ-CD1 4.42Å; A349-I384 HydrophobicContact CB-CD1 3.63Å; M352-I384 HydrophobicContact CB-CG2 3.82Å; M352-I384 HydrophobicContact CE-CG2 4.42Å; L353-I384 HydrophobicContact CD1-CD1 3.86Å; L353-I384 HydrophobicContact CD1-CG1 4.05Å; L353-I384 HydrophobicContact CD2-CG1 3.91Å; L353-I384 HydrophobicContact CD2-CG2 4.21Å; L353-I384 HydrophobicContact CG-CD1 3.98Å; L353-I384 HydrophobicContact CG-CG1 3.88Å; L353-I384 HydrophobicContact CG-CG2 4.1Å; L380-I384 HydrophobicContact CD1-CD1 3.99Å; L380-I384 HydrophobicContact CD1-CG1 4.16Å; L380-I384 HydrophobicContact CD2-CD1 4.27Å; L380-I384 HydrophobicContact CG-CD1 3.77Å; L380-I384 HydrophobicContact CG-CG1 4.33Å; L380-I384 VanDerWaalsContact O-CG1 3.22Å; L380-I384 WeakPolarHBondContact O-CG1 3.27Å; L380-I384 PolarHBondContact O-N 3.46Å; E381-I384 PolarHBondContact O-N 3.33Å; M382-I384 VanDerWaalsContact C-N 3.34Å; M382-I384 PolarHBondContact O-N 3.13Å
385	Q	81.9	Confident	79.6	Confident	71 Å²	71	47 Å²	47	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-64.7	-39.7	174.6	-74	171.1	-7.5	0	0	112.2	E381 M382 F383 P388	E381-Q385 VanDerWaalsContact O-CG 3.32Å; E381-Q385 WeakPolarHBondContact O-CG 3.45Å; E381-Q385 PolarHBondContact O-N 2.66Å; M382-Q385 PolarHBondContact O-N 2.88Å; F383-Q385 VanDerWaalsContact C-N 3.33Å; F383-Q385 PolarHBondContact O-N 3.14Å; Q385-P388 VanDerWaalsContact O-CD 3.25Å; Q385-P388 WeakPolarHBondContact O-CD 3.41Å
386	L	84.8	Confident	80.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-79.6	-18	-179.8	-67.9	174.1	0	0	0	113.9	M382 F383 Y389 F390 M399 E403 L405 V410 V413	M382-L386 WeakPolarHBondContact O-CG 3.37Å; M382-L386 PolarHBondContact O-N 2.9Å; F383-L386 PolarHBondContact O-N 3.26Å; L386-Y389 WeakPolarHBondContact O-CB 3.27Å; L386-Y389 WeakPolarHBondContact O-CD2 3.4Å; L386-Y389 PolarHBondContact O-N 3.36Å; L386-F390 HydrophobicContact CB-CE1 4.15Å; L386-F390 HydrophobicContact CB-CE2 4.27Å; L386-F390 HydrophobicContact CB-CZ 3.73Å; L386-M399 HydrophobicContact CB-CE 3.83Å; L386-M399 HydrophobicContact CD1-CE 4.18Å; L386-M399 HydrophobicContact CD2-CB 4.12Å; L386-M399 HydrophobicContact CD2-CE 3.58Å; L386-M399 HydrophobicContact CG-CE 4.05Å; L386-E403 HydrophobicContact CD2-CB 4.23Å; L386-E403 HydrophobicContact CD2-CG 3.87Å; L386-L405 HydrophobicContact CD1-CD1 3.92Å; L386-L405 HydrophobicContact CD2-CD1 3.64Å; L386-L405 HydrophobicContact CG-CD1 3.94Å; L386-V410 HydrophobicContact CD1-CG1 4.32Å; L386-V410 HydrophobicContact CD1-CG2 4.36Å; L386-V413 HydrophobicContact CD1-CB 4.32Å; L386-V413 HydrophobicContact CD1-CG1 4.17Å
387	L	82	Confident	81.4	Confident	12 Å²	12	41 Å²	41	6%	0.063	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-54.9	-38.4	-174	-159.1	142.3	0	0	0	115.2	L327 L353 C357 L359 I367 F383 Y389 F390	L327-L387 HydrophobicContact CD2-CD2 4.45Å; L353-L387 HydrophobicContact CD2-CD1 3.96Å; C357-L387 HydrophobicContact CB-CD2 3.57Å; C357-L387 VanDerWaalsContact SG-CD2 3.51Å; L359-L387 HydrophobicContact CD1-CD1 4.08Å; L359-L387 HydrophobicContact CD1-CD2 3.81Å; L359-L387 HydrophobicContact CD2-CD2 4.23Å; L359-L387 HydrophobicContact CG-CD2 4.24Å; I367-L387 HydrophobicContact CD1-CD1 3.85Å; F383-L387 HydrophobicContact CD1-CD1 4.3Å; F383-L387 HydrophobicContact CE1-CD1 3.64Å; F383-L387 HydrophobicContact CZ-CD1 4.17Å; F383-L387 WeakPolarHBondContact O-CB 3.45Å; F383-L387 PolarHBondContact O-N 3.43Å; L387-Y389 PolarHBondContact O-N 3.3Å; L387-F390 HydrophobicContact CB-CD2 4.43Å; L387-F390 HydrophobicContact CG-CD2 4.34Å; L387-F390 PolarHBondContact O-N 3.28Å
388	P	81.8	Confident	82	Confident	58 Å²	58	36.8 Å²	36.8	38%	0.377	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-61.1	-24.3	175.7	-24	35.9	0	0	0	114.3	N356 Q385	N356-P388 HydrophobicContact CB-CG 4.41Å; Q385-P388 VanDerWaalsContact O-CD 3.25Å; Q385-P388 WeakPolarHBondContact O-CD 3.41Å
389	Y	82.6	Confident	82.4	Confident	36 Å²	36	34.4 Å²	34.4	14%	0.141	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-90.5	-3.3	-178.8	-53.9	-84.9	0	0	0	113.1	L386 L387 D391 H394 M399 F402 E403	L386-Y389 WeakPolarHBondContact O-CB 3.27Å; L386-Y389 WeakPolarHBondContact O-CD2 3.4Å; L386-Y389 PolarHBondContact O-N 3.36Å; L387-Y389 PolarHBondContact O-N 3.3Å; Y389-D391 PolarHBondContact O-N 3.45Å; Y389-H394 HydrophobicContact CD1-CB 4.12Å; Y389-H394 AromaticContact CD1-CD2 3.79Å; Y389-H394 AromaticContact CD1-CG 3.82Å; Y389-M399 HydrophobicContact CD1-CG 4.44Å; Y389-M399 HydrophobicContact CG-CG 4Å; Y389-F402 HydrophobicContact CE1-CB 4.25Å; Y389-F402 HydrophobicContact CE1-CD2 4.01Å; Y389-F402 HydrophobicContact CE1-CG 4.44Å; Y389-F402 WeakPolarHBondContact OH-CB 3.29Å; Y389-E403 HydrophobicContact CE2-CG 3.71Å; Y389-E403 WeakPolarHBondContact CE2-OE1 3.38Å; Y389-E403 PolarHBondContact OH-OE1 2.93Å
390	F	83.8	Confident	83.1	Confident	10 Å²	10	32.7 Å²	32.7	4%	0.044	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	39.3	177.6	-60	-30.5	0	0	0	112.8	V325 L327 F383 L386 L387 M399 L421	V325-F390 HydrophobicContact CB-CD1 3.67Å; V325-F390 HydrophobicContact CB-CE1 4.08Å; V325-F390 HydrophobicContact CG1-CD1 3.52Å; V325-F390 HydrophobicContact CG1-CE1 3.76Å; V325-F390 HydrophobicContact CG1-CG 4.19Å; V325-F390 HydrophobicContact CG2-CD1 4.37Å; V325-F390 HydrophobicContact CG2-CE1 4.37Å; V325-F390 CarbonylContact O-C 3.57Å; V325-F390 VanDerWaalsContact O-C 3.26Å; V325-F390 VanDerWaalsContact O-CA 3.32Å; V325-F390 WeakPolarHBondContact O-CA 3.22Å; L327-F390 HydrophobicContact CB-CB 4Å; L327-F390 PolarHBondContact N-O 3.49Å; L327-F390 VanDerWaalsContact N-O 3.1Å; F383-F390 AromaticContact CD2-CE2 3.87Å; F383-F390 HydrophobicContact CD2-CE2 3.87Å; F383-F390 HydrophobicContact CD2-CZ 4.38Å; F383-F390 HydrophobicContact CE2-CD2 4.38Å; F383-F390 AromaticContact CE2-CE2 3.56Å; F383-F390 HydrophobicContact CE2-CE2 3.56Å; F383-F390 HydrophobicContact CE2-CZ 4.34Å; F383-F390 HydrophobicContact CZ-CE2 4.19Å; L386-F390 HydrophobicContact CB-CE1 4.15Å; L386-F390 HydrophobicContact CB-CE2 4.27Å; L386-F390 HydrophobicContact CB-CZ 3.73Å; L387-F390 HydrophobicContact CB-CD2 4.43Å; L387-F390 HydrophobicContact CG-CD2 4.34Å; L387-F390 PolarHBondContact O-N 3.28Å; F390-M399 HydrophobicContact CD1-CE 3.84Å; F390-M399 HydrophobicContact CE1-CE 3.33Å; F390-M399 HydrophobicContact CE1-SD 4.5Å; F390-M399 HydrophobicContact CZ-CE 4.22Å; F390-L421 HydrophobicContact CD2-CD2 3.84Å; F390-L421 HydrophobicContact CE2-CD1 4.47Å; F390-L421 HydrophobicContact CE2-CD2 4.05Å; F390-L421 HydrophobicContact CG-CD2 4.17Å; F390-L421 HydrophobicContact CZ-CD1 4.3Å; F390-L421 HydrophobicContact CZ-CD2 4.47Å
391	D	81.3	Confident	83.7	Confident	67 Å²	67	35 Å²	35	36%	0.358	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-12	179.2	59.2	3.9	0	0	0	113.3	Y389 E393 H394	Y389-D391 PolarHBondContact O-N 3.45Å; D391-E393 VanDerWaalsContact C-N 3.32Å; D391-E393 PolarHBondContact OD1-N 2.9Å; D391-H394 VanDerWaalsContact CG-ND1 3.26Å; D391-H394 IonicContact OD1-CE1 3.07Å; D391-H394 IonicContact OD1-CG 3.82Å; D391-H394 PolarHBondContact OD1-N 3.3Å; D391-H394 IonicContact OD1-ND1 2.68Å; D391-H394 PolarHBondContact OD1-ND1 3.37Å; D391-H394 IonicContact OD2-CE1 3.72Å; D391-H394 PolarHBondContact OD2-CE1 2.91Å; D391-H394 IonicContact OD2-ND1 2.71Å; D391-H394 PolarHBondContact OD2-ND1 3.46Å
392	G	80.1	Confident	84.1	Confident	4 Å²	4	34.8 Å²	34.8	4%	0.041	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84.6	-0.3	-174.7	0	0	0	0	0	115.1	F324 V325 Y326	F324-G392 VanDerWaalsContact CD1-O 3.28Å; F324-G392 WeakPolarHBondContact CD1-O 3.46Å; V325-G392 PolarHBondContact O-N 3.47Å; Y326-G392 VanDerWaalsContact CE1-CA 3.49Å; Y326-G392 PolarHBondContact OH-O 3.07Å
393	E	80.2	Confident	84.2	Confident	141 Å²	141	35.4 Å²	35.4	66%	0.659	17%	0.171	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	-24.7	176.4	-58.4	-167	160.2	0	0	111.7	F324 D391	F324-E393 WeakPolarHBondContact CE1-O 3.42Å; D391-E393 VanDerWaalsContact C-N 3.32Å; D391-E393 PolarHBondContact OD1-N 2.9Å
394	H	83.7	Confident	84.5	Confident	43 Å²	43	41.6 Å²	41.6	20%	0.199	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.1	178.5	-57.5	84.1	0	0	0	111.1	Y389 D391 E398	Y389-H394 HydrophobicContact CD1-CB 4.12Å; Y389-H394 AromaticContact CD1-CD2 3.79Å; Y389-H394 AromaticContact CD1-CG 3.82Å; D391-H394 VanDerWaalsContact CG-ND1 3.26Å; D391-H394 IonicContact OD1-CE1 3.07Å; D391-H394 IonicContact OD1-CG 3.82Å; D391-H394 PolarHBondContact OD1-N 3.3Å; D391-H394 IonicContact OD1-ND1 2.68Å; D391-H394 PolarHBondContact OD1-ND1 3.37Å; D391-H394 IonicContact OD2-CE1 3.72Å; D391-H394 PolarHBondContact OD2-CE1 2.91Å; D391-H394 IonicContact OD2-ND1 2.71Å; D391-H394 PolarHBondContact OD2-ND1 3.46Å; H394-E398 IonicContact CD2-OE1 3.41Å
395	H	87.6	Confident	84.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	162.9	174.7	55.1	-90.2	0	0	0	111.8	Y176 F244 H322 S323 F324 E397 E398 M399 D428	Y176-H395 AromaticContact CE2-NE2 3.96Å; F244-H395 AromaticContact CE1-CE1 3.8Å; F244-H395 AromaticContact CE1-NE2 3.25Å; F244-H395 VanDerWaalsContact CE1-NE2 3.25Å; F244-H395 WeakPolarHBondContact CE1-NE2 3.38Å; F244-H395 AromaticContact CZ-CE1 3.67Å; F244-H395 AromaticContact CZ-NE2 3.6Å; H322-H395 HydrophobicContact CB-CB 3.74Å; H322-H395 AromaticContact ND1-CD2 3.66Å; H322-H395 AromaticContact ND1-CG 3.95Å; S323-H395 VanDerWaalsContact O-CA 3.3Å; S323-H395 WeakPolarHBondContact O-CA 3.47Å; F324-H395 HydrophobicContact CD1-CB 4.01Å; F324-H395 HydrophobicContact CE1-CB 3.73Å; F324-H395 HydrophobicContact CE2-CB 4.29Å; F324-H395 HydrophobicContact CG-CB 4.42Å; F324-H395 HydrophobicContact CZ-CB 3.88Å; H395-E397 VanDerWaalsContact C-N 3.29Å; H395-E397 IonicContact CD2-OE2 3.65Å; H395-E397 PolarHBondContact CD2-OE2 2.88Å; H395-E397 VanDerWaalsContact CD2-OE2 3.28Å; H395-E397 IonicContact CG-OE2 3.98Å; H395-E397 PolarHBondContact O-N 3.14Å; H395-E398 PolarHBondContact CD2-N 3.3Å; H395-E398 VanDerWaalsContact CD2-N 3.32Å; H395-E398 IonicContact CE1-OE2 2.66Å; H395-E398 PolarHBondContact CE1-OE2 3.43Å; H395-E398 IonicContact ND1-OE2 3.85Å; H395-E398 PolarHBondContact NE2-N 3.21Å; H395-E398 WeakPolarHBondContact O-CB 3.27Å; H395-E398 PolarHBondContact O-N 3.1Å; H395-M399 PolarHBondContact O-N 3.4Å; H395-M399 VanDerWaalsContact O-N 3.15Å; H395-D428 IonicContact CE1-OD2 3.99Å; H395-D428 IonicContact ND1-OD2 2.89Å
396	I	88.2	Confident	85.2	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-54.2	-41.5	-177.2	-66.7	177.3	0	0	0	112.8	S323 V325 E398 M399 M400 V410 M411 I414	S323-I396 PolarHBondContact O-N 2.88Å; V325-I396 HydrophobicContact CG2-CG1 4.38Å; I396-E398 VanDerWaalsContact C-N 3.27Å; I396-E398 PolarHBondContact O-N 2.99Å; I396-M399 WeakPolarHBondContact O-CB 3.31Å; I396-M399 PolarHBondContact O-N 3.16Å; I396-M400 HydrophobicContact CG2-CG 4.24Å; I396-M400 HydrophobicContact CG2-SD 3.93Å; I396-M400 VanDerWaalsContact O-CG 3.25Å; I396-M400 WeakPolarHBondContact O-CG 3.35Å; I396-M400 PolarHBondContact O-N 3.17Å; I396-V410 HydrophobicContact CG2-CG1 4.1Å; I396-M411 HydrophobicContact CD1-SD 3.77Å; I396-I414 HydrophobicContact CD1-CD1 4.03Å; I396-I414 HydrophobicContact CG1-CD1 4.33Å
397	E	85.8	Confident	85.3	Confident	29 Å²	29	44.6 Å²	44.6	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-30.1	-179.7	-60.8	68.5	-154.4	0	0	112.9	H322 H395 F401 R407	H322-E397 IonicContact CE1-OE2 2.88Å; H322-E397 IonicContact CG-OE2 3.07Å; H322-E397 IonicContact ND1-OE2 3.83Å; H322-E397 PolarHBondContact ND1-OE2 3.18Å; H395-E397 VanDerWaalsContact C-N 3.29Å; H395-E397 IonicContact CD2-OE2 3.65Å; H395-E397 PolarHBondContact CD2-OE2 2.88Å; H395-E397 VanDerWaalsContact CD2-OE2 3.28Å; H395-E397 IonicContact CG-OE2 3.98Å; H395-E397 PolarHBondContact O-N 3.14Å; E397-F401 PolarHBondContact O-N 3.38Å; E397-F401 VanDerWaalsContact O-N 3.15Å; E397-R407 IonicContact OE1-CZ 3.52Å; E397-R407 IonicContact OE1-NH1 3.03Å; E397-R407 PolarHBondContact OE1-NH1 3.25Å; E397-R407 IonicContact OE1-NH2 3.75Å
398	E	85.6	Confident	85.7	Confident	9 Å²	9	48.2 Å²	48.2	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-71.1	-44.5	174.6	-176.8	158.6	-168.8	0	0	110.7	K174 Y176 H394 H395 I396 M400 F401 F402	K174-E398 IonicContact NZ-OE1 3.71Å; K174-E398 PolarHBondContact NZ-OE1 3.44Å; K174-E398 IonicContact NZ-OE2 3.38Å; K174-E398 PolarHBondContact NZ-OE2 2.56Å; Y176-E398 HydrophobicContact CE1-CB 4.48Å; Y176-E398 HydrophobicContact CE1-CG 4.19Å; Y176-E398 WeakPolarHBondContact OH-CG 3.44Å; Y176-E398 PolarHBondContact OH-OE2 2.98Å; Y176-E398 VanDerWaalsContact OH-OE2 3.06Å; H394-E398 IonicContact CD2-OE1 3.41Å; H395-E398 PolarHBondContact CD2-N 3.3Å; H395-E398 VanDerWaalsContact CD2-N 3.32Å; H395-E398 IonicContact CE1-OE2 2.66Å; H395-E398 PolarHBondContact CE1-OE2 3.43Å; H395-E398 IonicContact ND1-OE2 3.85Å; H395-E398 PolarHBondContact NE2-N 3.21Å; H395-E398 WeakPolarHBondContact O-CB 3.27Å; H395-E398 PolarHBondContact O-N 3.1Å; I396-E398 VanDerWaalsContact C-N 3.27Å; I396-E398 PolarHBondContact O-N 2.99Å; E398-M400 PolarHBondContact O-N 3.03Å; E398-F401 PolarHBondContact O-N 3.21Å; E398-F401 VanDerWaalsContact O-N 3.14Å; E398-F402 HydrophobicContact CG-CD2 3.6Å; E398-F402 HydrophobicContact CG-CE2 3.37Å; E398-F402 VanDerWaalsContact O-CD2 3.27Å; E398-F402 WeakPolarHBondContact O-CD2 3.12Å; E398-F402 PolarHBondContact O-N 3.12Å; E398-F402 WeakPolarHBondContact OE1-CE2 3.42Å
399	M	88.4	Confident	86	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-45.8	174.3	-61.5	169.5	71.2	0	0	111.9	V325 L386 Y389 F390 H395 I396 F401 F402 E403 V410	V325-M399 HydrophobicContact CG2-SD 4.37Å; L386-M399 HydrophobicContact CB-CE 3.83Å; L386-M399 HydrophobicContact CD1-CE 4.18Å; L386-M399 HydrophobicContact CD2-CB 4.12Å; L386-M399 HydrophobicContact CD2-CE 3.58Å; L386-M399 HydrophobicContact CG-CE 4.05Å; Y389-M399 HydrophobicContact CD1-CG 4.44Å; Y389-M399 HydrophobicContact CG-CG 4Å; F390-M399 HydrophobicContact CD1-CE 3.84Å; F390-M399 HydrophobicContact CE1-CE 3.33Å; F390-M399 HydrophobicContact CE1-SD 4.5Å; F390-M399 HydrophobicContact CZ-CE 4.22Å; H395-M399 PolarHBondContact O-N 3.4Å; H395-M399 VanDerWaalsContact O-N 3.15Å; I396-M399 WeakPolarHBondContact O-CB 3.31Å; I396-M399 PolarHBondContact O-N 3.16Å; M399-F401 PolarHBondContact O-N 3.28Å; M399-F402 PolarHBondContact O-N 3.06Å; M399-E403 PolarHBondContact O-N 3.19Å; M399-V410 HydrophobicContact CE-CG1 4.31Å
400	M	89.4	Confident	86.3	Confident	50 Å²	50	47.3 Å²	47.3	25%	0.246	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-39.1	175.7	-73.9	171.5	55.1	0	0	111.8	I396 E398 T404 L405 R407 V410	I396-M400 HydrophobicContact CG2-CG 4.24Å; I396-M400 HydrophobicContact CG2-SD 3.93Å; I396-M400 VanDerWaalsContact O-CG 3.25Å; I396-M400 WeakPolarHBondContact O-CG 3.35Å; I396-M400 PolarHBondContact O-N 3.17Å; E398-M400 PolarHBondContact O-N 3.03Å; M400-T404 CarbonylContact O-C 3.55Å; M400-T404 VanDerWaalsContact O-CA 3.26Å; M400-T404 WeakPolarHBondContact O-CA 3.39Å; M400-T404 PolarHBondContact O-N 3.43Å; M400-T404 VanDerWaalsContact O-N 3.12Å; M400-L405 WeakPolarHBondContact CB-O 3.46Å; M400-L405 PolarHBondContact O-N 3.04Å; M400-L405 VanDerWaalsContact O-N 3.13Å; M400-R407 HydrophobicContact CE-CB 3.82Å; M400-R407 HydrophobicContact SD-CB 3.63Å; M400-R407 HydrophobicContact SD-CG 3.97Å; M400-V410 HydrophobicContact CG-CG2 3.97Å
401	F	87	Confident	86.5	Confident	61 Å²	61	50 Å²	50	27%	0.268	26%	0.255	S	S	.	.	H	α-helix	trans	-71.8	-47.5	-178.6	-178.9	-94.7	0	0	0	112.5	P175 Y176 L214 E397 E398 M399	P175-F401 HydrophobicContact CB-CE1 4.34Å; P175-F401 HydrophobicContact CB-CE2 4.22Å; P175-F401 HydrophobicContact CB-CZ 3.66Å; P175-F401 HydrophobicContact CG-CD1 4.43Å; P175-F401 HydrophobicContact CG-CE1 3.43Å; P175-F401 VanDerWaalsContact CG-CE1 3.43Å; P175-F401 HydrophobicContact CG-CE2 4.14Å; P175-F401 HydrophobicContact CG-CZ 3.25Å; Y176-F401 HydrophobicContact CD1-CB 3.87Å; Y176-F401 AromaticContact CD1-CD1 3.64Å; Y176-F401 HydrophobicContact CD1-CD1 3.64Å; Y176-F401 HydrophobicContact CD1-CD2 4.18Å; Y176-F401 HydrophobicContact CD1-CE1 4.26Å; Y176-F401 AromaticContact CD1-CG 3.6Å; Y176-F401 HydrophobicContact CD1-CG 3.6Å; Y176-F401 HydrophobicContact CE1-CD1 4.34Å; Y176-F401 HydrophobicContact CG-CB 4.31Å; Y176-F401 HydrophobicContact CG-CD2 4.4Å; Y176-F401 HydrophobicContact CG-CG 4.17Å; L214-F401 HydrophobicContact CD2-CE2 3.66Å; L214-F401 HydrophobicContact CD2-CZ 3.99Å; E397-F401 PolarHBondContact O-N 3.38Å; E397-F401 VanDerWaalsContact O-N 3.15Å; E398-F401 PolarHBondContact O-N 3.21Å; E398-F401 VanDerWaalsContact O-N 3.14Å; M399-F401 PolarHBondContact O-N 3.28Å
402	F	86.8	Confident	86.8	Confident	99 Å²	99	51.4 Å²	51.4	43%	0.434	26%	0.259	S	S	.	.	H	α-helix	trans	-72.8	-41.9	-175.8	-73.9	-60.4	0	0	0	113.1	Y389 E398 M399 T404	Y389-F402 HydrophobicContact CE1-CB 4.25Å; Y389-F402 HydrophobicContact CE1-CD2 4.01Å; Y389-F402 HydrophobicContact CE1-CG 4.44Å; Y389-F402 WeakPolarHBondContact OH-CB 3.29Å; E398-F402 HydrophobicContact CG-CD2 3.6Å; E398-F402 HydrophobicContact CG-CE2 3.37Å; E398-F402 VanDerWaalsContact O-CD2 3.27Å; E398-F402 WeakPolarHBondContact O-CD2 3.12Å; E398-F402 PolarHBondContact O-N 3.12Å; E398-F402 WeakPolarHBondContact OE1-CE2 3.42Å; M399-F402 PolarHBondContact O-N 3.06Å; F402-T404 VanDerWaalsContact C-N 3.3Å
403	E	86.3	Confident	87	Confident	50 Å²	50	51.2 Å²	51.2	23%	0.234	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	0.7	179.6	-60.4	-55.6	139.9	0	0	112.5	L386 Y389 M399 L405	L386-E403 HydrophobicContact CD2-CB 4.23Å; L386-E403 HydrophobicContact CD2-CG 3.87Å; Y389-E403 HydrophobicContact CE2-CG 3.71Å; Y389-E403 WeakPolarHBondContact CE2-OE1 3.38Å; Y389-E403 PolarHBondContact OH-OE1 2.93Å; M399-E403 PolarHBondContact O-N 3.19Å; E403-L405 HydrophobicContact CB-CD1 3.79Å; E403-L405 HydrophobicContact CB-CG 3.77Å; E403-L405 PolarHBondContact O-N 2.64Å
404	T	88.5	Confident	87.3	Confident	130 Å²	130	44.6 Å²	44.6	80%	0.798	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	32.1	-177.6	59.6	0	0	0	0	114.1	M400 F402	M400-T404 CarbonylContact O-C 3.55Å; M400-T404 VanDerWaalsContact O-CA 3.26Å; M400-T404 WeakPolarHBondContact O-CA 3.39Å; M400-T404 PolarHBondContact O-N 3.43Å; M400-T404 VanDerWaalsContact O-N 3.12Å; F402-T404 VanDerWaalsContact C-N 3.3Å
405	L	87.8	Confident	87.4	Confident	24 Å²	24	46.3 Å²	46.3	13%	0.126	24%	0.243	C	C	.	.			trans	-92.2	149.6	-178.4	-62	175.6	0	0	0	111.7	M382 L386 M400 E403 V410	M382-L405 HydrophobicContact SD-CD2 4.32Å; L386-L405 HydrophobicContact CD1-CD1 3.92Å; L386-L405 HydrophobicContact CD2-CD1 3.64Å; L386-L405 HydrophobicContact CG-CD1 3.94Å; M400-L405 WeakPolarHBondContact CB-O 3.46Å; M400-L405 PolarHBondContact O-N 3.04Å; M400-L405 VanDerWaalsContact O-N 3.13Å; E403-L405 HydrophobicContact CB-CD1 3.79Å; E403-L405 HydrophobicContact CB-CG 3.77Å; E403-L405 PolarHBondContact O-N 2.64Å; L405-V410 HydrophobicContact CB-CG2 3.73Å; L405-V410 HydrophobicContact CD1-CG2 4Å
406	S	88.1	Confident	87.2	Confident	50 Å²	50	49.1 Å²	49.1	35%	0.35	26%	0.258	S	S	.	.			trans	-75	153.1	169.3	71.7	0	0	0	0	111.2	T408 E409 V410	S406-T408 PolarHBondContact O-N 3.03Å; S406-E409 WeakPolarHBondContact CA-OE2 3.32Å; S406-E409 VanDerWaalsContact CB-OE2 3.24Å; S406-E409 WeakPolarHBondContact CB-OE2 3.3Å; S406-E409 PolarHBondContact N-OE2 2.86Å; S406-E409 PolarHBondContact O-N 2.89Å; S406-E409 VanDerWaalsContact O-N 3.1Å; S406-E409 VanDerWaalsContact OG-CG 3.26Å; S406-E409 WeakPolarHBondContact OG-CG 3.37Å; S406-E409 PolarHBondContact OG-N 3.34Å; S406-E409 PolarHBondContact OG-OE2 3.49Å; S406-V410 PolarHBondContact O-N 3.42Å; S406-V410 VanDerWaalsContact O-N 3.11Å
407	R	87.2	Confident	86.8	Confident	62 Å²	62	49.2 Å²	49.2	23%	0.234	26%	0.258	C	S	.	.	H	α-helix	trans	-55.6	-36.8	176	-168	179.9	-173	88.4	-2.9	111.7	E397 M400 M411	E397-R407 IonicContact OE1-CZ 3.52Å; E397-R407 IonicContact OE1-NH1 3.03Å; E397-R407 PolarHBondContact OE1-NH1 3.25Å; E397-R407 IonicContact OE1-NH2 3.75Å; M400-R407 HydrophobicContact CE-CB 3.82Å; M400-R407 HydrophobicContact SD-CB 3.63Å; M400-R407 HydrophobicContact SD-CG 3.97Å; R407-M411 HydrophobicContact CG-CG 4.14Å; R407-M411 VanDerWaalsContact O-CB 3.28Å; R407-M411 WeakPolarHBondContact O-CB 3.43Å; R407-M411 WeakPolarHBondContact O-CG 3.31Å; R407-M411 PolarHBondContact O-N 2.86Å
408	T	89	Confident	86.6	Confident	89 Å²	89	52.7 Å²	52.7	55%	0.546	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-43.2	179.4	-51.6	0	0	0	0	111.4	S406 Q412	S406-T408 PolarHBondContact O-N 3.03Å; T408-Q412 HydrophobicContact CG2-CG 4.43Å; T408-Q412 VanDerWaalsContact O-CB 3.28Å; T408-Q412 WeakPolarHBondContact O-CB 3.31Å; T408-Q412 WeakPolarHBondContact O-CG 3.29Å; T408-Q412 PolarHBondContact O-N 3.32Å
409	E	89.4	Confident	86.3	Confident	74 Å²	74	60 Å²	60	35%	0.346	32%	0.317	S	S	.	.	H	α-helix	trans	-64.8	-46.8	177.6	-71.5	157.1	152.6	0	0	111.2	M382 S406 M411 Q412 V413	M382-E409 HydrophobicContact SD-CB 4.46Å; S406-E409 WeakPolarHBondContact CA-OE2 3.32Å; S406-E409 VanDerWaalsContact CB-OE2 3.24Å; S406-E409 WeakPolarHBondContact CB-OE2 3.3Å; S406-E409 PolarHBondContact N-OE2 2.86Å; S406-E409 PolarHBondContact O-N 2.89Å; S406-E409 VanDerWaalsContact O-N 3.1Å; S406-E409 VanDerWaalsContact OG-CG 3.26Å; S406-E409 WeakPolarHBondContact OG-CG 3.37Å; S406-E409 PolarHBondContact OG-N 3.34Å; S406-E409 PolarHBondContact OG-OE2 3.49Å; E409-M411 PolarHBondContact O-N 3.24Å; E409-Q412 PolarHBondContact O-N 3.22Å; E409-V413 WeakPolarHBondContact O-CG2 3.36Å; E409-V413 PolarHBondContact O-N 3.45Å
410	V	88.6	Confident	85.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-45.7	177.7	179.7	0	0	0	0	111	L386 I396 M399 M400 L405 S406 Q412 V413 I414	L386-V410 HydrophobicContact CD1-CG1 4.32Å; L386-V410 HydrophobicContact CD1-CG2 4.36Å; I396-V410 HydrophobicContact CG2-CG1 4.1Å; M399-V410 HydrophobicContact CE-CG1 4.31Å; M400-V410 HydrophobicContact CG-CG2 3.97Å; L405-V410 HydrophobicContact CB-CG2 3.73Å; L405-V410 HydrophobicContact CD1-CG2 4Å; S406-V410 PolarHBondContact O-N 3.42Å; S406-V410 VanDerWaalsContact O-N 3.11Å; V410-Q412 VanDerWaalsContact C-N 3.34Å; V410-Q412 PolarHBondContact O-N 2.79Å; V410-V413 PolarHBondContact O-N 3.29Å; V410-I414 HydrophobicContact CG1-CD1 3.86Å; V410-I414 VanDerWaalsContact O-CG1 3.29Å; V410-I414 WeakPolarHBondContact O-CG1 3.5Å; V410-I414 PolarHBondContact O-N 3.19Å
411	M	87.6	Confident	85.6	Confident	67 Å²	67	59.1 Å²	59.1	33%	0.33	31%	0.313	S	S	.	.	H	α-helix	trans	-67.1	-33.1	178.1	-71.1	-62.3	-58.5	0	0	113	I396 R407 E409 I414 S415	I396-M411 HydrophobicContact CD1-SD 3.77Å; R407-M411 HydrophobicContact CG-CG 4.14Å; R407-M411 VanDerWaalsContact O-CB 3.28Å; R407-M411 WeakPolarHBondContact O-CB 3.43Å; R407-M411 WeakPolarHBondContact O-CG 3.31Å; R407-M411 PolarHBondContact O-N 2.86Å; E409-M411 PolarHBondContact O-N 3.24Å; M411-I414 PolarHBondContact O-N 2.86Å; M411-I414 HydrophobicContact SD-CD1 4.28Å; M411-S415 WeakPolarHBondContact O-CB 3.49Å; M411-S415 PolarHBondContact O-N 2.65Å; M411-S415 PolarHBondContact O-OG 2.76Å
412	Q	86.9	Confident	85.5	Confident	96 Å²	96	59.8 Å²	59.8	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-45	173.4	-80.6	172.7	-1.5	0	0	111	T408 E409 V410 I414 S415 D416	T408-Q412 HydrophobicContact CG2-CG 4.43Å; T408-Q412 VanDerWaalsContact O-CB 3.28Å; T408-Q412 WeakPolarHBondContact O-CB 3.31Å; T408-Q412 WeakPolarHBondContact O-CG 3.29Å; T408-Q412 PolarHBondContact O-N 3.32Å; E409-Q412 PolarHBondContact O-N 3.22Å; V410-Q412 VanDerWaalsContact C-N 3.34Å; V410-Q412 PolarHBondContact O-N 2.79Å; Q412-I414 VanDerWaalsContact C-N 3.35Å; Q412-I414 PolarHBondContact O-N 3.34Å; Q412-S415 PolarHBondContact O-N 3.47Å; Q412-D416 WeakPolarHBondContact O-CB 3.38Å; Q412-D416 PolarHBondContact O-N 3.08Å
413	V	85.5	Confident	85.6	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-46.2	174.4	173.9	0	0	0	0	110.3	M382 F383 L386 E409 V410 S415 D416 Y417	M382-V413 HydrophobicContact CB-CG2 4.02Å; M382-V413 HydrophobicContact CE-CG2 4.33Å; F383-V413 HydrophobicContact CB-CG1 3.88Å; F383-V413 HydrophobicContact CD2-CG1 3.69Å; F383-V413 HydrophobicContact CG-CG1 4.29Å; L386-V413 HydrophobicContact CD1-CB 4.32Å; L386-V413 HydrophobicContact CD1-CG1 4.17Å; E409-V413 WeakPolarHBondContact O-CG2 3.36Å; E409-V413 PolarHBondContact O-N 3.45Å; V410-V413 PolarHBondContact O-N 3.29Å; V413-S415 VanDerWaalsContact C-N 3.3Å; V413-S415 PolarHBondContact O-N 3.2Å; V413-D416 PolarHBondContact O-N 3.27Å; V413-Y417 HydrophobicContact CG1-CD2 4.25Å; V413-Y417 VanDerWaalsContact O-CD2 3.31Å; V413-Y417 WeakPolarHBondContact O-CD2 3.26Å; V413-Y417 PolarHBondContact O-N 3.21Å
414	I	86.6	Confident	85.6	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-42.3	177.7	-67.6	164.7	0	0	0	111.3	V325 I396 V410 M411 Q412 Y417 D418 L421 L423	V325-I414 HydrophobicContact CG2-CD1 3.8Å; V325-I414 HydrophobicContact CG2-CG1 4.39Å; I396-I414 HydrophobicContact CD1-CD1 4.03Å; I396-I414 HydrophobicContact CG1-CD1 4.33Å; V410-I414 HydrophobicContact CG1-CD1 3.86Å; V410-I414 VanDerWaalsContact O-CG1 3.29Å; V410-I414 WeakPolarHBondContact O-CG1 3.5Å; V410-I414 PolarHBondContact O-N 3.19Å; M411-I414 PolarHBondContact O-N 2.86Å; M411-I414 HydrophobicContact SD-CD1 4.28Å; Q412-I414 VanDerWaalsContact C-N 3.35Å; Q412-I414 PolarHBondContact O-N 3.34Å; I414-Y417 CarbonylContact O-C 3.43Å; I414-Y417 PolarHBondContact O-N 3.29Å; I414-D418 PolarHBondContact O-N 3.1Å; I414-L421 HydrophobicContact CB-CD1 4.39Å; I414-L421 HydrophobicContact CG1-CD1 4.34Å; I414-L421 HydrophobicContact CG2-CD1 4.36Å; I414-L423 HydrophobicContact CD1-CD2 4.38Å; I414-L423 HydrophobicContact CG2-CD1 3.93Å; I414-L423 HydrophobicContact CG2-CD2 4.01Å; I414-L423 HydrophobicContact CG2-CG 4.19Å
415	S	85.4	Confident	85.5	Confident	78 Å²	78	55.3 Å²	55.3	55%	0.545	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-35.4	-179.8	-55.6	0	0	0	0	112.7	M411 Q412 V413 Y417	M411-S415 WeakPolarHBondContact O-CB 3.49Å; M411-S415 PolarHBondContact O-N 2.65Å; M411-S415 PolarHBondContact O-OG 2.76Å; Q412-S415 PolarHBondContact O-N 3.47Å; V413-S415 VanDerWaalsContact C-N 3.3Å; V413-S415 PolarHBondContact O-N 3.2Å; S415-Y417 VanDerWaalsContact C-N 3.25Å; S415-Y417 PolarHBondContact O-N 3.48Å
416	D	83.3	Confident	85.3	Confident	59 Å²	59	56.7 Å²	56.7	32%	0.316	31%	0.31	S	S	.	.	H	α-helix	trans	-69.3	-25.1	178.3	-79.2	3.9	0	0	0	112	S374 R379 Q412 V413	S374-D416 PolarHBondContact OG-OD2 3.12Å; S374-D416 VanDerWaalsContact OG-OD2 3.1Å; R379-D416 WeakPolarHBondContact CD-OD2 3.32Å; R379-D416 IonicContact CZ-OD2 3.79Å; R379-D416 IonicContact NE-OD2 3.6Å; R379-D416 IonicContact NH1-OD1 3.05Å; R379-D416 IonicContact NH1-OD2 2.9Å; R379-D416 PolarHBondContact NH1-OD2 2.92Å; Q412-D416 WeakPolarHBondContact O-CB 3.38Å; Q412-D416 PolarHBondContact O-N 3.08Å; V413-D416 PolarHBondContact O-N 3.27Å
417	Y	80	Confident	84.9	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.012	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	25.3	-178.2	-64.6	-89	0	0	0	112.9	A370 F383 V413 I414 S415 D419 M420 L421	A370-Y417 HydrophobicContact CB-CD1 3.67Å; A370-Y417 HydrophobicContact CB-CE1 3.76Å; F383-Y417 HydrophobicContact CB-CD2 4.38Å; F383-Y417 HydrophobicContact CB-CE2 3.77Å; F383-Y417 HydrophobicContact CD1-CE1 4.32Å; F383-Y417 HydrophobicContact CD1-CE2 4.42Å; F383-Y417 HydrophobicContact CD2-CD1 4.16Å; F383-Y417 AromaticContact CD2-CD2 3.34Å; F383-Y417 HydrophobicContact CD2-CD2 3.34Å; F383-Y417 HydrophobicContact CD2-CE1 4.36Å; F383-Y417 AromaticContact CD2-CE2 3.58Å; F383-Y417 HydrophobicContact CD2-CE2 3.58Å; F383-Y417 AromaticContact CD2-CG 3.68Å; F383-Y417 HydrophobicContact CD2-CG 3.68Å; F383-Y417 HydrophobicContact CE1-CD1 4.44Å; F383-Y417 HydrophobicContact CE1-CE1 4.36Å; F383-Y417 AromaticContact CE2-CD1 3.87Å; F383-Y417 HydrophobicContact CE2-CD1 3.87Å; F383-Y417 AromaticContact CE2-CD2 3.72Å; F383-Y417 HydrophobicContact CE2-CD2 3.72Å; F383-Y417 HydrophobicContact CE2-CE1 4.39Å; F383-Y417 HydrophobicContact CE2-CE2 4.26Å; F383-Y417 AromaticContact CE2-CG 3.52Å; F383-Y417 HydrophobicContact CE2-CG 3.52Å; F383-Y417 AromaticContact CG-CD2 3.94Å; F383-Y417 HydrophobicContact CG-CD2 3.94Å; F383-Y417 HydrophobicContact CG-CE1 4.32Å; F383-Y417 AromaticContact CG-CE2 3.66Å; F383-Y417 HydrophobicContact CG-CE2 3.66Å; F383-Y417 HydrophobicContact CG-CG 4.41Å; F383-Y417 AromaticContact CG-CZ 3.87Å; F383-Y417 HydrophobicContact CZ-CD1 4.03Å; F383-Y417 HydrophobicContact CZ-CE1 4.39Å; F383-Y417 HydrophobicContact CZ-CG 4.15Å; V413-Y417 HydrophobicContact CG1-CD2 4.25Å; V413-Y417 VanDerWaalsContact O-CD2 3.31Å; V413-Y417 WeakPolarHBondContact O-CD2 3.26Å; V413-Y417 PolarHBondContact O-N 3.21Å; I414-Y417 CarbonylContact O-C 3.43Å; I414-Y417 PolarHBondContact O-N 3.29Å; S415-Y417 VanDerWaalsContact C-N 3.25Å; S415-Y417 PolarHBondContact O-N 3.48Å; Y417-D419 PolarHBondContact O-N 3.19Å; Y417-D419 VanDerWaalsContact O-N 3.14Å; Y417-M420 PolarHBondContact O-N 2.82Å; Y417-L421 WeakPolarHBondContact O-CG 3.44Å; Y417-L421 PolarHBondContact O-N 3.26Å
418	D	81.9	Confident	84.2	Confident	102 Å²	102	52.8 Å²	52.8	55%	0.545	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-54.7	-33.9	-177.2	-166.7	53.7	0	0	0	112.6	I414 M420 L421	I414-D418 PolarHBondContact O-N 3.1Å; D418-M420 PolarHBondContact O-N 2.98Å; D418-M420 VanDerWaalsContact O-N 3.12Å; D418-L421 PolarHBondContact O-N 2.93Å; D418-L421 VanDerWaalsContact O-O 3.11Å
419	D	79	Confident	83.1	Confident	162 Å²	162	51.2 Å²	51.2	87%	0.866	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-62	-20.1	176.4	-70.7	-21.7	0	0	0	113.9	Y417	Y417-D419 PolarHBondContact O-N 3.19Å; Y417-D419 VanDerWaalsContact O-N 3.14Å
420	M	78.5	Confident	81.7	Confident	25 Å²	25	52 Å²	52	12%	0.123	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-114.9	-8	-176	-61.4	-172.2	176.2	0	0	113.4	C328 D366 I367 A370 Y417 D418	C328-M420 CarbonylContact C-O 3.42Å; C328-M420 WeakPolarHBondContact CA-O 3.27Å; C328-M420 PolarHBondContact N-O 2.93Å; D366-M420 VanDerWaalsContact C-CE 3.49Å; D366-M420 HydrophobicContact CB-CE 3.97Å; D366-M420 WeakPolarHBondContact O-CE 3.17Å; I367-M420 HydrophobicContact CG1-SD 4.46Å; A370-M420 HydrophobicContact CB-CE 3.29Å; A370-M420 HydrophobicContact CB-SD 3.51Å; A370-M420 VanDerWaalsContact CB-SD 3.51Å; Y417-M420 PolarHBondContact O-N 2.82Å; D418-M420 PolarHBondContact O-N 2.98Å; D418-M420 VanDerWaalsContact O-N 3.12Å
421	L	83.9	Confident	80.3	Confident	8 Å²	8	53 Å²	53	4%	0.042	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.4	-172.3	-61.5	176.4	0	0	0	109.8	V325 Y326 L327 F383 F390 I414 Y417 D418	V325-L421 HydrophobicContact CG1-CB 4.08Å; V325-L421 HydrophobicContact CG1-CD1 4.21Å; V325-L421 HydrophobicContact CG1-CD2 3.94Å; V325-L421 HydrophobicContact CG1-CG 4.3Å; Y326-L421 CarbonylContact O-C 3.41Å; Y326-L421 WeakPolarHBondContact O-CA 3.33Å; L327-L421 HydrophobicContact CD1-CD2 3.86Å; F383-L421 HydrophobicContact CE2-CD1 4.35Å; F390-L421 HydrophobicContact CD2-CD2 3.84Å; F390-L421 HydrophobicContact CE2-CD1 4.47Å; F390-L421 HydrophobicContact CE2-CD2 4.05Å; F390-L421 HydrophobicContact CG-CD2 4.17Å; F390-L421 HydrophobicContact CZ-CD1 4.3Å; F390-L421 HydrophobicContact CZ-CD2 4.47Å; I414-L421 HydrophobicContact CB-CD1 4.39Å; I414-L421 HydrophobicContact CG1-CD1 4.34Å; I414-L421 HydrophobicContact CG2-CD1 4.36Å; Y417-L421 WeakPolarHBondContact O-CG 3.44Å; Y417-L421 PolarHBondContact O-N 3.26Å; D418-L421 PolarHBondContact O-N 2.93Å; D418-L421 VanDerWaalsContact O-O 3.11Å
422	V	85.9	Confident	78.4	Confident	75 Å²	75	53.2 Å²	53.2	46%	0.455	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.8	172.3	174.7	0	0	0	0	108.6	Y326 C328	Y326-V422 PolarHBondContact N-O 2.9Å; Y326-V422 PolarHBondContact O-N 3.12Å; C328-V422 HydrophobicContact CB-CG2 3.97Å; C328-V422 WeakPolarHBondContact SG-CG2 3.46Å
423	L	87.4	Confident	76.4	Confident	74 Å²	74	55.2 Å²	55.2	39%	0.387	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	121.6	175.2	-67.9	169.6	0	0	0	110.2	F324 V325 I414	F324-L423 WeakPolarHBondContact O-CA 3.25Å; V325-L423 HydrophobicContact CB-CD2 4.41Å; V325-L423 HydrophobicContact CG1-CD2 4.42Å; V325-L423 HydrophobicContact CG2-CD2 3.74Å; I414-L423 HydrophobicContact CD1-CD2 4.38Å; I414-L423 HydrophobicContact CG2-CD1 3.93Å; I414-L423 HydrophobicContact CG2-CD2 4.01Å; I414-L423 HydrophobicContact CG2-CG 4.19Å
424	S	86.7	Confident	74.5	Confident	29 Å²	29	59.2 Å²	59.2	20%	0.203	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	153.2	166.7	83.1	0	0	0	0	109.8	S323 F324 Y326 H426	S323-S424 CarbonylContact C-O 3.46Å; S323-S424 WeakPolarHBondContact CA-O 3.39Å; F324-S424 PolarHBondContact N-O 3.18Å; F324-S424 PolarHBondContact O-N 3.36Å; Y326-S424 WeakPolarHBondContact CE2-OG 3.18Å; S424-H426 PolarHBondContact OG-CD2 3.11Å; S424-H426 VanDerWaalsContact OG-CD2 3.23Å; S424-H426 PolarHBondContact OG-NE2 3.1Å
425	V	87.1	Confident	72.3	Confident	81 Å²	81	62.4 Å²	62.4	49%	0.491	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	115.6	175.4	-179.9	0	0	0	0	108.2	L321 H322	L321-V425 HydrophobicContact CB-CG1 3.68Å; L321-V425 HydrophobicContact CD1-CG1 4.11Å; L321-V425 HydrophobicContact CG-CG1 4.46Å; H322-V425 VanDerWaalsContact O-CA 3.29Å; H322-V425 WeakPolarHBondContact O-CA 3.5Å
426	H	84.3	Confident	69.8	Low	54 Å²	54	62.6 Å²	62.6	25%	0.25	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	173.6	176.8	53.3	83.8	0	0	0	110.7	H322 F324 S424	H322-H426 PolarHBondContact N-O 2.87Å; H322-H426 PolarHBondContact O-N 3.27Å; H322-H426 VanDerWaalsContact O-N 3.11Å; F324-H426 AromaticContact CD1-CE1 3.97Å; F324-H426 AromaticContact CD2-CD2 3.73Å; F324-H426 AromaticContact CD2-CE1 3.16Å; F324-H426 WeakPolarHBondContact CD2-CE1 3.5Å; F324-H426 AromaticContact CD2-CG 3.92Å; F324-H426 AromaticContact CD2-ND1 3.6Å; F324-H426 AromaticContact CD2-NE2 3.25Å; F324-H426 WeakPolarHBondContact CD2-NE2 3.38Å; F324-H426 AromaticContact CE1-CE1 3.91Å; F324-H426 AromaticContact CE2-CE1 3.1Å; F324-H426 WeakPolarHBondContact CE2-CE1 3.45Å; F324-H426 AromaticContact CE2-CG 3.87Å; F324-H426 AromaticContact CE2-ND1 3.21Å; F324-H426 WeakPolarHBondContact CE2-ND1 3.24Å; F324-H426 AromaticContact CE2-NE2 3.71Å; F324-H426 AromaticContact CG-CE1 3.62Å; F324-H426 AromaticContact CG-NE2 3.58Å; F324-H426 AromaticContact CZ-CE1 3.5Å; F324-H426 AromaticContact CZ-ND1 3.8Å; S424-H426 PolarHBondContact OG-CD2 3.11Å; S424-H426 VanDerWaalsContact OG-CD2 3.23Å; S424-H426 PolarHBondContact OG-NE2 3.1Å
427	E	78.9	Confident	67.4	Low	28 Å²	28	68.4 Å²	68.4	13%	0.131	34%	0.339	C	S	.	.			trans	-66.8	152.4	172	-169.9	176	-176.9	0	0	109.6	M319 P429 E432	M319-E427 HydrophobicContact CE-CB 3.62Å; M319-E427 HydrophobicContact CE-CG 3.97Å; M319-E427 WeakPolarHBondContact CE-OE2 3.29Å; E427-P429 VanDerWaalsContact O-CD 3.3Å; E427-P429 WeakPolarHBondContact O-CD 3.15Å; E427-E432 HydrophobicContact CB-CG 3.71Å; E427-E432 HydrophobicContact CG-CG 3.7Å; E427-E432 WeakPolarHBondContact OE2-CG 3.26Å
428	D	73.4	Confident	65.2	Low	1 Å²	1	71 Å²	71	1%	0.005	37%	0.367	C	S	.	.			trans	-66.5	119.4	170.9	-176.4	-9.8	0	0	0	109.5	F244 H395 F430 L431 E432	F244-D428 HydrophobicContact CE2-CB 4.41Å; F244-D428 WeakPolarHBondContact CZ-OD2 3.28Å; H395-D428 IonicContact CE1-OD2 3.99Å; H395-D428 IonicContact ND1-OD2 2.89Å; D428-F430 PolarHBondContact O-N 2.9Å; D428-F430 WeakPolarHBondContact OD1-CB 3.48Å; D428-F430 WeakPolarHBondContact OD1-CD2 3.18Å; D428-F430 PolarHBondContact OD1-N 2.93Å; D428-L431 WeakPolarHBondContact O-CA 3.15Å; D428-L431 PolarHBondContact O-N 3.28Å; D428-E432 PolarHBondContact O-N 3.02Å
429	P	64.1	Low	62.7	Low	56 Å²	56	72.8 Å²	72.8	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-53.9	-27.6	177.1	-24.2	33.4	0	0	0	113.3	E427 L431 E432 R433	E427-P429 VanDerWaalsContact O-CD 3.3Å; E427-P429 WeakPolarHBondContact O-CD 3.15Å; P429-L431 VanDerWaalsContact C-N 3.3Å; P429-L431 PolarHBondContact O-N 3.27Å; P429-E432 PolarHBondContact O-N 3.18Å; P429-R433 PolarHBondContact O-N 2.71Å
430	F	61.7	Low	60.3	Low	91 Å²	91	76.5 Å²	76.5	40%	0.399	39%	0.386	S	S	.	.	H	α-helix	trans	-68.1	-29.9	176.6	-67.4	-69.4	0	0	0	112.7	D428	D428-F430 PolarHBondContact O-N 2.9Å; D428-F430 WeakPolarHBondContact OD1-CB 3.48Å; D428-F430 WeakPolarHBondContact OD1-CD2 3.18Å; D428-F430 PolarHBondContact OD1-N 2.93Å
431	L	57.7	Low	59.3	Low	21 Å²	21	79.1 Å²	79.1	11%	0.11	40%	0.399	C	S	.	.	H	α-helix	trans	-87.6	-34.2	171.7	-68.3	179	0	0	0	111.9	F244 D428 P429 R433 R434	F244-L431 HydrophobicContact CD2-CD1 3.9Å; F244-L431 HydrophobicContact CE2-CD1 3.58Å; F244-L431 HydrophobicContact CE2-CG 4.38Å; D428-L431 WeakPolarHBondContact O-CA 3.15Å; D428-L431 PolarHBondContact O-N 3.28Å; P429-L431 VanDerWaalsContact C-N 3.3Å; P429-L431 PolarHBondContact O-N 3.27Å; L431-R433 PolarHBondContact O-N 3.33Å; L431-R434 WeakPolarHBondContact O-CB 3.28Å; L431-R434 WeakPolarHBondContact O-CG 3.37Å; L431-R434 PolarHBondContact O-N 3.48Å
432	E	48.6	Very low	58	Low	71 Å²	71	82.8 Å²	82.8	33%	0.332	42%	0.418	S	S	.	.	H	α-helix	trans	-57.3	-32.5	177.7	-76.2	-174.9	160.4	0	0	113	E427 D428 P429 R434 L435 T436	E427-E432 HydrophobicContact CB-CG 3.71Å; E427-E432 HydrophobicContact CG-CG 3.7Å; E427-E432 WeakPolarHBondContact OE2-CG 3.26Å; D428-E432 PolarHBondContact O-N 3.02Å; P429-E432 PolarHBondContact O-N 3.18Å; E432-R434 PolarHBondContact O-N 2.93Å; E432-L435 PolarHBondContact O-N 3.28Å; E432-T436 PolarHBondContact O-N 3.38Å; E432-T436 PolarHBondContact O-OG1 3.08Å; E432-T436 VanDerWaalsContact O-OG1 3.13Å
433	R	45.3	Very low	56.5	Low	139 Å²	139	83.3 Å²	83.3	53%	0.525	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-8.8	172.2	-70.7	-176.1	-166.3	-177.9	2.8	113.5	D169 P429 L431	D169-R433 IonicContact OD2-CZ 3.5Å; D169-R433 IonicContact OD2-NH1 3.04Å; D169-R433 PolarHBondContact OD2-NH1 2.76Å; D169-R433 IonicContact OD2-NH2 2.69Å; P429-R433 PolarHBondContact O-N 2.71Å; L431-R433 PolarHBondContact O-N 3.33Å
434	R	44.7	Very low	54.7	Low	85 Å²	85	83.8 Å²	83.8	32%	0.321	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.2	171.5	-72.5	-172.4	165.7	161.3	7.4	114.9	M171 V242 L431 E432	M171-R434 PolarHBondContact SD-NH2 3.17Å; V242-R434 PolarHBondContact O-NH1 3.22Å; V242-R434 PolarHBondContact O-NH2 3.26Å; V242-R434 VanDerWaalsContact O-NH2 3.13Å; L431-R434 WeakPolarHBondContact O-CB 3.28Å; L431-R434 WeakPolarHBondContact O-CG 3.37Å; L431-R434 PolarHBondContact O-N 3.48Å; E432-R434 PolarHBondContact O-N 2.93Å
435	L	40.7	Very low	52.7	Low	69 Å²	69	87.3 Å²	87.3	36%	0.361	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-31.4	-169.5	-66.2	174.2	0	0	0	112.9	E432 Y437	E432-L435 PolarHBondContact O-N 3.28Å; L435-Y437 PolarHBondContact O-N 3.08Å; L435-Y437 VanDerWaalsContact O-N 3.12Å
436	T	31.9	Very low	50.4	Low	81 Å²	81	87.7 Å²	87.7	50%	0.497	43%	0.426	S	S	.	.			trans	-90.4	84.9	-173.3	51.2	0	0	0	0	113.4	E432	E432-T436 PolarHBondContact O-N 3.38Å; E432-T436 PolarHBondContact O-OG1 3.08Å; E432-T436 VanDerWaalsContact O-OG1 3.13Å
437	Y	33.1	Very low	48	Very low	181 Å²	181	90.1 Å²	90.1	71%	0.71	44%	0.439	S	S	*	.			trans	-144.9	68	133.5	-98.5	-84.5	0	0	0	105.8	D164 L435	D164-Y437 HydrophobicContact CB-CE1 4Å; L435-Y437 PolarHBondContact O-N 3.08Å; L435-Y437 VanDerWaalsContact O-N 3.12Å
438	G	35	Very low	45.6	Very low	57 Å²	57	94.8 Å²	94.8	59%	0.588	46%	0.463	S	S	*	.			trans	-113.8	19.4	173.2	0	0	0	0	0	112.3
439	D	29	Very low	43.3	Very low	140 Å²	140	102.7 Å²	102.7	75%	0.749	50%	0.501	S	S	*	.			trans	-89.1	113.4	171.1	-75.7	-35.9	0	0	0	109.6
440	F	27.5	Very low	41.4	Very low	241 Å²	241	106.9 Å²	106.9	100%	1.057	51%	0.513	S	S	*	.			trans	99.6	0	175.1	-54.1	-71.2	0	0	0	118.5	L161	L161-F440 HydrophobicContact CD1-CB 3.45Å; L161-F440 VanDerWaalsContact CD1-CB 3.45Å; L161-F440 WeakPolarHBondContact CD1-O 3.16Å

Retrieved 440 of 440 residues in 1552.6 ms (Link to these results)

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