A0A087YJ58_POEFO Loading...

RAB, member of RAS oncogene family-like 2

AlphaFold DB , UniProt , Accession A0A087YJ58, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 222 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	35.4	Very low	243 Å²	243	146.6 Å²	146.6	100%	1.197	83%	0.83	S	S	*	*				0	97.3	0	-74.1	177.2	-179.8	0	0	107.4
2	A	33.9	Very low	35.6	Very low	104 Å²	104	146 Å²	146	86%	0.86	82%	0.823	S	S	*	*			trans	-143.3	92.3	169.8	0	0	0	0	0	105
3	D	35.3	Very low	35.9	Very low	148 Å²	148	149.4 Å²	149.4	79%	0.791	83%	0.828	S	S	*	*			trans	-84.4	124.1	179.5	-86	-36.1	0	0	0	109.9
4	H	35.2	Very low	36	Very low	161 Å²	161	150.1 Å²	150.1	75%	0.745	82%	0.818	S	S	*	*				67.4	124.7	128.4	-93.4	-36.6	0	0	0	123.5
5	I	35	Very low	36.3	Very low	159 Å²	159	153.9 Å²	153.9	82%	0.815	82%	0.824	S	S	*	*				97.7	113.6	129.7	-60.7	156.3	0	0	0	117.7
6	G	28.9	Very low	37.1	Very low	66 Å²	66	155.4 Å²	155.4	68%	0.68	82%	0.816	S	S	*	*			trans	175.5	46.8	161.8	0	0	0	0	0	111.2	I8	G6-I8 PolarHBondContact O-N 3.39Å; G6-I8 VanDerWaalsContact O-N 3.09Å
7	C	32.6	Very low	38.2	Very low	127 Å²	127	151.1 Å²	151.1	86%	0.858	79%	0.793	S	S	*	*			trans	-57.6	112.6	172.4	-160.1	0	0	0	0	107.7
8	I	38.2	Very low	39.4	Very low	147 Å²	147	146.7 Å²	146.7	75%	0.754	78%	0.782	S	S	*	*			trans	-64.9	122.9	172.4	-56.6	167.2	0	0	0	105.1	G6 E10	G6-I8 PolarHBondContact O-N 3.39Å; G6-I8 VanDerWaalsContact O-N 3.09Å; I8-E10 PolarHBondContact O-N 3.09Å
9	P	36.3	Very low	40.6	Very low	109 Å²	109	149.6 Å²	149.6	71%	0.708	78%	0.782	S	S	*	*			trans	-61	119.7	175.2	-15.3	28.1	0	0	0	107.5	L11	P9-L11 VanDerWaalsContact C-N 3.34Å; P9-L11 PolarHBondContact O-N 2.87Å
10	E	38.1	Very low	42.4	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.883	76%	0.761	S	S	*	*			trans	-49	104.8	162.1	-77.6	173.1	149.4	0	0	106.7	I8 D12	I8-E10 PolarHBondContact O-N 3.09Å; E10-D12 VanDerWaalsContact C-N 3.31Å; E10-D12 PolarHBondContact O-N 3.37Å
11	L	39.9	Very low	44.6	Very low	160 Å²	160	142.5 Å²	142.5	84%	0.838	74%	0.74	S	S	*	*			trans	-62	103.9	168.4	-79.2	162.5	0	0	0	105.4	P9 Q13	P9-L11 VanDerWaalsContact C-N 3.34Å; P9-L11 PolarHBondContact O-N 2.87Å; L11-Q13 PolarHBondContact O-N 3.07Å
12	D	37.9	Very low	47.4	Very low	139 Å²	139	131.1 Å²	131.1	74%	0.743	68%	0.684	S	S	*	*			trans	-36.3	99.2	171.5	-94.7	-31.4	0	0	0	109.7	E10 K14	E10-D12 VanDerWaalsContact C-N 3.31Å; E10-D12 PolarHBondContact O-N 3.37Å; D12-K14 PolarHBondContact O-N 2.9Å
13	Q	39.4	Very low	50.3	Low	190 Å²	190	127.1 Å²	127.1	89%	0.888	65%	0.648	S	S	*	*			trans	-69.9	67.2	156.3	-83.9	178.1	-5.5	0	0	106.8	L11 K15	L11-Q13 PolarHBondContact O-N 3.07Å; Q13-K15 VanDerWaalsContact C-N 3.34Å; Q13-K15 PolarHBondContact O-N 3.09Å
14	K	36.9	Very low	53.2	Low	160 Å²	160	120 Å²	120	70%	0.696	61%	0.61	S	S	*	*			trans	-59.2	111.1	152.9	-83.9	-175.2	177.2	178.9	0	104.8	D12 Y16	D12-K14 PolarHBondContact O-N 2.9Å; K14-Y16 VanDerWaalsContact C-N 3.29Å; K14-Y16 WeakPolarHBondContact O-CD2 3.24Å; K14-Y16 PolarHBondContact O-N 3.24Å
15	K	41.2	Very low	56.1	Low	207 Å²	207	112.4 Å²	112.4	90%	0.9	57%	0.574	S	S	*	*			trans	-44.5	101.6	163.5	-84.6	177.4	170.5	179.1	0	106.2	Q13 D17	Q13-K15 VanDerWaalsContact C-N 3.34Å; Q13-K15 PolarHBondContact O-N 3.09Å; K15-D17 PolarHBondContact O-N 3.44Å
16	Y	48.7	Very low	58.9	Low	178 Å²	178	104.9 Å²	104.9	70%	0.698	54%	0.536	S	S	*	.			trans	-60.8	108.6	170.1	-78.5	-89.4	0	0	0	105	K14 A18 T71	K14-Y16 VanDerWaalsContact C-N 3.29Å; K14-Y16 WeakPolarHBondContact O-CD2 3.24Å; K14-Y16 PolarHBondContact O-N 3.24Å; Y16-A18 PolarHBondContact O-N 3.22Å; Y16-A18 VanDerWaalsContact O-N 3.11Å; Y16-T71 VanDerWaalsContact CD1-OG1 3.25Å; Y16-T71 WeakPolarHBondContact CD1-OG1 3.36Å; Y16-T71 WeakPolarHBondContact CE1-OG1 3.36Å
17	D	55.6	Low	62	Low	81 Å²	81	101.8 Å²	101.8	43%	0.433	50%	0.504	S	S	.	.			trans	-65	115.6	175.9	-166.5	-17.3	0	0	0	106.5	K15 R19 E20	K15-D17 PolarHBondContact O-N 3.44Å; D17-R19 PolarHBondContact O-N 2.84Å; D17-R19 VanDerWaalsContact OD1-CB 3.26Å; D17-R19 WeakPolarHBondContact OD1-CB 3.45Å; D17-R19 VanDerWaalsContact OD1-CG 3.26Å; D17-R19 WeakPolarHBondContact OD1-CG 3.41Å; D17-R19 PolarHBondContact OD1-N 3.49Å; D17-R19 VanDerWaalsContact OD1-N 3.1Å; D17-E20 HydrophobicContact CB-CG 4.37Å; D17-E20 PolarHBondContact O-N 2.79Å
18	A	59.9	Low	64.9	Low	72 Å²	72	95.8 Å²	95.8	60%	0.595	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-55.3	-22.3	177.7	0	0	0	0	0	111.2	Y16 E20 Q21 K184	Y16-A18 PolarHBondContact O-N 3.22Å; Y16-A18 VanDerWaalsContact O-N 3.11Å; A18-E20 PolarHBondContact O-N 3.33Å; A18-Q21 PolarHBondContact O-N 2.73Å; A18-K184 PolarHBondContact O-NZ 2.79Å
19	R	62.2	Low	67.5	Low	203 Å²	203	89.7 Å²	89.7	77%	0.766	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-62.5	-27.3	172.5	-64.3	175	173.8	170.5	-1.1	113.1	D17 K184	D17-R19 PolarHBondContact O-N 2.84Å; D17-R19 VanDerWaalsContact OD1-CB 3.26Å; D17-R19 WeakPolarHBondContact OD1-CB 3.45Å; D17-R19 VanDerWaalsContact OD1-CG 3.26Å; D17-R19 WeakPolarHBondContact OD1-CG 3.41Å; D17-R19 PolarHBondContact OD1-N 3.49Å; D17-R19 VanDerWaalsContact OD1-N 3.1Å; R19-K184 VanDerWaalsContact C-NZ 3.29Å; R19-K184 WeakPolarHBondContact O-CE 3.4Å; R19-K184 PolarHBondContact O-NZ 2.98Å
20	E	77.1	Confident	70	Confident	80 Å²	80	86.6 Å²	86.6	37%	0.374	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-100.3	5.9	-177.8	-59	-165.7	149.4	0	0	114	D17 A18 V70 T71	D17-E20 HydrophobicContact CB-CG 4.37Å; D17-E20 PolarHBondContact O-N 2.79Å; A18-E20 PolarHBondContact O-N 3.33Å; E20-V70 WeakPolarHBondContact O-CA 3.34Å; E20-V70 WeakPolarHBondContact O-CB 3.38Å; E20-T71 PolarHBondContact O-N 3.1Å; E20-T71 VanDerWaalsContact O-N 3.09Å
21	Q	89.4	Confident	72.5	Confident	70 Å²	70	80.8 Å²	80.8	33%	0.327	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.6	175.7	-167.9	-179.9	35.1	0	0	112.2	A18 T71 D73 K184	A18-Q21 PolarHBondContact O-N 2.73Å; Q21-T71 CarbonylContact C-O 3.59Å; Q21-T71 VanDerWaalsContact CA-O 3.26Å; Q21-T71 WeakPolarHBondContact CA-O 3.46Å; Q21-T71 HydrophobicContact CG-CG2 4.44Å; Q21-D73 PolarHBondContact NE2-OD1 3.4Å; Q21-D73 PolarHBondContact NE2-OD2 3.2Å; Q21-K184 PolarHBondContact O-NZ 2.8Å
22	V	94.1	Very high	75.1	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.018	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.9	172.4	-66.5	0	0	0	0	110.5	T71 V72 D73 H95 A180 V181 K184	V22-T71 PolarHBondContact N-O 3.48Å; V22-V72 HydrophobicContact CG2-CB 4.2Å; V22-V72 HydrophobicContact CG2-CG1 4.14Å; V22-V72 HydrophobicContact CG2-CG2 3.77Å; V22-V72 CarbonylContact O-C 3.57Å; V22-V72 WeakPolarHBondContact O-CA 3.46Å; V22-D73 PolarHBondContact O-N 3.19Å; V22-H95 HydrophobicContact CB-CB 4.5Å; V22-A180 HydrophobicContact CB-CB 4.28Å; V22-A180 HydrophobicContact CG2-CB 4.47Å; V22-V181 HydrophobicContact CG1-CG2 3.93Å; V22-V181 HydrophobicContact CG2-CG2 4.28Å; V22-K184 HydrophobicContact CG1-CB 4.29Å; V22-K184 HydrophobicContact CG1-CD 3.9Å
23	K	94.9	Very high	77.8	Confident	20 Å²	20	67.2 Å²	67.2	9%	0.087	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.1	177.2	167.9	175.1	175.9	-173.6	0	110	I25 D73 W75 Y90 H92 K93 H95 A96	K23-I25 HydrophobicContact CG-CG2 4.26Å; K23-D73 CarbonylContact C-O 3.57Å; K23-D73 WeakPolarHBondContact CA-O 3.37Å; K23-W75 HydrophobicContact CD-CG 4.38Å; K23-W75 HydrophobicContact CG-CG 4.36Å; K23-Y90 WeakPolarHBondContact CE-O 3.34Å; K23-Y90 PolarHBondContact NZ-O 3.34Å; K23-H92 PolarHBondContact NZ-O 3.49Å; K23-K93 WeakPolarHBondContact CB-O 3.48Å; K23-H95 PolarHBondContact N-ND1 3.08Å; K23-H95 WeakPolarHBondContact O-CB 3.49Å; K23-H95 PolarHBondContact O-N 3.03Å; K23-A96 PolarHBondContact O-N 2.86Å
24	I	96.3	Very high	80.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.8	175.7	-57.9	-177.8	0	0	0	108.2	V72 D73 F74 W75 A96 I98 I177 A180	I24-V72 HydrophobicContact CD1-CG1 3.81Å; I24-V72 HydrophobicContact CG1-CG1 4.14Å; I24-D73 PolarHBondContact N-O 3.19Å; I24-F74 HydrophobicContact CB-CD1 3.77Å; I24-F74 HydrophobicContact CB-CE1 3.93Å; I24-F74 HydrophobicContact CD1-CD1 4.45Å; I24-F74 HydrophobicContact CD1-CE1 3.73Å; I24-F74 HydrophobicContact CD1-CZ 4.37Å; I24-F74 HydrophobicContact CG1-CE1 4.31Å; I24-F74 HydrophobicContact CG2-CD1 4.01Å; I24-F74 HydrophobicContact CG2-CE1 4.07Å; I24-F74 WeakPolarHBondContact O-CA 3.34Å; I24-W75 PolarHBondContact O-N 3.49Å; I24-A96 HydrophobicContact CG1-CB 4.26Å; I24-A96 HydrophobicContact CG2-CB 4.46Å; I24-I98 HydrophobicContact CG2-CD1 3.88Å; I24-I98 HydrophobicContact CG2-CG1 4.15Å; I24-I177 HydrophobicContact CD1-CG1 3.91Å; I24-A180 HydrophobicContact CD1-CB 4.05Å; I24-A180 HydrophobicContact CG1-CB 4.04Å
25	I	95.4	Very high	82.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	150.1	178.5	63.4	172	0	0	0	110.7	K23 W75 Y90 Y91 A94 A96 C97 I98 L119	K23-I25 HydrophobicContact CG-CG2 4.26Å; I25-W75 HydrophobicContact CG2-CB 4.15Å; I25-Y90 HydrophobicContact CB-CE1 3.76Å; I25-Y90 HydrophobicContact CD1-CD1 4.4Å; I25-Y90 HydrophobicContact CD1-CE1 4.08Å; I25-Y90 HydrophobicContact CG1-CE1 4.42Å; I25-Y90 HydrophobicContact CG2-CE1 4.11Å; I25-Y90 HydrophobicContact CG2-CE2 4.45Å; I25-Y91 HydrophobicContact CD1-CD1 3.74Å; I25-Y91 HydrophobicContact CD1-CE1 4.16Å; I25-A94 HydrophobicContact CD1-CB 3.85Å; I25-A94 HydrophobicContact CG1-CB 4.04Å; I25-A94 HydrophobicContact CG2-CB 3.86Å; I25-A96 PolarHBondContact N-O 3.46Å; I25-C97 HydrophobicContact CD1-CB 4.32Å; I25-C97 HydrophobicContact CG1-CB 3.88Å; I25-C97 WeakPolarHBondContact O-CA 3.18Å; I25-I98 PolarHBondContact O-N 3.16Å; I25-L119 HydrophobicContact CD1-CD1 3.93Å
26	C	93.8	Very high	85.3	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.007	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.9	169	-76.6	0	0	0	0	110.7	K34 M38 W75 Y90 I98	C26-K34 HydrophobicContact CB-CB 4.21Å; C26-K34 HydrophobicContact CB-CD 4.06Å; C26-K34 HydrophobicContact CB-CG 4.35Å; C26-M38 HydrophobicContact CB-CE 3.75Å; C26-M38 WeakPolarHBondContact SG-CE 3.36Å; C26-W75 PolarHBondContact N-O 2.88Å; C26-Y90 PolarHBondContact N-OH 3.12Å; C26-Y90 VanDerWaalsContact N-OH 3.17Å; C26-Y90 PolarHBondContact O-OH 3.07Å; C26-I98 WeakPolarHBondContact CA-O 3.36Å
27	L	94.1	Very high	87.5	Confident	2 Å²	2	40 Å²	40	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	155.2	174.6	-65.8	176.5	0	0	0	110.7	M86 Y90 Y91 C97 I98 M99 V100 W115 L119	L27-M86 HydrophobicContact CD2-CG 4.33Å; L27-Y90 HydrophobicContact CD2-CD1 4.31Å; L27-Y90 HydrophobicContact CD2-CE1 3.77Å; L27-Y91 HydrophobicContact CD1-CE1 3.94Å; L27-Y91 HydrophobicContact CD2-CE1 4.02Å; L27-C97 VanDerWaalsContact CD1-SG 3.52Å; L27-I98 PolarHBondContact N-O 3.09Å; L27-M99 HydrophobicContact CB-CG 4.42Å; L27-M99 WeakPolarHBondContact O-CA 3.39Å; L27-V100 PolarHBondContact O-N 3.43Å; L27-W115 HydrophobicContact CB-CB 4.37Å; L27-W115 HydrophobicContact CD1-CB 4.5Å; L27-W115 HydrophobicContact CD2-CE3 4.21Å; L27-L119 HydrophobicContact CD1-CB 3.98Å; L27-L119 HydrophobicContact CD1-CD1 4.36Å; L27-L119 HydrophobicContact CD1-CD2 4.26Å; L27-L119 HydrophobicContact CD1-CG 4.45Å
28	G	93.6	Very high	89.2	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	20%	0.196	C	C	.	.			trans	139.4	161.5	179.1	0	0	0	0	0	112	K34 V100	G28-K34 PolarHBondContact O-NZ 3.05Å; G28-V100 WeakPolarHBondContact CA-O 3.37Å
29	D	92	Very high	90.6	Very high	18 Å²	18	35.9 Å²	35.9	10%	0.096	18%	0.183	C	C	.	.			trans	-56.4	165.5	-176.4	-75.4	23	0	0	0	113.8	V32 K34 T108 N111 W115	D29-V32 HydrophobicContact CB-CG1 3.84Å; D29-V32 WeakPolarHBondContact O-CG1 3.25Å; D29-V32 WeakPolarHBondContact O-CG2 3.26Å; D29-V32 PolarHBondContact O-N 3.28Å; D29-K34 PolarHBondContact O-NZ 3.47Å; D29-T108 HydrophobicContact CB-CG2 3.74Å; D29-T108 WeakPolarHBondContact OD2-CA 3.47Å; D29-N111 VanDerWaalsContact OD1-CB 3.27Å; D29-N111 WeakPolarHBondContact OD1-CB 3.21Å; D29-N111 PolarHBondContact OD1-ND2 2.95Å; D29-N111 PolarHBondContact OD2-ND2 3.27Å; D29-W115 PolarHBondContact OD1-NE1 3.02Å
30	S	90.4	Very high	92	Very high	45 Å²	45	30.2 Å²	30.2	32%	0.315	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	144.7	178	-156.6	0	0	0	0	111.6	V32 E81 R105	S30-V32 PolarHBondContact O-N 2.97Å; S30-E81 VanDerWaalsContact CA-CG 3.47Å; S30-E81 WeakPolarHBondContact CA-OE1 3.4Å; S30-E81 WeakPolarHBondContact CB-OE1 3.13Å; S30-E81 PolarHBondContact OG-OE1 2.83Å; S30-R105 PolarHBondContact O-NH1 2.95Å
31	A	90.7	Very high	92.7	Very high	66 Å²	66	27.4 Å²	27.4	55%	0.545	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	20.5	179.7	0	0	0	0	0	115.8	G33 K134	A31-G33 PolarHBondContact O-N 3.42Å; A31-K134 WeakPolarHBondContact O-CE 3.3Å; A31-K134 PolarHBondContact O-NZ 2.91Å
32	V	93.9	Very high	92.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-74.3	-15.2	170.8	-60.4	0	0	0	0	113.3	D29 S30 K34 V100 D102 T108 N133	D29-V32 HydrophobicContact CB-CG1 3.84Å; D29-V32 WeakPolarHBondContact O-CG1 3.25Å; D29-V32 WeakPolarHBondContact O-CG2 3.26Å; D29-V32 PolarHBondContact O-N 3.28Å; S30-V32 PolarHBondContact O-N 2.97Å; V32-K34 HydrophobicContact CG2-CD 4.32Å; V32-K34 HydrophobicContact CG2-CG 3.68Å; V32-V100 HydrophobicContact CB-CG1 4.3Å; V32-V100 HydrophobicContact CG2-CB 3.94Å; V32-V100 HydrophobicContact CG2-CG1 3.88Å; V32-D102 HydrophobicContact CB-CB 4.32Å; V32-D102 HydrophobicContact CG1-CB 4.12Å; V32-T108 HydrophobicContact CG1-CG2 3.74Å; V32-N133 PolarHBondContact O-ND2 2.78Å
33	G	93.6	Very high	91.7	Very high	15 Å²	15	29 Å²	29	16%	0.155	16%	0.156	C	C	.	.	S	Bend	trans	102	25.4	174.7	0	0	0	0	0	115.8	A31 K36 L37	A31-G33 PolarHBondContact O-N 3.42Å; G33-K36 PolarHBondContact O-N 2.85Å; G33-L37 WeakPolarHBondContact O-CG 3.43Å; G33-L37 PolarHBondContact O-N 3.1Å
34	K	93.8	Very high	89.7	Confident	7 Å²	7	36.1 Å²	36.1	3%	0.03	20%	0.196	C	C	.	.	H	α-helix	trans	-54.2	-55.3	176.1	-55.8	-175.4	-60.4	-84.7	0	112.1	C26 G28 D29 V32 K36 L37 M38 T77 E81 V100	C26-K34 HydrophobicContact CB-CB 4.21Å; C26-K34 HydrophobicContact CB-CD 4.06Å; C26-K34 HydrophobicContact CB-CG 4.35Å; G28-K34 PolarHBondContact O-NZ 3.05Å; D29-K34 PolarHBondContact O-NZ 3.47Å; V32-K34 HydrophobicContact CG2-CD 4.32Å; V32-K34 HydrophobicContact CG2-CG 3.68Å; K34-K36 VanDerWaalsContact C-N 3.32Å; K34-K36 PolarHBondContact O-N 3.1Å; K34-L37 WeakPolarHBondContact O-CB 3.49Å; K34-L37 PolarHBondContact O-N 2.93Å; K34-L37 VanDerWaalsContact O-N 3.16Å; K34-M38 PolarHBondContact O-N 3.35Å; K34-T77 WeakPolarHBondContact CE-OG1 3.43Å; K34-E81 IonicContact NZ-OE1 3.89Å; K34-E81 IonicContact NZ-OE2 3.13Å; K34-V100 HydrophobicContact CG-CB 4.17Å; K34-V100 HydrophobicContact CG-CG2 4.2Å
35	S	91	Very high	87.7	Confident	39 Å²	39	42.7 Å²	42.7	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-56.4	-44.8	176.4	-35.7	0	0	0	0	112.1	L37 M38 E39 D76	S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L37 PolarHBondContact O-N 3.19Å; S35-M38 PolarHBondContact O-N 3.23Å; S35-E39 WeakPolarHBondContact O-CG 3.4Å; S35-E39 PolarHBondContact O-N 2.93Å; S35-D76 WeakPolarHBondContact CA-OD2 3.26Å; S35-D76 WeakPolarHBondContact CB-OD2 3.43Å; S35-D76 PolarHBondContact N-OD1 3.12Å; S35-D76 VanDerWaalsContact OG-CG 3.3Å; S35-D76 PolarHBondContact OG-OD1 3.09Å; S35-D76 PolarHBondContact OG-OD2 3.08Å
36	K	91.9	Very high	85.8	Confident	114 Å²	114	45.3 Å²	45.3	50%	0.496	24%	0.238	S	C	.	.	H	α-helix	trans	-66.2	-33.2	179.7	-65.9	-50.5	-174.7	-164.4	0	113.4	G33 K34 E39 R40 A163	G33-K36 PolarHBondContact O-N 2.85Å; K34-K36 VanDerWaalsContact C-N 3.32Å; K34-K36 PolarHBondContact O-N 3.1Å; K36-E39 WeakPolarHBondContact CD-OE2 3.49Å; K36-E39 VanDerWaalsContact NZ-CD 3.27Å; K36-E39 IonicContact NZ-OE1 3.79Å; K36-E39 PolarHBondContact NZ-OE1 2.97Å; K36-E39 IonicContact NZ-OE2 2.74Å; K36-E39 PolarHBondContact NZ-OE2 3.32Å; K36-R40 WeakPolarHBondContact O-CB 3.39Å; K36-R40 PolarHBondContact O-N 3.13Å; K36-A163 HydrophobicContact CB-CB 3.81Å
37	L	93.8	Very high	83.7	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-44.1	172.9	-76.9	168.6	0	0	0	111.2	G33 K34 S35 R40 F41 V100 V131 N133 V161 A163 V169 F173	G33-L37 WeakPolarHBondContact O-CG 3.43Å; G33-L37 PolarHBondContact O-N 3.1Å; K34-L37 WeakPolarHBondContact O-CB 3.49Å; K34-L37 PolarHBondContact O-N 2.93Å; K34-L37 VanDerWaalsContact O-N 3.16Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L37 PolarHBondContact O-N 3.19Å; L37-R40 PolarHBondContact O-N 2.99Å; L37-F41 WeakPolarHBondContact O-CB 3.26Å; L37-F41 PolarHBondContact O-N 2.88Å; L37-V100 HydrophobicContact CD1-CG1 3.76Å; L37-V100 HydrophobicContact CD1-CG2 3.9Å; L37-V131 HydrophobicContact CD1-CG1 4.15Å; L37-N133 HydrophobicContact CD1-CB 4.38Å; L37-V161 HydrophobicContact CD1-CG2 4.34Å; L37-V161 HydrophobicContact CD2-CB 4.32Å; L37-V161 HydrophobicContact CD2-CG2 3.65Å; L37-A163 HydrophobicContact CD2-CB 3.84Å; L37-A163 HydrophobicContact CG-CB 4.03Å; L37-V169 HydrophobicContact CD2-CG1 4.45Å; L37-V169 HydrophobicContact CD2-CG2 3.81Å; L37-F173 HydrophobicContact CB-CE2 4.03Å; L37-F173 HydrophobicContact CB-CZ 4.2Å; L37-F173 WeakPolarHBondContact O-CE2 3.44Å
38	M	91.9	Very high	81.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-50.9	177	-63.6	-174.2	-178.7	0	0	111.6	C26 K34 S35 R40 F41 L42 Y59 F74 W75 D76 F173	C26-M38 HydrophobicContact CB-CE 3.75Å; C26-M38 WeakPolarHBondContact SG-CE 3.36Å; K34-M38 PolarHBondContact O-N 3.35Å; S35-M38 PolarHBondContact O-N 3.23Å; M38-R40 PolarHBondContact O-N 3.48Å; M38-F41 PolarHBondContact O-N 3.02Å; M38-F41 VanDerWaalsContact O-N 3.15Å; M38-L42 WeakPolarHBondContact O-CB 3.34Å; M38-L42 WeakPolarHBondContact O-CD1 3.47Å; M38-L42 WeakPolarHBondContact O-CG 3.4Å; M38-L42 PolarHBondContact O-N 3.23Å; M38-Y59 HydrophobicContact CB-CD1 4.49Å; M38-Y59 HydrophobicContact CB-CD2 4.21Å; M38-Y59 HydrophobicContact CB-CE2 4.25Å; M38-Y59 HydrophobicContact CB-CG 4.38Å; M38-Y59 HydrophobicContact SD-CD2 3.47Å; M38-Y59 WeakPolarHBondContact SD-CD2 3.4Å; M38-Y59 HydrophobicContact SD-CE2 3.71Å; M38-Y59 HydrophobicContact SD-CG 4.32Å; M38-F74 HydrophobicContact CE-CB 3.92Å; M38-F74 HydrophobicContact CG-CB 4.48Å; M38-F74 HydrophobicContact SD-CB 3.77Å; M38-W75 VanDerWaalsContact CE-O 3.3Å; M38-W75 WeakPolarHBondContact CE-O 3.36Å; M38-D76 HydrophobicContact CE-CB 4.02Å; M38-D76 HydrophobicContact SD-CB 3.68Å; M38-F173 HydrophobicContact CG-CE1 4.48Å; M38-F173 HydrophobicContact CG-CZ 4.11Å
39	E	89.6	Confident	79.9	Confident	68 Å²	68	64.9 Å²	64.9	32%	0.318	33%	0.327	S	S	.	.	H	α-helix	trans	-52.7	-45.3	175.6	-72.7	173.6	-155.2	0	0	111.1	S35 K36 L42 M43 Y59	S35-E39 WeakPolarHBondContact O-CG 3.4Å; S35-E39 PolarHBondContact O-N 2.93Å; K36-E39 WeakPolarHBondContact CD-OE2 3.49Å; K36-E39 VanDerWaalsContact NZ-CD 3.27Å; K36-E39 IonicContact NZ-OE1 3.79Å; K36-E39 PolarHBondContact NZ-OE1 2.97Å; K36-E39 IonicContact NZ-OE2 2.74Å; K36-E39 PolarHBondContact NZ-OE2 3.32Å; E39-L42 PolarHBondContact O-N 2.9Å; E39-M43 VanDerWaalsContact O-CG 3.29Å; E39-M43 WeakPolarHBondContact O-CG 3.5Å; E39-M43 PolarHBondContact O-N 3.09Å; E39-M43 VanDerWaalsContact O-N 3.17Å; E39-Y59 HydrophobicContact CG-CE1 4.27Å
40	R	90.8	Very high	78	Confident	83 Å²	83	69.5 Å²	69.5	31%	0.313	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-43.5	179	175.4	58.2	68.4	-168.3	5.4	112.5	K36 L37 M38 L42 M43 A163 A164 V169	K36-R40 WeakPolarHBondContact O-CB 3.39Å; K36-R40 PolarHBondContact O-N 3.13Å; L37-R40 PolarHBondContact O-N 2.99Å; M38-R40 PolarHBondContact O-N 3.48Å; R40-L42 PolarHBondContact O-N 2.82Å; R40-M43 PolarHBondContact NH1-SD 3.35Å; R40-A163 PolarHBondContact NE-O 3.44Å; R40-A164 PolarHBondContact NH2-O 3.23Å; R40-V169 HydrophobicContact CB-CG1 4.35Å; R40-V169 HydrophobicContact CG-CB 4.26Å; R40-V169 HydrophobicContact CG-CG1 4.01Å; R40-V169 HydrophobicContact CG-CG2 4.12Å
41	F	91.1	Very high	76.2	Confident	21 Å²	21	71 Å²	71	9%	0.092	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-34.6	178.5	175.2	-116.5	0	0	0	112.1	L37 M38 H61 F74 V169 V170 F173 I177	L37-F41 WeakPolarHBondContact O-CB 3.26Å; L37-F41 PolarHBondContact O-N 2.88Å; M38-F41 PolarHBondContact O-N 3.02Å; M38-F41 VanDerWaalsContact O-N 3.15Å; F41-H61 AromaticContact CE1-CD2 3.87Å; F41-H61 AromaticContact CZ-NE2 3.87Å; F41-F74 HydrophobicContact CD1-CE2 4.03Å; F41-F74 HydrophobicContact CD1-CZ 4.09Å; F41-F74 AromaticContact CE1-CE2 3.76Å; F41-F74 HydrophobicContact CE1-CE2 3.76Å; F41-F74 AromaticContact CE1-CZ 3.73Å; F41-F74 HydrophobicContact CE1-CZ 3.73Å; F41-V169 HydrophobicContact CB-CG1 3.91Å; F41-V170 HydrophobicContact CD2-CG2 4.38Å; F41-V170 HydrophobicContact CE2-CG1 4.46Å; F41-F173 HydrophobicContact CB-CD2 3.49Å; F41-F173 VanDerWaalsContact CB-CD2 3.49Å; F41-F173 HydrophobicContact CB-CE2 3.66Å; F41-F173 HydrophobicContact CB-CG 4Å; F41-F173 HydrophobicContact CB-CZ 4.3Å; F41-F173 HydrophobicContact CD1-CB 3.92Å; F41-F173 AromaticContact CD1-CD1 3.91Å; F41-F173 HydrophobicContact CD1-CD1 3.91Å; F41-F173 HydrophobicContact CD1-CD2 4.15Å; F41-F173 HydrophobicContact CD1-CE1 4.44Å; F41-F173 AromaticContact CD1-CG 3.74Å; F41-F173 HydrophobicContact CD1-CG 3.74Å; F41-F173 HydrophobicContact CD2-CB 3.44Å; F41-F173 VanDerWaalsContact CD2-CB 3.44Å; F41-F173 AromaticContact CD2-CD2 3.86Å; F41-F173 HydrophobicContact CD2-CD2 3.86Å; F41-F173 AromaticContact CD2-CG 3.8Å; F41-F173 HydrophobicContact CD2-CG 3.8Å; F41-F173 HydrophobicContact CE1-CB 3.92Å; F41-F173 HydrophobicContact CE1-CD1 4.31Å; F41-F173 HydrophobicContact CE1-CG 4.19Å; F41-F173 HydrophobicContact CE2-CB 3.43Å; F41-F173 VanDerWaalsContact CE2-CB 3.43Å; F41-F173 HydrophobicContact CE2-CG 4.23Å; F41-F173 HydrophobicContact CG-CB 3.7Å; F41-F173 HydrophobicContact CG-CD1 4.15Å; F41-F173 AromaticContact CG-CD2 3.55Å; F41-F173 HydrophobicContact CG-CD2 3.55Å; F41-F173 HydrophobicContact CG-CE2 4.16Å; F41-F173 AromaticContact CG-CG 3.54Å; F41-F173 HydrophobicContact CG-CG 3.54Å; F41-F173 HydrophobicContact CZ-CB 3.69Å; F41-F173 HydrophobicContact CZ-CG 4.42Å; F41-I177 HydrophobicContact CE1-CD1 4.09Å; F41-I177 HydrophobicContact CZ-CD1 3.81Å
42	L	87.2	Confident	74	Confident	5 Å²	5	73.3 Å²	73.3	3%	0.026	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	6	-173	-61	172.7	0	0	0	113.8	M38 E39 R40 D44 E45 F46 Y59 H61 F74	M38-L42 WeakPolarHBondContact O-CB 3.34Å; M38-L42 WeakPolarHBondContact O-CD1 3.47Å; M38-L42 WeakPolarHBondContact O-CG 3.4Å; M38-L42 PolarHBondContact O-N 3.23Å; E39-L42 PolarHBondContact O-N 2.9Å; R40-L42 PolarHBondContact O-N 2.82Å; L42-D44 PolarHBondContact O-N 2.83Å; L42-E45 PolarHBondContact O-N 2.82Å; L42-F46 HydrophobicContact CB-CB 4.02Å; L42-F46 HydrophobicContact CB-CG 4.19Å; L42-F46 HydrophobicContact CD1-CD2 4.12Å; L42-F46 HydrophobicContact CD1-CE2 4.24Å; L42-F46 HydrophobicContact CD1-CG 4.42Å; L42-F46 WeakPolarHBondContact O-CB 3.41Å; L42-Y59 HydrophobicContact CD1-CD1 3.57Å; L42-Y59 HydrophobicContact CD1-CG 3.76Å; L42-H61 HydrophobicContact CD2-CB 3.58Å; L42-F74 HydrophobicContact CD2-CE2 4.33Å
43	M	75.9	Confident	71.6	Confident	101 Å²	101	78.8 Å²	78.8	50%	0.498	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	137.5	172	-73.4	-166.2	173.7	0	0	109.5	E39 R40	E39-M43 VanDerWaalsContact O-CG 3.29Å; E39-M43 WeakPolarHBondContact O-CG 3.5Å; E39-M43 PolarHBondContact O-N 3.09Å; E39-M43 VanDerWaalsContact O-N 3.17Å; R40-M43 PolarHBondContact NH1-SD 3.35Å
44	D	52.3	Low	69.6	Low	171 Å²	171	88.3 Å²	88.3	91%	0.914	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-6.2	-175.3	-55.1	-31.8	0	0	0	118.2	L42	L42-D44 PolarHBondContact O-N 2.83Å
45	E	56	Low	68.1	Low	138 Å²	138	89.3 Å²	89.3	65%	0.645	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	9.8	-175.9	-68.5	-172.5	174.1	0	0	116.4	L42 H61	L42-E45 PolarHBondContact O-N 2.82Å; E45-H61 IonicContact OE2-CE1 3.24Å; E45-H61 PolarHBondContact OE2-CE1 3.37Å; E45-H61 IonicContact OE2-ND1 2.8Å; E45-H61 PolarHBondContact OE2-ND1 3.31Å
46	F	53.9	Low	67.3	Low	55 Å²	55	89 Å²	89	24%	0.241	44%	0.436	C	S	.	.			trans	-119.1	146.2	-158.5	-171.6	-121.2	0	0	0	119.1	L42 P48 Y59	L42-F46 HydrophobicContact CB-CB 4.02Å; L42-F46 HydrophobicContact CB-CG 4.19Å; L42-F46 HydrophobicContact CD1-CD2 4.12Å; L42-F46 HydrophobicContact CD1-CE2 4.24Å; L42-F46 HydrophobicContact CD1-CG 4.42Å; L42-F46 WeakPolarHBondContact O-CB 3.41Å; F46-P48 HydrophobicContact CD1-CB 4.27Å; F46-P48 VanDerWaalsContact CD1-CD 3.5Å; F46-P48 HydrophobicContact CD1-CG 3.88Å; F46-P48 HydrophobicContact CE1-CB 3.37Å; F46-P48 VanDerWaalsContact CE1-CD 3.43Å; F46-P48 HydrophobicContact CE1-CG 3.46Å; F46-P48 VanDerWaalsContact CE1-CG 3.46Å; F46-P48 HydrophobicContact CZ-CB 3.85Å; F46-P48 HydrophobicContact CZ-CG 4.36Å; F46-Y59 HydrophobicContact CD1-CD1 4.18Å; F46-Y59 AromaticContact CE1-CD1 3.26Å; F46-Y59 HydrophobicContact CE1-CD1 3.26Å; F46-Y59 AromaticContact CE1-CE1 3.7Å; F46-Y59 HydrophobicContact CE1-CE1 3.7Å; F46-Y59 HydrophobicContact CE1-CG 4.28Å; F46-Y59 AromaticContact CE2-CD1 3.9Å; F46-Y59 HydrophobicContact CE2-CD1 3.9Å; F46-Y59 HydrophobicContact CE2-CG 4.24Å; F46-Y59 AromaticContact CZ-CD1 3.08Å; F46-Y59 HydrophobicContact CZ-CD1 3.08Å; F46-Y59 AromaticContact CZ-CE1 3.92Å; F46-Y59 HydrophobicContact CZ-CE1 3.92Å; F46-Y59 AromaticContact CZ-CG 3.67Å; F46-Y59 HydrophobicContact CZ-CG 3.67Å
47	R	51.4	Low	66.8	Low	219 Å²	219	83.9 Å²	83.9	83%	0.826	41%	0.414	S	S	*	.			trans	-124.6	107.5	161.7	-68.6	-174.2	-178.4	-173	1.8	110.5	Q49	R47-Q49 PolarHBondContact O-N 3Å
48	P	53.2	Low	66.5	Low	90 Å²	90	84.2 Å²	84.2	58%	0.584	42%	0.415	S	S	*	.			trans	-60.3	125.6	176.3	-0.5	4.2	0	0	0	113.3	F46	F46-P48 HydrophobicContact CD1-CB 4.27Å; F46-P48 VanDerWaalsContact CD1-CD 3.5Å; F46-P48 HydrophobicContact CD1-CG 3.88Å; F46-P48 HydrophobicContact CE1-CB 3.37Å; F46-P48 VanDerWaalsContact CE1-CD 3.43Å; F46-P48 HydrophobicContact CE1-CG 3.46Å; F46-P48 VanDerWaalsContact CE1-CG 3.46Å; F46-P48 HydrophobicContact CZ-CB 3.85Å; F46-P48 HydrophobicContact CZ-CG 4.36Å
49	Q	54.1	Low	66.2	Low	106 Å²	106	84.8 Å²	84.8	50%	0.495	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	96.1	164.1	-72.6	-174.5	0.7	0	0	108.6	R47 L51	R47-Q49 PolarHBondContact O-N 3Å; Q49-L51 PolarHBondContact O-N 2.84Å
50	Q	51.5	Low	66.2	Low	115 Å²	115	86 Å²	86	54%	0.537	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	112.6	164.9	-72.1	-72.4	-39.9	0	0	107.5	T57	Q50-T57 PolarHBondContact NE2-OG1 3.11Å; Q50-T57 PolarHBondContact OE1-OG1 3.35Å
51	L	53.3	Low	66.1	Low	75 Å²	75	83.2 Å²	83.2	39%	0.393	41%	0.413	S	S	.	.			trans	-69.8	137.5	171.8	-66.7	173.5	0	0	0	108.4	Q49 T53 L58 W75	Q49-L51 PolarHBondContact O-N 2.84Å; L51-T53 PolarHBondContact O-N 2.93Å; L51-L58 HydrophobicContact CD1-CB 3.92Å; L51-L58 HydrophobicContact CD1-CD2 4.19Å; L51-L58 HydrophobicContact CG-CB 4.22Å; L51-W75 HydrophobicContact CD1-CH2 4.38Å
52	S	43.2	Very low	66.1	Low	116 Å²	116	85.6 Å²	85.6	81%	0.811	43%	0.429	S	S	*	.	S	Bend	trans	-59.4	128.3	-172.3	60.7	0	0	0	0	111
53	T	43.4	Very low	66.1	Low	115 Å²	115	85.8 Å²	85.8	71%	0.706	43%	0.431	S	S	*	.	S	Bend	trans	92.2	68.6	-178	-32.1	0	0	0	0	114.6	L51 A55	L51-T53 PolarHBondContact O-N 2.93Å; T53-A55 WeakPolarHBondContact O-CB 3.43Å; T53-A55 PolarHBondContact O-N 3.22Å
54	Y	52	Low	66.7	Low	215 Å²	215	87 Å²	87	84%	0.843	44%	0.44	S	S	*	.	S	Bend	trans	34	9.3	147.2	-63.8	-79.3	0	0	0	122.3
55	A	62.4	Low	68.4	Low	27 Å²	27	79.9 Å²	79.9	22%	0.223	40%	0.402	C	S	.	.	S	Bend	trans	-109.3	-34	-169.9	0	0	0	0	0	112.3	T53 A78 Q80	T53-A55 WeakPolarHBondContact O-CB 3.43Å; T53-A55 PolarHBondContact O-N 3.22Å; A55-A78 PolarHBondContact O-N 3.17Å; A55-Q80 HydrophobicContact CB-CG 4.44Å
56	L	74.3	Confident	69.9	Low	34 Å²	34	76.7 Å²	76.7	18%	0.178	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	132.3	-176.2	-63.2	173	0	0	0	109.8	W75 D76 T77 M86 Y90	L56-W75 HydrophobicContact CB-CE3 4.38Å; L56-W75 HydrophobicContact CB-CZ3 4.48Å; L56-W75 HydrophobicContact CD1-CE3 3.96Å; L56-W75 HydrophobicContact CD1-CZ3 3.78Å; L56-D76 WeakPolarHBondContact CA-O 3.41Å; L56-T77 HydrophobicContact CD2-CG2 4.06Å; L56-M86 HydrophobicContact CD2-CE 3.97Å; L56-Y90 HydrophobicContact CD1-CD2 4.1Å; L56-Y90 HydrophobicContact CD2-CD2 3.61Å; L56-Y90 HydrophobicContact CD2-CE2 3.7Å
57	T	81.8	Confident	71.3	Confident	5 Å²	5	82.5 Å²	82.5	3%	0.031	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.2	171.2	-56.7	0	0	0	0	109.2	Q50 Y59 D76	Q50-T57 PolarHBondContact NE2-OG1 3.11Å; Q50-T57 PolarHBondContact OE1-OG1 3.35Å; T57-Y59 HydrophobicContact CG2-CD2 3.87Å; T57-Y59 HydrophobicContact CG2-CE1 4.31Å; T57-Y59 HydrophobicContact CG2-CE2 3.3Å; T57-D76 PolarHBondContact N-O 3.47Å; T57-D76 PolarHBondContact O-N 2.94Å
58	L	86.4	Confident	72.8	Confident	9 Å²	9	76.6 Å²	76.6	5%	0.047	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.1	173.7	176.2	59.2	0	0	0	109.6	L51 K60 D73 W75	L51-L58 HydrophobicContact CD1-CB 3.92Å; L51-L58 HydrophobicContact CD1-CD2 4.19Å; L51-L58 HydrophobicContact CG-CB 4.22Å; L58-K60 HydrophobicContact CD2-CG 4.41Å; L58-K60 HydrophobicContact CG-CG 4.26Å; L58-D73 HydrophobicContact CD1-CB 3.64Å; L58-W75 HydrophobicContact CD1-CG 4.4Å
59	Y	87.4	Confident	74.5	Confident	13 Å²	13	75.8 Å²	75.8	5%	0.051	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.4	170.1	-53.4	-109	0	0	0	109.8	M38 E39 L42 F46 T57 F74 D76	M38-Y59 HydrophobicContact CB-CD1 4.49Å; M38-Y59 HydrophobicContact CB-CD2 4.21Å; M38-Y59 HydrophobicContact CB-CE2 4.25Å; M38-Y59 HydrophobicContact CB-CG 4.38Å; M38-Y59 HydrophobicContact SD-CD2 3.47Å; M38-Y59 WeakPolarHBondContact SD-CD2 3.4Å; M38-Y59 HydrophobicContact SD-CE2 3.71Å; M38-Y59 HydrophobicContact SD-CG 4.32Å; E39-Y59 HydrophobicContact CG-CE1 4.27Å; L42-Y59 HydrophobicContact CD1-CD1 3.57Å; L42-Y59 HydrophobicContact CD1-CG 3.76Å; F46-Y59 HydrophobicContact CD1-CD1 4.18Å; F46-Y59 AromaticContact CE1-CD1 3.26Å; F46-Y59 HydrophobicContact CE1-CD1 3.26Å; F46-Y59 AromaticContact CE1-CE1 3.7Å; F46-Y59 HydrophobicContact CE1-CE1 3.7Å; F46-Y59 HydrophobicContact CE1-CG 4.28Å; F46-Y59 AromaticContact CE2-CD1 3.9Å; F46-Y59 HydrophobicContact CE2-CD1 3.9Å; F46-Y59 HydrophobicContact CE2-CG 4.24Å; F46-Y59 AromaticContact CZ-CD1 3.08Å; F46-Y59 HydrophobicContact CZ-CD1 3.08Å; F46-Y59 AromaticContact CZ-CE1 3.92Å; F46-Y59 HydrophobicContact CZ-CE1 3.92Å; F46-Y59 AromaticContact CZ-CG 3.67Å; F46-Y59 HydrophobicContact CZ-CG 3.67Å; T57-Y59 HydrophobicContact CG2-CD2 3.87Å; T57-Y59 HydrophobicContact CG2-CE1 4.31Å; T57-Y59 HydrophobicContact CG2-CE2 3.3Å; Y59-F74 PolarHBondContact N-O 3.37Å; Y59-F74 PolarHBondContact O-N 3.16Å; Y59-D76 HydrophobicContact CD2-CB 4.32Å; Y59-D76 HydrophobicContact CE2-CB 3.73Å
60	K	88.8	Confident	76.3	Confident	92 Å²	92	71 Å²	71	40%	0.4	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	136.3	175.1	-64.8	-172.4	173.6	178.5	0	111.1	L58 V72	L58-K60 HydrophobicContact CD2-CG 4.41Å; L58-K60 HydrophobicContact CG-CG 4.26Å; K60-V72 CarbonylContact C-O 3.58Å; K60-V72 WeakPolarHBondContact CA-O 3.46Å
61	H	88.6	Confident	78.3	Confident	26 Å²	26	66.3 Å²	66.3	12%	0.12	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.4	176.2	172.4	64.9	0	0	0	110	F41 L42 E45 V72 F74	F41-H61 AromaticContact CE1-CD2 3.87Å; F41-H61 AromaticContact CZ-NE2 3.87Å; L42-H61 HydrophobicContact CD2-CB 3.58Å; E45-H61 IonicContact OE2-CE1 3.24Å; E45-H61 PolarHBondContact OE2-CE1 3.37Å; E45-H61 IonicContact OE2-ND1 2.8Å; E45-H61 PolarHBondContact OE2-ND1 3.31Å; H61-V72 HydrophobicContact CB-CB 4.43Å; H61-V72 PolarHBondContact N-O 2.98Å; H61-V72 PolarHBondContact O-N 3.1Å; H61-F74 HydrophobicContact CB-CD2 4.44Å; H61-F74 HydrophobicContact CB-CE2 3.94Å
62	T	90.3	Very high	80.2	Confident	71 Å²	71	62.7 Å²	62.7	44%	0.436	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.1	173.8	-59.6	0	0	0	0	108.3	T69 V70	T62-T69 HydrophobicContact CG2-CG2 3.28Å; T62-V70 WeakPolarHBondContact CA-O 3.37Å
63	A	88.7	Confident	82.6	Confident	9 Å²	9	57.8 Å²	57.8	7%	0.074	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.6	-179.4	0	0	0	0	0	110.8	V65 V70 V72 I177	A63-V65 HydrophobicContact CB-CG2 4.45Å; A63-V70 HydrophobicContact CB-CG2 4.04Å; A63-V70 PolarHBondContact N-O 3.18Å; A63-V70 WeakPolarHBondContact O-CG2 3.43Å; A63-V70 PolarHBondContact O-N 2.95Å; A63-V72 HydrophobicContact CB-CG2 4.02Å; A63-I177 HydrophobicContact CB-CD1 4.27Å; A63-I177 HydrophobicContact CB-CG2 3.98Å
64	N	88.4	Confident	84.9	Confident	127 Å²	127	52.3 Å²	52.3	68%	0.679	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	115.4	168.6	-67.6	-40.7	0	0	0	109	K68 T69	N64-K68 CarbonylContact C-O 3.41Å; N64-K68 WeakPolarHBondContact CA-O 3.46Å; N64-T69 PolarHBondContact OD1-OG1 3.27Å
65	V	88.4	Confident	86.7	Confident	20 Å²	20	44.4 Å²	44.4	12%	0.121	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	106.8	-179.9	178.7	0	0	0	0	108	A63 N67 K68 V70 I177 N178 V181	A63-V65 HydrophobicContact CB-CG2 4.45Å; V65-N67 PolarHBondContact O-N 3.28Å; V65-K68 PolarHBondContact N-O 2.91Å; V65-K68 PolarHBondContact O-N 3.09Å; V65-K68 VanDerWaalsContact O-N 3.1Å; V65-V70 HydrophobicContact CG2-CG2 3.88Å; V65-I177 HydrophobicContact CG2-CG2 3.69Å; V65-N178 WeakPolarHBondContact CG1-OD1 3.46Å; V65-V181 HydrophobicContact CG1-CB 4.33Å; V65-V181 HydrophobicContact CG1-CG1 4.14Å; V65-V181 HydrophobicContact CG1-CG2 4.5Å; V65-V181 HydrophobicContact CG2-CG2 4.23Å
66	G	85.8	Confident	87.7	Confident	72 Å²	72	43.2 Å²	43.2	74%	0.742	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	-119.6	-168.6	0	0	0	0	0	110.9
67	N	83.9	Confident	87.5	Confident	177 Å²	177	41.8 Å²	41.8	95%	0.947	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	10.8	178.8	-63.3	-10.3	0	0	0	113.2	V65	V65-N67 PolarHBondContact O-N 3.28Å
68	K	84	Confident	86.4	Confident	94 Å²	94	43.6 Å²	43.6	41%	0.409	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144	-178.1	-61.8	-175.9	-176.6	178.1	0	110.8	N64 V65 V70	N64-K68 CarbonylContact C-O 3.41Å; N64-K68 WeakPolarHBondContact CA-O 3.46Å; V65-K68 PolarHBondContact N-O 2.91Å; V65-K68 PolarHBondContact O-N 3.09Å; V65-K68 VanDerWaalsContact O-N 3.1Å; K68-V70 HydrophobicContact CB-CG1 4.45Å
69	T	88.9	Confident	85	Confident	73 Å²	73	43.9 Å²	43.9	45%	0.448	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114	170.9	-61.2	0	0	0	0	107.8	T62 N64	T62-T69 HydrophobicContact CG2-CG2 3.28Å; N64-T69 PolarHBondContact OD1-OG1 3.27Å
70	V	91.5	Very high	83.5	Confident	5 Å²	5	46 Å²	46	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.4	-176.5	-63.2	0	0	0	0	110.7	E20 T62 A63 V65 K68 V72 V181	E20-V70 WeakPolarHBondContact O-CA 3.34Å; E20-V70 WeakPolarHBondContact O-CB 3.38Å; T62-V70 WeakPolarHBondContact CA-O 3.37Å; A63-V70 HydrophobicContact CB-CG2 4.04Å; A63-V70 PolarHBondContact N-O 3.18Å; A63-V70 WeakPolarHBondContact O-CG2 3.43Å; A63-V70 PolarHBondContact O-N 2.95Å; V65-V70 HydrophobicContact CG2-CG2 3.88Å; K68-V70 HydrophobicContact CB-CG1 4.45Å; V70-V72 HydrophobicContact CG2-CG2 4.21Å; V70-V181 HydrophobicContact CB-CG2 4.37Å; V70-V181 HydrophobicContact CG1-CG2 4.08Å; V70-V181 HydrophobicContact CG2-CG2 3.93Å
71	T	92.3	Very high	82.2	Confident	17 Å²	17	42.3 Å²	42.3	10%	0.104	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123	171.2	-59.2	0	0	0	0	108.9	Y16 E20 Q21 V22	Y16-T71 VanDerWaalsContact CD1-OG1 3.25Å; Y16-T71 WeakPolarHBondContact CD1-OG1 3.36Å; Y16-T71 WeakPolarHBondContact CE1-OG1 3.36Å; E20-T71 PolarHBondContact O-N 3.1Å; E20-T71 VanDerWaalsContact O-N 3.09Å; Q21-T71 CarbonylContact C-O 3.59Å; Q21-T71 VanDerWaalsContact CA-O 3.26Å; Q21-T71 WeakPolarHBondContact CA-O 3.46Å; Q21-T71 HydrophobicContact CG-CG2 4.44Å; V22-T71 PolarHBondContact N-O 3.48Å
72	V	93.6	Very high	80.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.3	-179.5	-172.8	0	0	0	0	109.2	V22 I24 K60 H61 A63 V70 F74 I177	V22-V72 HydrophobicContact CG2-CB 4.2Å; V22-V72 HydrophobicContact CG2-CG1 4.14Å; V22-V72 HydrophobicContact CG2-CG2 3.77Å; V22-V72 CarbonylContact O-C 3.57Å; V22-V72 WeakPolarHBondContact O-CA 3.46Å; I24-V72 HydrophobicContact CD1-CG1 3.81Å; I24-V72 HydrophobicContact CG1-CG1 4.14Å; K60-V72 CarbonylContact C-O 3.58Å; K60-V72 WeakPolarHBondContact CA-O 3.46Å; H61-V72 HydrophobicContact CB-CB 4.43Å; H61-V72 PolarHBondContact N-O 2.98Å; H61-V72 PolarHBondContact O-N 3.1Å; A63-V72 HydrophobicContact CB-CG2 4.02Å; V70-V72 HydrophobicContact CG2-CG2 4.21Å; V72-F74 HydrophobicContact CB-CE2 4.1Å; V72-F74 HydrophobicContact CB-CZ 4.34Å; V72-F74 HydrophobicContact CG1-CD1 4.27Å; V72-F74 HydrophobicContact CG1-CD2 4Å; V72-F74 HydrophobicContact CG1-CE1 3.8Å; V72-F74 HydrophobicContact CG1-CE2 3.52Å; V72-F74 HydrophobicContact CG1-CG 4.36Å; V72-F74 HydrophobicContact CG1-CZ 3.42Å; V72-F74 VanDerWaalsContact CG1-CZ 3.42Å; V72-I177 HydrophobicContact CG1-CG1 4.2Å; V72-I177 HydrophobicContact CG2-CD1 4.32Å; V72-I177 HydrophobicContact CG2-CG1 4.1Å; V72-I177 HydrophobicContact CG2-CG2 3.96Å
73	D	93.1	Very high	79.5	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.064	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	105.6	173.5	-85	26.7	0	0	0	109.1	Q21 V22 K23 I24 L58	Q21-D73 PolarHBondContact NE2-OD1 3.4Å; Q21-D73 PolarHBondContact NE2-OD2 3.2Å; V22-D73 PolarHBondContact O-N 3.19Å; K23-D73 CarbonylContact C-O 3.57Å; K23-D73 WeakPolarHBondContact CA-O 3.37Å; I24-D73 PolarHBondContact N-O 3.19Å; L58-D73 HydrophobicContact CD1-CB 3.64Å
74	F	92.2	Very high	78.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.6	171.1	-62.1	-76.6	0	0	0	110.7	I24 M38 F41 L42 Y59 H61 V72 F173 I177	I24-F74 HydrophobicContact CB-CD1 3.77Å; I24-F74 HydrophobicContact CB-CE1 3.93Å; I24-F74 HydrophobicContact CD1-CD1 4.45Å; I24-F74 HydrophobicContact CD1-CE1 3.73Å; I24-F74 HydrophobicContact CD1-CZ 4.37Å; I24-F74 HydrophobicContact CG1-CE1 4.31Å; I24-F74 HydrophobicContact CG2-CD1 4.01Å; I24-F74 HydrophobicContact CG2-CE1 4.07Å; I24-F74 WeakPolarHBondContact O-CA 3.34Å; M38-F74 HydrophobicContact CE-CB 3.92Å; M38-F74 HydrophobicContact CG-CB 4.48Å; M38-F74 HydrophobicContact SD-CB 3.77Å; F41-F74 HydrophobicContact CD1-CE2 4.03Å; F41-F74 HydrophobicContact CD1-CZ 4.09Å; F41-F74 AromaticContact CE1-CE2 3.76Å; F41-F74 HydrophobicContact CE1-CE2 3.76Å; F41-F74 AromaticContact CE1-CZ 3.73Å; F41-F74 HydrophobicContact CE1-CZ 3.73Å; L42-F74 HydrophobicContact CD2-CE2 4.33Å; Y59-F74 PolarHBondContact N-O 3.37Å; Y59-F74 PolarHBondContact O-N 3.16Å; H61-F74 HydrophobicContact CB-CD2 4.44Å; H61-F74 HydrophobicContact CB-CE2 3.94Å; V72-F74 HydrophobicContact CB-CE2 4.1Å; V72-F74 HydrophobicContact CB-CZ 4.34Å; V72-F74 HydrophobicContact CG1-CD1 4.27Å; V72-F74 HydrophobicContact CG1-CD2 4Å; V72-F74 HydrophobicContact CG1-CE1 3.8Å; V72-F74 HydrophobicContact CG1-CE2 3.52Å; V72-F74 HydrophobicContact CG1-CG 4.36Å; V72-F74 HydrophobicContact CG1-CZ 3.42Å; V72-F74 VanDerWaalsContact CG1-CZ 3.42Å; F74-F173 HydrophobicContact CD1-CD1 4.18Å; F74-F173 AromaticContact CD1-CE1 3.84Å; F74-F173 HydrophobicContact CD1-CE1 3.84Å; F74-F173 AromaticContact CE1-CD1 3.41Å; F74-F173 HydrophobicContact CE1-CD1 3.41Å; F74-F173 VanDerWaalsContact CE1-CD1 3.41Å; F74-F173 AromaticContact CE1-CE1 3.56Å; F74-F173 HydrophobicContact CE1-CE1 3.56Å; F74-F173 AromaticContact CZ-CD1 3.69Å; F74-F173 HydrophobicContact CZ-CD1 3.69Å; F74-F173 HydrophobicContact CZ-CE1 4.12Å; F74-I177 HydrophobicContact CZ-CD1 4.05Å; F74-I177 HydrophobicContact CZ-CG1 4.09Å
75	W	89.8	Confident	77.6	Confident	50 Å²	50	57.8 Å²	57.8	19%	0.189	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	117.5	178.7	-72.4	65	0	0	0	110	K23 I24 I25 C26 M38 L51 L56 L58 Y90	K23-W75 HydrophobicContact CD-CG 4.38Å; K23-W75 HydrophobicContact CG-CG 4.36Å; I24-W75 PolarHBondContact O-N 3.49Å; I25-W75 HydrophobicContact CG2-CB 4.15Å; C26-W75 PolarHBondContact N-O 2.88Å; M38-W75 VanDerWaalsContact CE-O 3.3Å; M38-W75 WeakPolarHBondContact CE-O 3.36Å; L51-W75 HydrophobicContact CD1-CH2 4.38Å; L56-W75 HydrophobicContact CB-CE3 4.38Å; L56-W75 HydrophobicContact CB-CZ3 4.48Å; L56-W75 HydrophobicContact CD1-CE3 3.96Å; L56-W75 HydrophobicContact CD1-CZ3 3.78Å; L58-W75 HydrophobicContact CD1-CG 4.4Å; W75-Y90 HydrophobicContact CB-CE2 3.76Å; W75-Y90 HydrophobicContact CE3-CD2 4.4Å; W75-Y90 HydrophobicContact CE3-CE2 4.46Å; W75-Y90 PolarHBondContact O-OH 3.28Å
76	D	83.1	Confident	77.3	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.011	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.5	175.7	-173.7	34.5	0	0	0	110.7	S35 M38 L56 T57 Y59	S35-D76 WeakPolarHBondContact CA-OD2 3.26Å; S35-D76 WeakPolarHBondContact CB-OD2 3.43Å; S35-D76 PolarHBondContact N-OD1 3.12Å; S35-D76 VanDerWaalsContact OG-CG 3.3Å; S35-D76 PolarHBondContact OG-OD1 3.09Å; S35-D76 PolarHBondContact OG-OD2 3.08Å; M38-D76 HydrophobicContact CE-CB 4.02Å; M38-D76 HydrophobicContact SD-CB 3.68Å; L56-D76 WeakPolarHBondContact CA-O 3.41Å; T57-D76 PolarHBondContact N-O 3.47Å; T57-D76 PolarHBondContact O-N 2.94Å; Y59-D76 HydrophobicContact CD2-CB 4.32Å; Y59-D76 HydrophobicContact CE2-CB 3.73Å
77	T	70.1	Confident	77.3	Confident	4 Å²	4	59.3 Å²	59.3	3%	0.025	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	107.3	177.1	70.2	0	0	0	0	108.9	K34 L56 G79 E81 M86 Y90	K34-T77 WeakPolarHBondContact CE-OG1 3.43Å; L56-T77 HydrophobicContact CD2-CG2 4.06Å; T77-G79 VanDerWaalsContact C-N 3.34Å; T77-G79 PolarHBondContact O-N 3.27Å; T77-E81 VanDerWaalsContact O-OE2 3.13Å; T77-E81 PolarHBondContact OG1-OE2 3.43Å; T77-M86 HydrophobicContact CG2-CE 3.34Å; T77-M86 HydrophobicContact CG2-SD 3.73Å; T77-Y90 HydrophobicContact CG2-CD1 4.5Å; T77-Y90 HydrophobicContact CG2-CD2 4.23Å; T77-Y90 HydrophobicContact CG2-CE1 3.83Å; T77-Y90 HydrophobicContact CG2-CE2 3.53Å; T77-Y90 VanDerWaalsContact CG2-OH 3.31Å; T77-Y90 WeakPolarHBondContact CG2-OH 3.5Å
78	A	60.2	Low	77.3	Confident	43 Å²	43	53.5 Å²	53.5	36%	0.355	27%	0.267	S	S	.	.	S	Bend	trans	-83.2	80.9	176.1	0	0	0	0	0	109.4	A55 Q80	A55-A78 PolarHBondContact O-N 3.17Å; A78-Q80 VanDerWaalsContact C-N 3.33Å; A78-Q80 PolarHBondContact O-N 2.81Å
79	G	55.5	Low	77.3	Confident	15 Å²	15	52.3 Å²	52.3	16%	0.155	27%	0.27	C	S	.	.	S	Bend	trans	79.2	3.8	166.7	0	0	0	0	0	116.6	T77 E81 R82	T77-G79 VanDerWaalsContact C-N 3.34Å; T77-G79 PolarHBondContact O-N 3.27Å; G79-E81 WeakPolarHBondContact CA-OE1 3.43Å; G79-E81 WeakPolarHBondContact CA-OE2 3.35Å; G79-E81 PolarHBondContact N-OE2 2.69Å; G79-E81 VanDerWaalsContact N-OE2 3.08Å; G79-R82 WeakPolarHBondContact O-CB 3.22Å; G79-R82 WeakPolarHBondContact O-CG 3.41Å; G79-R82 PolarHBondContact O-N 2.87Å; G79-R82 PolarHBondContact O-NE 2.96Å
80	Q	56.7	Low	77.3	Confident	56 Å²	56	48.9 Å²	48.9	26%	0.262	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-68.8	-23.2	168.5	-81.9	-147.8	-7.2	0	0	112.4	A55 A78 R82 F83 M86	A55-Q80 HydrophobicContact CB-CG 4.44Å; A78-Q80 VanDerWaalsContact C-N 3.33Å; A78-Q80 PolarHBondContact O-N 2.81Å; Q80-R82 PolarHBondContact O-N 3.26Å; Q80-F83 WeakPolarHBondContact O-CD2 3.26Å; Q80-F83 PolarHBondContact O-N 2.89Å; Q80-M86 HydrophobicContact CB-CE 3.88Å; Q80-M86 HydrophobicContact CB-SD 3.74Å
81	E	60.8	Low	77.2	Confident	15 Å²	15	48.7 Å²	48.7	7%	0.07	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-61.6	-10.9	175.9	69.1	-78.3	175.6	0	0	113.7	S30 K34 T77 G79 F83 Q84 W115	S30-E81 VanDerWaalsContact CA-CG 3.47Å; S30-E81 WeakPolarHBondContact CA-OE1 3.4Å; S30-E81 WeakPolarHBondContact CB-OE1 3.13Å; S30-E81 PolarHBondContact OG-OE1 2.83Å; K34-E81 IonicContact NZ-OE1 3.89Å; K34-E81 IonicContact NZ-OE2 3.13Å; T77-E81 VanDerWaalsContact O-OE2 3.13Å; T77-E81 PolarHBondContact OG1-OE2 3.43Å; G79-E81 WeakPolarHBondContact CA-OE1 3.43Å; G79-E81 WeakPolarHBondContact CA-OE2 3.35Å; G79-E81 PolarHBondContact N-OE2 2.69Å; G79-E81 VanDerWaalsContact N-OE2 3.08Å; E81-F83 PolarHBondContact O-N 2.73Å; E81-Q84 PolarHBondContact O-N 2.78Å; E81-Q84 VanDerWaalsContact O-N 3.14Å; E81-W115 HydrophobicContact CB-CH2 3.8Å; E81-W115 HydrophobicContact CB-CZ2 3.88Å
82	R	59.6	Low	77	Confident	183 Å²	183	52.3 Å²	52.3	69%	0.691	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-62	-21.4	170.4	-67.8	-174.9	-68.9	-179.9	-0.8	113.1	G79 Q80 Q84	G79-R82 WeakPolarHBondContact O-CB 3.22Å; G79-R82 WeakPolarHBondContact O-CG 3.41Å; G79-R82 PolarHBondContact O-N 2.87Å; G79-R82 PolarHBondContact O-NE 2.96Å; Q80-R82 PolarHBondContact O-N 3.26Å; R82-Q84 VanDerWaalsContact C-N 3.33Å
83	F	63	Low	76.8	Confident	152 Å²	152	55.8 Å²	55.8	67%	0.667	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-89.6	4.2	176.9	-58.4	-68.5	0	0	0	113.5	Q80 E81 S85	Q80-F83 WeakPolarHBondContact O-CD2 3.26Å; Q80-F83 PolarHBondContact O-N 2.89Å; E81-F83 PolarHBondContact O-N 2.73Å; F83-S85 PolarHBondContact O-N 3.34Å
84	Q	63.1	Low	76.8	Confident	161 Å²	161	55.2 Å²	55.2	75%	0.752	28%	0.276	S	S	*	.	S	Bend	trans	61.4	3.8	178.3	-54.5	179.9	15.9	0	0	115.8	E81 R82	E81-Q84 PolarHBondContact O-N 2.78Å; E81-Q84 VanDerWaalsContact O-N 3.14Å; R82-Q84 VanDerWaalsContact C-N 3.33Å
85	S	73.9	Confident	77	Confident	62 Å²	62	56.3 Å²	56.3	43%	0.434	28%	0.28	S	S	.	.	S	Bend	trans	-148.6	158.8	167.8	61	0	0	0	0	110	F83 E118	F83-S85 PolarHBondContact O-N 3.34Å; S85-E118 WeakPolarHBondContact CA-OE1 3.33Å; S85-E118 WeakPolarHBondContact CA-OE2 3.28Å; S85-E118 WeakPolarHBondContact CB-OE1 3.24Å; S85-E118 WeakPolarHBondContact CB-OE2 3.35Å
86	M	83	Confident	77.4	Confident	7 Å²	7	53.9 Å²	53.9	3%	0.034	27%	0.271	C	S	.	.			trans	-103	153.4	174.6	-68	-60.6	-58.3	0	0	110.4	L27 L56 T77 Q80 Y90 Y91 W115 E118	L27-M86 HydrophobicContact CD2-CG 4.33Å; L56-M86 HydrophobicContact CD2-CE 3.97Å; T77-M86 HydrophobicContact CG2-CE 3.34Å; T77-M86 HydrophobicContact CG2-SD 3.73Å; Q80-M86 HydrophobicContact CB-CE 3.88Å; Q80-M86 HydrophobicContact CB-SD 3.74Å; M86-Y90 HydrophobicContact CB-CD1 4.13Å; M86-Y90 HydrophobicContact CB-CG 4.41Å; M86-Y90 HydrophobicContact CE-CD1 4.18Å; M86-Y90 HydrophobicContact CE-CD2 4.03Å; M86-Y90 HydrophobicContact CE-CE2 4.46Å; M86-Y90 HydrophobicContact CE-CG 3.87Å; M86-Y90 HydrophobicContact CG-CD1 4.09Å; M86-Y91 HydrophobicContact CB-CE2 3.81Å; M86-W115 HydrophobicContact CG-CZ3 4.11Å; M86-E118 PolarHBondContact N-OE1 2.85Å
87	H	84.3	Confident	78.1	Confident	118 Å²	118	53.8 Å²	53.8	55%	0.546	27%	0.271	S	S	.	.			trans	-61.9	137.8	170.7	-172.1	-91.7	0	0	0	110.1	S89 Y90	H87-S89 WeakPolarHBondContact ND1-CB 3.46Å; H87-S89 PolarHBondContact ND1-N 2.53Å; H87-S89 PolarHBondContact ND1-OG 3.22Å; H87-S89 PolarHBondContact O-N 2.9Å; H87-Y90 VanDerWaalsContact O-CB 3.23Å; H87-Y90 WeakPolarHBondContact O-CB 3.41Å; H87-Y90 PolarHBondContact O-N 2.95Å
88	P	84.2	Confident	79.4	Confident	55 Å²	55	53.6 Å²	53.6	36%	0.357	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-51.4	-33.5	-176.3	-30.9	35.7	0	0	0	115	Y90 Y91 H92 Y122	P88-Y90 PolarHBondContact O-N 3.41Å; P88-Y90 VanDerWaalsContact O-N 3.11Å; P88-Y91 PolarHBondContact O-N 3.43Å; P88-H92 PolarHBondContact O-N 3.19Å; P88-Y122 HydrophobicContact CB-CD1 4.29Å; P88-Y122 HydrophobicContact CB-CE1 3.67Å; P88-Y122 HydrophobicContact CG-CE1 4.01Å; P88-Y122 WeakPolarHBondContact CG-OH 3.45Å
89	S	84.2	Confident	81.1	Confident	69 Å²	69	51.6 Å²	51.6	48%	0.483	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-60.4	-20.4	177.3	66.7	0	0	0	0	114	H87 Y91 H92	H87-S89 WeakPolarHBondContact ND1-CB 3.46Å; H87-S89 PolarHBondContact ND1-N 2.53Å; H87-S89 PolarHBondContact ND1-OG 3.22Å; H87-S89 PolarHBondContact O-N 2.9Å; S89-Y91 VanDerWaalsContact C-N 3.34Å; S89-H92 WeakPolarHBondContact O-CB 3.37Å; S89-H92 PolarHBondContact O-N 3.35Å
90	Y	88.3	Confident	83.1	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-65.1	-40	174.7	-176.6	-109.2	0	0	0	111.6	K23 I25 C26 L27 L56 W75 T77 M86 H87 P88	K23-Y90 WeakPolarHBondContact CE-O 3.34Å; K23-Y90 PolarHBondContact NZ-O 3.34Å; I25-Y90 HydrophobicContact CB-CE1 3.76Å; I25-Y90 HydrophobicContact CD1-CD1 4.4Å; I25-Y90 HydrophobicContact CD1-CE1 4.08Å; I25-Y90 HydrophobicContact CG1-CE1 4.42Å; I25-Y90 HydrophobicContact CG2-CE1 4.11Å; I25-Y90 HydrophobicContact CG2-CE2 4.45Å; C26-Y90 PolarHBondContact N-OH 3.12Å; C26-Y90 VanDerWaalsContact N-OH 3.17Å; C26-Y90 PolarHBondContact O-OH 3.07Å; L27-Y90 HydrophobicContact CD2-CD1 4.31Å; L27-Y90 HydrophobicContact CD2-CE1 3.77Å; L56-Y90 HydrophobicContact CD1-CD2 4.1Å; L56-Y90 HydrophobicContact CD2-CD2 3.61Å; L56-Y90 HydrophobicContact CD2-CE2 3.7Å; W75-Y90 HydrophobicContact CB-CE2 3.76Å; W75-Y90 HydrophobicContact CE3-CD2 4.4Å; W75-Y90 HydrophobicContact CE3-CE2 4.46Å; W75-Y90 PolarHBondContact O-OH 3.28Å; T77-Y90 HydrophobicContact CG2-CD1 4.5Å; T77-Y90 HydrophobicContact CG2-CD2 4.23Å; T77-Y90 HydrophobicContact CG2-CE1 3.83Å; T77-Y90 HydrophobicContact CG2-CE2 3.53Å; T77-Y90 VanDerWaalsContact CG2-OH 3.31Å; T77-Y90 WeakPolarHBondContact CG2-OH 3.5Å; M86-Y90 HydrophobicContact CB-CD1 4.13Å; M86-Y90 HydrophobicContact CB-CG 4.41Å; M86-Y90 HydrophobicContact CE-CD1 4.18Å; M86-Y90 HydrophobicContact CE-CD2 4.03Å; M86-Y90 HydrophobicContact CE-CE2 4.46Å; M86-Y90 HydrophobicContact CE-CG 3.87Å; M86-Y90 HydrophobicContact CG-CD1 4.09Å; H87-Y90 VanDerWaalsContact O-CB 3.23Å; H87-Y90 WeakPolarHBondContact O-CB 3.41Å; H87-Y90 PolarHBondContact O-N 2.95Å; P88-Y90 PolarHBondContact O-N 3.41Å; P88-Y90 VanDerWaalsContact O-N 3.11Å
91	Y	91.1	Very high	85	Confident	1 Å²	1	48.3 Å²	48.3	0%	0.004	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-23.3	-180	-59	-75.5	0	0	0	113.5	I25 L27 M86 P88 S89 K93 A94 E118 L119 Y122 R123	I25-Y91 HydrophobicContact CD1-CD1 3.74Å; I25-Y91 HydrophobicContact CD1-CE1 4.16Å; L27-Y91 HydrophobicContact CD1-CE1 3.94Å; L27-Y91 HydrophobicContact CD2-CE1 4.02Å; M86-Y91 HydrophobicContact CB-CE2 3.81Å; P88-Y91 PolarHBondContact O-N 3.43Å; S89-Y91 VanDerWaalsContact C-N 3.34Å; Y91-K93 PolarHBondContact O-N 3.45Å; Y91-A94 VanDerWaalsContact O-CB 3.25Å; Y91-A94 WeakPolarHBondContact O-CB 3.29Å; Y91-A94 PolarHBondContact O-N 2.98Å; Y91-E118 HydrophobicContact CE2-CG 4.18Å; Y91-E118 VanDerWaalsContact OH-CD 3.27Å; Y91-E118 PolarHBondContact OH-OE1 3.06Å; Y91-L119 HydrophobicContact CD1-CD1 3.56Å; Y91-L119 HydrophobicContact CE1-CB 4.26Å; Y91-L119 HydrophobicContact CE1-CD1 3.81Å; Y91-Y122 AromaticContact CD2-CD2 3.38Å; Y91-Y122 HydrophobicContact CD2-CD2 3.38Å; Y91-Y122 AromaticContact CD2-CE2 3.9Å; Y91-Y122 HydrophobicContact CD2-CE2 3.9Å; Y91-Y122 AromaticContact CD2-CG 3.94Å; Y91-Y122 HydrophobicContact CD2-CG 3.94Å; Y91-Y122 AromaticContact CE2-CD2 3.79Å; Y91-Y122 HydrophobicContact CE2-CD2 3.79Å; Y91-Y122 HydrophobicContact CE2-CE2 4.02Å; Y91-Y122 AromaticContact CG-CD2 3.84Å; Y91-Y122 HydrophobicContact CG-CD2 3.84Å; Y91-Y122 HydrophobicContact CG-CG 4.1Å; Y91-R123 WeakPolarHBondContact O-CG 3.21Å
92	H	87.6	Confident	86.7	Confident	92 Å²	92	47.7 Å²	47.7	43%	0.426	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	128.6	-179.5	-178.9	82	0	0	0	111.7	K23 P88 S89 A94 L195	K23-H92 PolarHBondContact NZ-O 3.49Å; P88-H92 PolarHBondContact O-N 3.19Å; S89-H92 WeakPolarHBondContact O-CB 3.37Å; S89-H92 PolarHBondContact O-N 3.35Å; H92-A94 PolarHBondContact O-N 3.48Å; H92-L195 WeakPolarHBondContact CE1-CD2 3.36Å
93	K	88.4	Confident	88.5	Confident	74 Å²	74	39.6 Å²	39.6	32%	0.322	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	24.9	-177.1	-63.6	178.8	-176.8	-178.5	0	114.7	K23 Y91 H95 L195 E199	K23-K93 WeakPolarHBondContact CB-O 3.48Å; Y91-K93 PolarHBondContact O-N 3.45Å; K93-H95 PolarHBondContact O-CE1 3.37Å; K93-H95 PolarHBondContact O-ND1 3.49Å; K93-L195 HydrophobicContact CG-CD1 3.97Å; K93-E199 VanDerWaalsContact CE-OE1 3.22Å; K93-E199 WeakPolarHBondContact CE-OE1 3.46Å; K93-E199 IonicContact NZ-OE1 2.8Å; K93-E199 PolarHBondContact NZ-OE1 3.5Å
94	A	94.3	Very high	89.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.			trans	-70.9	133.3	169.5	0	0	0	0	0	109.7	I25 Y91 H92 R123 I126	I25-A94 HydrophobicContact CD1-CB 3.85Å; I25-A94 HydrophobicContact CG1-CB 4.04Å; I25-A94 HydrophobicContact CG2-CB 3.86Å; Y91-A94 VanDerWaalsContact O-CB 3.25Å; Y91-A94 WeakPolarHBondContact O-CB 3.29Å; Y91-A94 PolarHBondContact O-N 2.98Å; H92-A94 PolarHBondContact O-N 3.48Å; A94-R123 HydrophobicContact CB-CG 4.47Å; A94-R123 PolarHBondContact O-NE 3.02Å; A94-R123 VanDerWaalsContact O-NE 3.09Å; A94-R123 PolarHBondContact O-NH2 2.79Å; A94-R123 VanDerWaalsContact O-NH2 3.1Å; A94-I126 HydrophobicContact CB-CD1 3.98Å; A94-I126 VanDerWaalsContact O-CG2 3.29Å; A94-I126 WeakPolarHBondContact O-CG2 3.29Å
95	H	96	Very high	91.4	Very high	22 Å²	22	34.3 Å²	34.3	10%	0.102	18%	0.175	C	C	.	.			trans	-105.8	-18.8	-179.6	-57.4	81.2	0	0	0	111.9	V22 K23 K93 P127 A180 Y183 K184	V22-H95 HydrophobicContact CB-CB 4.5Å; K23-H95 PolarHBondContact N-ND1 3.08Å; K23-H95 WeakPolarHBondContact O-CB 3.49Å; K23-H95 PolarHBondContact O-N 3.03Å; K93-H95 PolarHBondContact O-CE1 3.37Å; K93-H95 PolarHBondContact O-ND1 3.49Å; H95-P127 VanDerWaalsContact O-CD 3.24Å; H95-P127 WeakPolarHBondContact O-CD 3.02Å; H95-P127 WeakPolarHBondContact O-CG 3.4Å; H95-A180 HydrophobicContact CB-CB 4.11Å; H95-Y183 HydrophobicContact CB-CD1 4.48Å; H95-K184 WeakPolarHBondContact NE2-CD 3.35Å
96	A	97.6	Very high	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	160.1	169.9	0	0	0	0	0	111.2	K23 I24 I25 P127 M176 A180	K23-A96 PolarHBondContact O-N 2.86Å; I24-A96 HydrophobicContact CG1-CB 4.26Å; I24-A96 HydrophobicContact CG2-CB 4.46Å; I25-A96 PolarHBondContact N-O 3.46Å; A96-P127 CarbonylContact C-O 3.6Å; A96-P127 VanDerWaalsContact CA-O 3.26Å; A96-P127 WeakPolarHBondContact CA-O 3.08Å; A96-P127 HydrophobicContact CB-CG 3.94Å; A96-M176 HydrophobicContact CB-CE 3.82Å; A96-A180 HydrophobicContact CB-CB 3.75Å
97	C	97.4	Very high	92.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.2	176.6	179.8	0	0	0	0	112.8	I25 L27 L119 I126 P127 C128 C129	I25-C97 HydrophobicContact CD1-CB 4.32Å; I25-C97 HydrophobicContact CG1-CB 3.88Å; I25-C97 WeakPolarHBondContact O-CA 3.18Å; L27-C97 VanDerWaalsContact CD1-SG 3.52Å; C97-L119 HydrophobicContact CB-CD1 4.42Å; C97-L119 HydrophobicContact CB-CD2 3.6Å; C97-I126 HydrophobicContact CB-CD1 4.08Å; C97-P127 PolarHBondContact N-O 3.23Å; C97-C128 VanDerWaalsContact O-CA 3.24Å; C97-C128 WeakPolarHBondContact O-CA 3.32Å; C97-C129 PolarHBondContact O-N 3.01Å; C97-C129 VanDerWaalsContact O-N 3.09Å
98	I	97.9	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112	171.4	-60.9	167.7	0	0	0	108.4	I24 I25 C26 L27 V100 V131 M172 F173 M176	I24-I98 HydrophobicContact CG2-CD1 3.88Å; I24-I98 HydrophobicContact CG2-CG1 4.15Å; I25-I98 PolarHBondContact O-N 3.16Å; C26-I98 WeakPolarHBondContact CA-O 3.36Å; L27-I98 PolarHBondContact N-O 3.09Å; I98-V100 HydrophobicContact CG2-CG2 3.81Å; I98-V131 HydrophobicContact CG2-CB 4.36Å; I98-V131 HydrophobicContact CG2-CG2 3.62Å; I98-M172 HydrophobicContact CD1-CE 4.42Å; I98-M172 HydrophobicContact CD1-SD 3.82Å; I98-M172 HydrophobicContact CG1-SD 4.2Å; I98-M172 HydrophobicContact CG2-CE 4.39Å; I98-M172 HydrophobicContact CG2-SD 4.07Å; I98-F173 HydrophobicContact CD1-CD1 3.88Å; I98-F173 HydrophobicContact CD1-CE1 3.62Å; I98-F173 HydrophobicContact CD1-CZ 4.28Å; I98-M176 HydrophobicContact CD1-CB 4.29Å; I98-M176 HydrophobicContact CD1-CG 4.26Å; I98-M176 HydrophobicContact CG1-CB 4.34Å; I98-M176 HydrophobicContact CG1-CE 4.44Å; I98-M176 HydrophobicContact CG1-CG 3.95Å
99	M	97.1	Very high	94	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112.4	178.4	-67.1	-173.1	-75.2	0	0	110.7	L27 L112 Y116 C128 C129 V130 V131 F150 L156	L27-M99 HydrophobicContact CB-CG 4.42Å; L27-M99 WeakPolarHBondContact O-CA 3.39Å; M99-L112 HydrophobicContact CB-CD2 4.13Å; M99-Y116 HydrophobicContact CE-CD2 3.59Å; M99-Y116 HydrophobicContact CE-CE2 4.2Å; M99-Y116 HydrophobicContact CE-CG 4.34Å; M99-Y116 HydrophobicContact SD-CD2 3.79Å; M99-Y116 HydrophobicContact SD-CG 4.25Å; M99-C128 HydrophobicContact CE-CB 4.13Å; M99-C129 WeakPolarHBondContact CB-O 3.33Å; M99-C129 PolarHBondContact N-O 3.47Å; M99-V130 HydrophobicContact CE-CG2 3.85Å; M99-V130 CarbonylContact O-C 3.52Å; M99-V130 WeakPolarHBondContact O-CA 3.17Å; M99-V131 PolarHBondContact O-N 2.94Å; M99-F150 HydrophobicContact CE-CE1 4.1Å; M99-L156 HydrophobicContact CE-CD1 3.35Å
100	V	97.1	Very high	94.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.5	-171.8	-169.7	0	0	0	0	110.8	L27 G28 V32 K34 L37 I98 V131 N133	L27-V100 PolarHBondContact O-N 3.43Å; G28-V100 WeakPolarHBondContact CA-O 3.37Å; V32-V100 HydrophobicContact CB-CG1 4.3Å; V32-V100 HydrophobicContact CG2-CB 3.94Å; V32-V100 HydrophobicContact CG2-CG1 3.88Å; K34-V100 HydrophobicContact CG-CB 4.17Å; K34-V100 HydrophobicContact CG-CG2 4.2Å; L37-V100 HydrophobicContact CD1-CG1 3.76Å; L37-V100 HydrophobicContact CD1-CG2 3.9Å; I98-V100 HydrophobicContact CG2-CG2 3.81Å; V100-V131 WeakPolarHBondContact CA-O 3.36Å; V100-V131 HydrophobicContact CG1-CG1 4.39Å; V100-V131 HydrophobicContact CG2-CB 4.28Å; V100-N133 HydrophobicContact CG1-CB 3.79Å
101	F	97	Very high	94.9	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	161.5	166.7	76.9	-83.2	0	0	0	111.3	V103 Y109 L112 V130 V131 A132 N133 F148 F158	F101-V103 HydrophobicContact CE2-CG1 4.15Å; F101-Y109 HydrophobicContact CD1-CD2 4.1Å; F101-Y109 HydrophobicContact CD2-CD2 4.23Å; F101-Y109 HydrophobicContact CD2-CG 4.37Å; F101-Y109 AromaticContact CE1-CD2 3.89Å; F101-Y109 HydrophobicContact CE1-CD2 3.89Å; F101-Y109 HydrophobicContact CE2-CD2 4.03Å; F101-Y109 HydrophobicContact CE2-CG 4.31Å; F101-Y109 HydrophobicContact CG-CD2 4.23Å; F101-Y109 AromaticContact CZ-CD2 3.83Å; F101-Y109 HydrophobicContact CZ-CD2 3.83Å; F101-L112 HydrophobicContact CB-CD1 4.22Å; F101-L112 HydrophobicContact CB-CD2 4.34Å; F101-L112 HydrophobicContact CB-CG 4.34Å; F101-L112 HydrophobicContact CD1-CD1 3.7Å; F101-L112 HydrophobicContact CE1-CD1 4.41Å; F101-L112 HydrophobicContact CG-CD1 4.22Å; F101-V130 HydrophobicContact CD1-CG1 4.13Å; F101-V130 HydrophobicContact CE1-CG1 3.93Å; F101-V131 VanDerWaalsContact CD1-O 3.24Å; F101-V131 WeakPolarHBondContact CD1-O 3.35Å; F101-V131 PolarHBondContact N-O 3.29Å; F101-A132 HydrophobicContact CD1-CB 4.48Å; F101-A132 HydrophobicContact CE1-CB 3.59Å; F101-A132 HydrophobicContact CE2-CB 4.18Å; F101-A132 HydrophobicContact CZ-CB 3.42Å; F101-A132 VanDerWaalsContact CZ-CB 3.42Å; F101-N133 PolarHBondContact O-N 2.9Å; F101-F148 HydrophobicContact CE2-CD1 4.2Å; F101-F148 AromaticContact CE2-CE1 3.64Å; F101-F148 HydrophobicContact CE2-CE1 3.64Å; F101-F148 AromaticContact CE2-CZ 3.95Å; F101-F148 HydrophobicContact CE2-CZ 3.95Å; F101-F148 AromaticContact CZ-CD1 3.73Å; F101-F148 HydrophobicContact CZ-CD1 3.73Å; F101-F148 HydrophobicContact CZ-CD2 4.34Å; F101-F148 AromaticContact CZ-CE1 3.55Å; F101-F148 HydrophobicContact CZ-CE1 3.55Å; F101-F148 HydrophobicContact CZ-CE2 4.19Å; F101-F148 HydrophobicContact CZ-CG 4.11Å; F101-F148 AromaticContact CZ-CZ 3.79Å; F101-F148 HydrophobicContact CZ-CZ 3.79Å; F101-F158 AromaticContact CE1-CE2 3.82Å; F101-F158 HydrophobicContact CE1-CE2 3.82Å; F101-F158 HydrophobicContact CE1-CZ 4.14Å; F101-F158 HydrophobicContact CZ-CE2 4.16Å; F101-F158 HydrophobicContact CZ-CZ 4.13Å
102	D	96.1	Very high	95.1	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.011	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.6	178	177.7	-16.6	0	0	0	109.5	V32 Q104 R105 T108 K134	V32-D102 HydrophobicContact CB-CB 4.32Å; V32-D102 HydrophobicContact CG1-CB 4.12Å; D102-Q104 PolarHBondContact O-N 3.37Å; D102-Q104 VanDerWaalsContact O-N 3.15Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.38Å; D102-Q104 PolarHBondContact OD1-N 2.96Å; D102-R105 HydrophobicContact CB-CB 4.15Å; D102-R105 CarbonylContact O-C 3.58Å; D102-R105 PolarHBondContact O-N 3.03Å; D102-R105 WeakPolarHBondContact OD2-CD 3.23Å; D102-T108 PolarHBondContact N-OG1 3.41Å; D102-T108 PolarHBondContact O-OG1 3.02Å; D102-K134 WeakPolarHBondContact OD2-CD 3.43Å; D102-K134 WeakPolarHBondContact OD2-CE 3.23Å; D102-K134 IonicContact OD2-NZ 2.69Å; D102-K134 PolarHBondContact OD2-NZ 3.47Å
103	V	96.3	Very high	95.5	Very high	14 Å²	14	39.2 Å²	39.2	9%	0.085	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.2	-178	-63.7	0	0	0	0	113.9	F101 A132 N133 K134 I135 A138 V143	F101-V103 HydrophobicContact CE2-CG1 4.15Å; V103-A132 HydrophobicContact CG1-CB 3.64Å; V103-N133 WeakPolarHBondContact CG1-O 3.39Å; V103-N133 WeakPolarHBondContact CG2-O 3.08Å; V103-N133 PolarHBondContact N-O 3.44Å; V103-N133 VanDerWaalsContact N-O 3.11Å; V103-K134 VanDerWaalsContact CG2-O 3.31Å; V103-K134 WeakPolarHBondContact CG2-O 3.47Å; V103-I135 HydrophobicContact CG1-CG2 4.18Å; V103-A138 HydrophobicContact CG2-CB 4.35Å; V103-V143 HydrophobicContact CB-CG2 3.93Å; V103-V143 HydrophobicContact CG1-CG2 4.26Å; V103-V143 HydrophobicContact CG2-CG2 4.05Å
104	Q	93.6	Very high	95.8	Very high	110 Å²	110	40.3 Å²	40.3	51%	0.514	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-22.4	176.6	-55.5	-175.7	-61.5	0	0	111.8	D102 A137	D102-Q104 PolarHBondContact O-N 3.37Å; D102-Q104 VanDerWaalsContact O-N 3.15Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.38Å; D102-Q104 PolarHBondContact OD1-N 2.96Å; Q104-A137 PolarHBondContact NE2-O 2.69Å
105	R	94.1	Very high	95.8	Very high	92 Å²	92	40.8 Å²	40.8	35%	0.347	20%	0.195	S	C	.	.			trans	-114.8	89.3	-173.9	-66.9	173.3	54.9	-154.9	-6	111.4	S30 D102 I107 T108	S30-R105 PolarHBondContact O-NH1 2.95Å; D102-R105 HydrophobicContact CB-CB 4.15Å; D102-R105 CarbonylContact O-C 3.58Å; D102-R105 PolarHBondContact O-N 3.03Å; D102-R105 WeakPolarHBondContact OD2-CD 3.23Å; R105-I107 PolarHBondContact O-N 3.37Å; R105-T108 HydrophobicContact CB-CG2 3.76Å; R105-T108 WeakPolarHBondContact O-CB 3.17Å; R105-T108 PolarHBondContact O-N 3Å; R105-T108 PolarHBondContact O-OG1 3.43Å
106	K	93.6	Very high	95.8	Very high	160 Å²	160	41.1 Å²	41.1	70%	0.696	20%	0.196	S	C	*	.	H	α-helix	trans	-49.8	-33.5	-178.8	-170.1	177.7	-174.5	176.4	0	114.8	T108 Y109 K110	K106-T108 VanDerWaalsContact C-N 3.29Å; K106-T108 PolarHBondContact O-N 3.37Å; K106-Y109 PolarHBondContact O-N 3.37Å; K106-K110 PolarHBondContact O-N 3.02Å
107	I	94.6	Very high	95.7	Very high	88 Å²	88	47.8 Å²	47.8	45%	0.451	23%	0.225	S	C	.	.	H	α-helix	trans	-62.1	-37.1	178.7	-170.4	59.1	0	0	0	112.2	R105 Y109 K110 N111	R105-I107 PolarHBondContact O-N 3.37Å; I107-Y109 VanDerWaalsContact C-N 3.26Å; I107-Y109 PolarHBondContact O-N 2.98Å; I107-K110 HydrophobicContact CD1-CB 4.47Å; I107-K110 HydrophobicContact CD1-CD 4.37Å; I107-K110 WeakPolarHBondContact O-CB 3.44Å; I107-K110 PolarHBondContact O-N 2.95Å; I107-N111 PolarHBondContact O-N 3.15Å
108	T	95.6	Very high	95.5	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-32.9	-179.1	67.9	0	0	0	0	111.7	D29 V32 D102 R105 K106	D29-T108 HydrophobicContact CB-CG2 3.74Å; D29-T108 WeakPolarHBondContact OD2-CA 3.47Å; V32-T108 HydrophobicContact CG1-CG2 3.74Å; D102-T108 PolarHBondContact N-OG1 3.41Å; D102-T108 PolarHBondContact O-OG1 3.02Å; R105-T108 HydrophobicContact CB-CG2 3.76Å; R105-T108 WeakPolarHBondContact O-CB 3.17Å; R105-T108 PolarHBondContact O-N 3Å; R105-T108 PolarHBondContact O-OG1 3.43Å; K106-T108 VanDerWaalsContact C-N 3.29Å; K106-T108 PolarHBondContact O-N 3.37Å
109	Y	96.7	Very high	95.3	Very high	41 Å²	41	49 Å²	49	16%	0.161	23%	0.231	C	C	.	.	H	α-helix	trans	-69.4	-41.8	171.3	174	-106.6	0	0	0	112.4	F101 K106 I107 N111 L112 F148 S149 F150	F101-Y109 HydrophobicContact CD1-CD2 4.1Å; F101-Y109 HydrophobicContact CD2-CD2 4.23Å; F101-Y109 HydrophobicContact CD2-CG 4.37Å; F101-Y109 AromaticContact CE1-CD2 3.89Å; F101-Y109 HydrophobicContact CE1-CD2 3.89Å; F101-Y109 HydrophobicContact CE2-CD2 4.03Å; F101-Y109 HydrophobicContact CE2-CG 4.31Å; F101-Y109 HydrophobicContact CG-CD2 4.23Å; F101-Y109 AromaticContact CZ-CD2 3.83Å; F101-Y109 HydrophobicContact CZ-CD2 3.83Å; K106-Y109 PolarHBondContact O-N 3.37Å; I107-Y109 VanDerWaalsContact C-N 3.26Å; I107-Y109 PolarHBondContact O-N 2.98Å; Y109-N111 VanDerWaalsContact C-N 3.29Å; Y109-N111 PolarHBondContact O-N 2.59Å; Y109-L112 HydrophobicContact CD2-CD1 3.91Å; Y109-L112 HydrophobicContact CE2-CD1 4.39Å; Y109-L112 WeakPolarHBondContact O-CB 3.26Å; Y109-L112 WeakPolarHBondContact O-CG 3.5Å; Y109-L112 PolarHBondContact O-N 2.95Å; Y109-F148 HydrophobicContact CD1-CD1 4.31Å; Y109-F148 AromaticContact CD2-CD1 3.68Å; Y109-F148 HydrophobicContact CD2-CD1 3.68Å; Y109-F148 HydrophobicContact CD2-CE1 4.3Å; Y109-F148 HydrophobicContact CE1-CD1 4.14Å; Y109-F148 HydrophobicContact CE2-CB 3.75Å; Y109-F148 AromaticContact CE2-CD1 3.49Å; Y109-F148 HydrophobicContact CE2-CD1 3.49Å; Y109-F148 VanDerWaalsContact CE2-CD1 3.49Å; Y109-F148 HydrophobicContact CE2-CG 4.03Å; Y109-F148 HydrophobicContact CG-CD1 4.09Å; Y109-F148 HydrophobicContact CG-CE1 4.41Å; Y109-F148 AromaticContact CZ-CD1 3.72Å; Y109-S149 PolarHBondContact OH-N 3.17Å; Y109-F150 HydrophobicContact CE2-CB 3.87Å; Y109-F150 WeakPolarHBondContact OH-CB 3.32Å; Y109-F150 PolarHBondContact OH-N 3.09Å
110	K	95.6	Very high	95.2	Very high	128 Å²	128	51.9 Å²	51.9	56%	0.557	24%	0.242	S	C	*	.	H	α-helix	trans	-62.6	-39.4	178.8	-70.2	-177.4	174.9	-173.6	0	111.6	K106 I107 L112 A113	K106-K110 PolarHBondContact O-N 3.02Å; I107-K110 HydrophobicContact CD1-CB 4.47Å; I107-K110 HydrophobicContact CD1-CD 4.37Å; I107-K110 WeakPolarHBondContact O-CB 3.44Å; I107-K110 PolarHBondContact O-N 2.95Å; K110-L112 PolarHBondContact O-N 2.85Å; K110-A113 PolarHBondContact O-N 2.8Å
111	N	95.2	Very high	95	Very high	44 Å²	44	57.7 Å²	57.7	24%	0.235	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-15	-178.7	-70.3	-11.7	0	0	0	113.4	D29 I107 Y109 A113 N114 W115	D29-N111 VanDerWaalsContact OD1-CB 3.27Å; D29-N111 WeakPolarHBondContact OD1-CB 3.21Å; D29-N111 PolarHBondContact OD1-ND2 2.95Å; D29-N111 PolarHBondContact OD2-ND2 3.27Å; I107-N111 PolarHBondContact O-N 3.15Å; Y109-N111 VanDerWaalsContact C-N 3.29Å; Y109-N111 PolarHBondContact O-N 2.59Å; N111-A113 PolarHBondContact O-N 3Å; N111-A113 VanDerWaalsContact O-N 3.16Å; N111-N114 WeakPolarHBondContact O-CB 3.35Å; N111-N114 PolarHBondContact O-N 3.14Å; N111-W115 PolarHBondContact O-N 2.93Å; N111-W115 VanDerWaalsContact O-N 3.13Å
112	L	95.6	Very high	94.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.3	-31.7	174.7	-66.5	-175.5	0	0	0	113.1	M99 F101 Y109 K110 N114 W115 Y116 V130 F150	M99-L112 HydrophobicContact CB-CD2 4.13Å; F101-L112 HydrophobicContact CB-CD1 4.22Å; F101-L112 HydrophobicContact CB-CD2 4.34Å; F101-L112 HydrophobicContact CB-CG 4.34Å; F101-L112 HydrophobicContact CD1-CD1 3.7Å; F101-L112 HydrophobicContact CE1-CD1 4.41Å; F101-L112 HydrophobicContact CG-CD1 4.22Å; Y109-L112 HydrophobicContact CD2-CD1 3.91Å; Y109-L112 HydrophobicContact CE2-CD1 4.39Å; Y109-L112 WeakPolarHBondContact O-CB 3.26Å; Y109-L112 WeakPolarHBondContact O-CG 3.5Å; Y109-L112 PolarHBondContact O-N 2.95Å; K110-L112 PolarHBondContact O-N 2.85Å; L112-N114 VanDerWaalsContact C-N 3.28Å; L112-N114 PolarHBondContact O-N 2.92Å; L112-W115 PolarHBondContact O-N 2.84Å; L112-Y116 WeakPolarHBondContact O-CB 3.39Å; L112-Y116 PolarHBondContact O-N 3.18Å; L112-V130 HydrophobicContact CD1-CG1 3.77Å; L112-F150 HydrophobicContact CB-CD1 4.22Å; L112-F150 HydrophobicContact CB-CE1 3.98Å; L112-F150 HydrophobicContact CB-CZ 4.32Å; L112-F150 HydrophobicContact CD1-CD1 4.29Å
113	A	95.9	Very high	94.7	Very high	46 Å²	46	61.5 Å²	61.5	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-63.3	-36.3	176.5	0	0	0	0	0	112.1	K110 N111 K117 F150	K110-A113 PolarHBondContact O-N 2.8Å; N111-A113 PolarHBondContact O-N 3Å; N111-A113 VanDerWaalsContact O-N 3.16Å; A113-K117 WeakPolarHBondContact O-CB 3.25Å; A113-K117 PolarHBondContact O-N 3.23Å; A113-F150 HydrophobicContact CB-CE2 4.08Å
114	N	94.6	Very high	94.5	Very high	98 Å²	98	63.2 Å²	63.2	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-72.4	-48.3	177.5	-60	-18.1	0	0	0	110.2	N111 L112 Y116 K117 E118	N111-N114 WeakPolarHBondContact O-CB 3.35Å; N111-N114 PolarHBondContact O-N 3.14Å; L112-N114 VanDerWaalsContact C-N 3.28Å; L112-N114 PolarHBondContact O-N 2.92Å; N114-Y116 VanDerWaalsContact C-N 3.26Å; N114-Y116 PolarHBondContact O-N 2.69Å; N114-K117 PolarHBondContact O-N 3.46Å; N114-K117 VanDerWaalsContact O-N 3.16Å; N114-E118 PolarHBondContact O-N 3.07Å
115	W	94.5	Very high	94.5	Very high	9 Å²	9	63 Å²	63	3%	0.034	29%	0.294	C	S	.	.	H	α-helix	trans	-56.1	-42	176	-68.7	118.7	0	0	0	112.4	L27 D29 E81 M86 N111 L112 L119	L27-W115 HydrophobicContact CB-CB 4.37Å; L27-W115 HydrophobicContact CD1-CB 4.5Å; L27-W115 HydrophobicContact CD2-CE3 4.21Å; D29-W115 PolarHBondContact OD1-NE1 3.02Å; E81-W115 HydrophobicContact CB-CH2 3.8Å; E81-W115 HydrophobicContact CB-CZ2 3.88Å; M86-W115 HydrophobicContact CG-CZ3 4.11Å; N111-W115 PolarHBondContact O-N 2.93Å; N111-W115 VanDerWaalsContact O-N 3.13Å; L112-W115 PolarHBondContact O-N 2.84Å; W115-L119 VanDerWaalsContact O-CB 3.31Å; W115-L119 WeakPolarHBondContact O-CB 3.41Å; W115-L119 PolarHBondContact O-N 2.87Å
116	Y	96	Very high	94.6	Very high	30 Å²	30	58.7 Å²	58.7	12%	0.118	28%	0.278	C	S	.	.	H	α-helix	trans	-69.9	-41.2	178.2	-174.3	-113.1	0	0	0	112.3	M99 L112 N114 L119 R120 F150 Q154 L156	M99-Y116 HydrophobicContact CE-CD2 3.59Å; M99-Y116 HydrophobicContact CE-CE2 4.2Å; M99-Y116 HydrophobicContact CE-CG 4.34Å; M99-Y116 HydrophobicContact SD-CD2 3.79Å; M99-Y116 HydrophobicContact SD-CG 4.25Å; L112-Y116 WeakPolarHBondContact O-CB 3.39Å; L112-Y116 PolarHBondContact O-N 3.18Å; N114-Y116 VanDerWaalsContact C-N 3.26Å; N114-Y116 PolarHBondContact O-N 2.69Å; Y116-L119 PolarHBondContact O-N 3.17Å; Y116-R120 HydrophobicContact CD1-CG 4.42Å; Y116-R120 HydrophobicContact CD2-CG 4.41Å; Y116-R120 HydrophobicContact CE1-CG 4.11Å; Y116-R120 HydrophobicContact CE2-CG 4.1Å; Y116-R120 VanDerWaalsContact CE2-NE 3.31Å; Y116-R120 VanDerWaalsContact O-CG 3.27Å; Y116-R120 WeakPolarHBondContact O-CG 3.15Å; Y116-R120 PolarHBondContact O-N 3.15Å; Y116-R120 PolarHBondContact OH-NE 3.37Å; Y116-R120 PolarHBondContact OH-NH2 3.32Å; Y116-F150 HydrophobicContact CD1-CZ 4.1Å; Y116-F150 AromaticContact CG-CZ 3.92Å; Y116-F150 HydrophobicContact CG-CZ 3.92Å; Y116-Q154 HydrophobicContact CD1-CG 4.33Å; Y116-Q154 HydrophobicContact CE1-CB 4.34Å; Y116-Q154 HydrophobicContact CE1-CG 3.97Å; Y116-L156 HydrophobicContact CD2-CD1 4.3Å; Y116-L156 HydrophobicContact CE2-CD1 3.91Å; Y116-L156 HydrophobicContact CE2-CD2 4.5Å
117	K	95.4	Very high	94.8	Very high	140 Å²	140	52.2 Å²	52.2	61%	0.609	25%	0.252	S	S	*	.	H	α-helix	trans	-59.3	-51.6	175.5	-177.2	-172.4	171	-167.8	0	110.6	A113 N114 L119 R120 E121	A113-K117 WeakPolarHBondContact O-CB 3.25Å; A113-K117 PolarHBondContact O-N 3.23Å; N114-K117 PolarHBondContact O-N 3.46Å; N114-K117 VanDerWaalsContact O-N 3.16Å; K117-L119 VanDerWaalsContact C-N 3.34Å; K117-L119 PolarHBondContact O-N 2.78Å; K117-R120 PolarHBondContact O-N 3.25Å; K117-R120 VanDerWaalsContact O-N 3.16Å; K117-E121 WeakPolarHBondContact CE-OE1 3.38Å; K117-E121 PolarHBondContact O-N 3.31Å
118	E	93.5	Very high	94.9	Very high	25 Å²	25	48.2 Å²	48.2	12%	0.117	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-44.7	178.4	-177	179	153.5	0	0	111.6	S85 M86 Y91 N114 R120 E121 Y122	S85-E118 WeakPolarHBondContact CA-OE1 3.33Å; S85-E118 WeakPolarHBondContact CA-OE2 3.28Å; S85-E118 WeakPolarHBondContact CB-OE1 3.24Å; S85-E118 WeakPolarHBondContact CB-OE2 3.35Å; M86-E118 PolarHBondContact N-OE1 2.85Å; Y91-E118 HydrophobicContact CE2-CG 4.18Å; Y91-E118 VanDerWaalsContact OH-CD 3.27Å; Y91-E118 PolarHBondContact OH-OE1 3.06Å; N114-E118 PolarHBondContact O-N 3.07Å; E118-R120 VanDerWaalsContact C-N 3.3Å; E118-R120 PolarHBondContact O-N 3.27Å; E118-E121 WeakPolarHBondContact O-CB 3.36Å; E118-E121 PolarHBondContact O-N 2.86Å; E118-E121 VanDerWaalsContact O-N 3.14Å; E118-Y122 HydrophobicContact CG-CE2 4.21Å; E118-Y122 VanDerWaalsContact O-CD2 3.3Å; E118-Y122 WeakPolarHBondContact O-CD2 3.26Å
119	L	94.3	Very high	95.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.4	-46.2	175.3	175	63.2	0	0	0	112.1	I25 L27 Y91 C97 W115 Y116 K117 E121 Y122 R123 I126 C128	I25-L119 HydrophobicContact CD1-CD1 3.93Å; L27-L119 HydrophobicContact CD1-CB 3.98Å; L27-L119 HydrophobicContact CD1-CD1 4.36Å; L27-L119 HydrophobicContact CD1-CD2 4.26Å; L27-L119 HydrophobicContact CD1-CG 4.45Å; Y91-L119 HydrophobicContact CD1-CD1 3.56Å; Y91-L119 HydrophobicContact CE1-CB 4.26Å; Y91-L119 HydrophobicContact CE1-CD1 3.81Å; C97-L119 HydrophobicContact CB-CD1 4.42Å; C97-L119 HydrophobicContact CB-CD2 3.6Å; W115-L119 VanDerWaalsContact O-CB 3.31Å; W115-L119 WeakPolarHBondContact O-CB 3.41Å; W115-L119 PolarHBondContact O-N 2.87Å; Y116-L119 PolarHBondContact O-N 3.17Å; K117-L119 VanDerWaalsContact C-N 3.34Å; K117-L119 PolarHBondContact O-N 2.78Å; L119-E121 PolarHBondContact O-N 2.79Å; L119-Y122 PolarHBondContact O-N 3.43Å; L119-Y122 VanDerWaalsContact O-N 3.09Å; L119-R123 HydrophobicContact CD1-CB 4.21Å; L119-R123 PolarHBondContact O-N 2.92Å; L119-I126 HydrophobicContact CD1-CD1 3.98Å; L119-C128 WeakPolarHBondContact CD2-SG 3.46Å
120	R	95.1	Very high	95.1	Very high	60 Å²	60	46.2 Å²	46.2	23%	0.226	22%	0.224	C	C	.	.	H	α-helix	trans	-70	-18.1	-177.5	-68.2	-62.9	-175.1	-150.9	6.2	113.3	Y116 K117 E118 Y122 R123 P124 I126	Y116-R120 HydrophobicContact CD1-CG 4.42Å; Y116-R120 HydrophobicContact CD2-CG 4.41Å; Y116-R120 HydrophobicContact CE1-CG 4.11Å; Y116-R120 HydrophobicContact CE2-CG 4.1Å; Y116-R120 VanDerWaalsContact CE2-NE 3.31Å; Y116-R120 VanDerWaalsContact O-CG 3.27Å; Y116-R120 WeakPolarHBondContact O-CG 3.15Å; Y116-R120 PolarHBondContact O-N 3.15Å; Y116-R120 PolarHBondContact OH-NE 3.37Å; Y116-R120 PolarHBondContact OH-NH2 3.32Å; K117-R120 PolarHBondContact O-N 3.25Å; K117-R120 VanDerWaalsContact O-N 3.16Å; E118-R120 VanDerWaalsContact C-N 3.3Å; E118-R120 PolarHBondContact O-N 3.27Å; R120-Y122 VanDerWaalsContact C-N 3.29Å; R120-R123 PolarHBondContact NH1-O 2.8Å; R120-P124 WeakPolarHBondContact CD-O 3.36Å; R120-P124 PolarHBondContact NE-O 3.15Å; R120-P124 PolarHBondContact NH1-O 2.8Å; R120-I126 PolarHBondContact NH1-O 3Å
121	E	92.9	Very high	95.3	Very high	122 Å²	122	40.1 Å²	40.1	57%	0.57	20%	0.197	S	C	*	.	H	α-helix	trans	-69.1	-28.5	170.3	-67.8	174.6	-170	0	0	112.1	K117 E118 L119	K117-E121 WeakPolarHBondContact CE-OE1 3.38Å; K117-E121 PolarHBondContact O-N 3.31Å; E118-E121 WeakPolarHBondContact O-CB 3.36Å; E118-E121 PolarHBondContact O-N 2.86Å; E118-E121 VanDerWaalsContact O-N 3.14Å; L119-E121 PolarHBondContact O-N 2.79Å
122	Y	91.6	Very high	95.4	Very high	80 Å²	80	38 Å²	38	31%	0.314	19%	0.186	S	C	.	.	H	α-helix	trans	-106.9	-31.1	-177.9	-62.8	-69.3	0	0	0	114.5	P88 Y91 E118 L119 R120	P88-Y122 HydrophobicContact CB-CD1 4.29Å; P88-Y122 HydrophobicContact CB-CE1 3.67Å; P88-Y122 HydrophobicContact CG-CE1 4.01Å; P88-Y122 WeakPolarHBondContact CG-OH 3.45Å; Y91-Y122 AromaticContact CD2-CD2 3.38Å; Y91-Y122 HydrophobicContact CD2-CD2 3.38Å; Y91-Y122 AromaticContact CD2-CE2 3.9Å; Y91-Y122 HydrophobicContact CD2-CE2 3.9Å; Y91-Y122 AromaticContact CD2-CG 3.94Å; Y91-Y122 HydrophobicContact CD2-CG 3.94Å; Y91-Y122 AromaticContact CE2-CD2 3.79Å; Y91-Y122 HydrophobicContact CE2-CD2 3.79Å; Y91-Y122 HydrophobicContact CE2-CE2 4.02Å; Y91-Y122 AromaticContact CG-CD2 3.84Å; Y91-Y122 HydrophobicContact CG-CD2 3.84Å; Y91-Y122 HydrophobicContact CG-CG 4.1Å; E118-Y122 HydrophobicContact CG-CE2 4.21Å; E118-Y122 VanDerWaalsContact O-CD2 3.3Å; E118-Y122 WeakPolarHBondContact O-CD2 3.26Å; L119-Y122 PolarHBondContact O-N 3.43Å; L119-Y122 VanDerWaalsContact O-N 3.09Å; R120-Y122 VanDerWaalsContact C-N 3.29Å
123	R	94.2	Very high	95.5	Very high	5 Å²	5	38.2 Å²	38.2	2%	0.019	19%	0.187	C	C	.	.			trans	-140.8	74.5	-175.1	-62.7	-60.1	-65.9	179.3	1.4	110.2	Y91 A94 L119 R120 E125 I126 Y183 D192	Y91-R123 WeakPolarHBondContact O-CG 3.21Å; A94-R123 HydrophobicContact CB-CG 4.47Å; A94-R123 PolarHBondContact O-NE 3.02Å; A94-R123 VanDerWaalsContact O-NE 3.09Å; A94-R123 PolarHBondContact O-NH2 2.79Å; A94-R123 VanDerWaalsContact O-NH2 3.1Å; L119-R123 HydrophobicContact CD1-CB 4.21Å; L119-R123 PolarHBondContact O-N 2.92Å; R120-R123 PolarHBondContact NH1-O 2.8Å; R123-E125 VanDerWaalsContact C-N 3.27Å; R123-E125 PolarHBondContact O-N 3.45Å; R123-I126 HydrophobicContact CB-CB 4.46Å; R123-I126 HydrophobicContact CB-CD1 3.88Å; R123-I126 HydrophobicContact CB-CG1 3.85Å; R123-I126 HydrophobicContact CB-CG2 3.88Å; R123-I126 HydrophobicContact CG-CD1 4.34Å; R123-I126 HydrophobicContact CG-CG2 4.41Å; R123-Y183 PolarHBondContact NH2-OH 3.02Å; R123-D192 IonicContact CZ-OD1 3.76Å; R123-D192 IonicContact CZ-OD2 2.63Å; R123-D192 IonicContact NH1-OD1 3.62Å; R123-D192 PolarHBondContact NH1-OD1 2.98Å; R123-D192 IonicContact NH1-OD2 3.05Å; R123-D192 IonicContact NH2-OD1 2.95Å; R123-D192 PolarHBondContact NH2-OD1 2.91Å; R123-D192 IonicContact NH2-OD2 2.69Å; R123-D192 PolarHBondContact NH2-OD2 3.14Å
124	P	92.2	Very high	95.5	Very high	49 Å²	49	38.5 Å²	38.5	32%	0.318	18%	0.18	S	C	.	.	S	Bend	trans	-57.5	-33.7	-173.9	20.4	-34.9	0	0	0	114.2	R120 D189	R120-P124 WeakPolarHBondContact CD-O 3.36Å; R120-P124 PolarHBondContact NE-O 3.15Å; R120-P124 PolarHBondContact NH1-O 2.8Å; P124-D189 WeakPolarHBondContact CD-OD2 3.33Å; P124-D189 VanDerWaalsContact CG-OD1 3.32Å; P124-D189 WeakPolarHBondContact CG-OD1 3.41Å; P124-D189 WeakPolarHBondContact CG-OD2 3.4Å
125	E	93.3	Very high	95.6	Very high	107 Å²	107	35 Å²	35	50%	0.5	16%	0.16	S	C	.	.	S	Bend	trans	-111.1	-6.7	-167.4	-61.6	-60.5	146.3	0	0	115	R123 Y183 S188 D189	R123-E125 VanDerWaalsContact C-N 3.27Å; R123-E125 PolarHBondContact O-N 3.45Å; E125-Y183 HydrophobicContact CB-CE2 4.1Å; E125-S188 WeakPolarHBondContact CB-OG 3.3Å; E125-D189 HydrophobicContact CB-CB 4.12Å; E125-D189 HydrophobicContact CG-CB 4.34Å
126	I	96.3	Very high	95.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	18%	0.178	C	C	.	.			trans	-63.2	143.2	-173.8	69.9	168	0	0	0	112	A94 C97 L119 R120 R123 C128 Y183	A94-I126 HydrophobicContact CB-CD1 3.98Å; A94-I126 VanDerWaalsContact O-CG2 3.29Å; A94-I126 WeakPolarHBondContact O-CG2 3.29Å; C97-I126 HydrophobicContact CB-CD1 4.08Å; L119-I126 HydrophobicContact CD1-CD1 3.98Å; R120-I126 PolarHBondContact NH1-O 3Å; R123-I126 HydrophobicContact CB-CB 4.46Å; R123-I126 HydrophobicContact CB-CD1 3.88Å; R123-I126 HydrophobicContact CB-CG1 3.85Å; R123-I126 HydrophobicContact CB-CG2 3.88Å; R123-I126 HydrophobicContact CG-CD1 4.34Å; R123-I126 HydrophobicContact CG-CG2 4.41Å; I126-C128 PolarHBondContact O-N 3.14Å; I126-C128 PolarHBondContact O-SG 3.08Å; I126-Y183 HydrophobicContact CG2-CD1 4.46Å; I126-Y183 HydrophobicContact CG2-CE1 3.83Å; I126-Y183 HydrophobicContact CG2-CE2 4.17Å
127	P	97.3	Very high	95.2	Very high	23 Å²	23	38.7 Å²	38.7	15%	0.149	19%	0.189	C	C	.	.			trans	-61.4	135	176	23	-34.5	0	0	0	111.4	H95 A96 C97 R179 Y183	H95-P127 VanDerWaalsContact O-CD 3.24Å; H95-P127 WeakPolarHBondContact O-CD 3.02Å; H95-P127 WeakPolarHBondContact O-CG 3.4Å; A96-P127 CarbonylContact C-O 3.6Å; A96-P127 VanDerWaalsContact CA-O 3.26Å; A96-P127 WeakPolarHBondContact CA-O 3.08Å; A96-P127 HydrophobicContact CB-CG 3.94Å; C97-P127 PolarHBondContact N-O 3.23Å; P127-R179 HydrophobicContact CB-CB 3.85Å; P127-R179 HydrophobicContact CG-CB 3.98Å; P127-Y183 HydrophobicContact CG-CG 4.4Å
128	C	97.9	Very high	94.6	Very high	4 Å²	4	33 Å²	33	3%	0.027	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.9	-179.7	-61.4	0	0	0	0	111.1	C97 M99 L119 I126 L156 P157	C97-C128 VanDerWaalsContact O-CA 3.24Å; C97-C128 WeakPolarHBondContact O-CA 3.32Å; M99-C128 HydrophobicContact CE-CB 4.13Å; L119-C128 WeakPolarHBondContact CD2-SG 3.46Å; I126-C128 PolarHBondContact O-N 3.14Å; I126-C128 PolarHBondContact O-SG 3.08Å; C128-L156 HydrophobicContact CB-CD1 4.39Å; C128-L156 HydrophobicContact CB-CD2 4Å; C128-P157 WeakPolarHBondContact O-CD 3.44Å
129	C	98.1	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	160	164.8	74.6	0	0	0	0	111.7	C97 M99 P157 Y159 M176	C97-C129 PolarHBondContact O-N 3.01Å; C97-C129 VanDerWaalsContact O-N 3.09Å; M99-C129 WeakPolarHBondContact CB-O 3.33Å; M99-C129 PolarHBondContact N-O 3.47Å; C129-P157 WeakPolarHBondContact CA-O 3.18Å; C129-P157 HydrophobicContact CB-CB 4.11Å; C129-Y159 HydrophobicContact CB-CD2 4.25Å; C129-Y159 HydrophobicContact CB-CE2 4.11Å; C129-M176 HydrophobicContact CB-CE 4.37Å; C129-M176 HydrophobicContact CB-SD 3.54Å; C129-M176 VanDerWaalsContact CB-SD 3.54Å; C129-M176 PolarHBondContact SG-SD 3.31Å
130	V	98.3	Very high	93.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.8	173.9	178.3	0	0	0	0	109.3	M99 F101 L112 F150 A151 L156 P157 F158 Y159	M99-V130 HydrophobicContact CE-CG2 3.85Å; M99-V130 CarbonylContact O-C 3.52Å; M99-V130 WeakPolarHBondContact O-CA 3.17Å; F101-V130 HydrophobicContact CD1-CG1 4.13Å; F101-V130 HydrophobicContact CE1-CG1 3.93Å; L112-V130 HydrophobicContact CD1-CG1 3.77Å; V130-F150 HydrophobicContact CG2-CD1 3.9Å; V130-F150 HydrophobicContact CG2-CE1 3.93Å; V130-A151 HydrophobicContact CB-CB 3.97Å; V130-A151 HydrophobicContact CG2-CB 3.86Å; V130-L156 HydrophobicContact CG2-CB 4.38Å; V130-L156 HydrophobicContact CG2-CD1 4.04Å; V130-P157 PolarHBondContact N-O 3.3Å; V130-F158 HydrophobicContact CB-CD2 3.86Å; V130-F158 HydrophobicContact CB-CE2 4.47Å; V130-F158 HydrophobicContact CG1-CD2 3.64Å; V130-F158 HydrophobicContact CG1-CE2 3.75Å; V130-F158 CarbonylContact O-C 3.53Å; V130-F158 VanDerWaalsContact O-CA 3.29Å; V130-F158 WeakPolarHBondContact O-CA 3.35Å; V130-Y159 PolarHBondContact O-N 3.01Å
131	V	98.3	Very high	92.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	116.6	-173.8	177.5	0	0	0	0	109.9	L37 I98 M99 V100 F101 Y159 V161 M172	L37-V131 HydrophobicContact CD1-CG1 4.15Å; I98-V131 HydrophobicContact CG2-CB 4.36Å; I98-V131 HydrophobicContact CG2-CG2 3.62Å; M99-V131 PolarHBondContact O-N 2.94Å; V100-V131 WeakPolarHBondContact CA-O 3.36Å; V100-V131 HydrophobicContact CG1-CG1 4.39Å; V100-V131 HydrophobicContact CG2-CB 4.28Å; F101-V131 VanDerWaalsContact CD1-O 3.24Å; F101-V131 WeakPolarHBondContact CD1-O 3.35Å; F101-V131 PolarHBondContact N-O 3.29Å; V131-Y159 WeakPolarHBondContact CA-O 3.46Å; V131-V161 HydrophobicContact CG1-CB 4.2Å; V131-V161 HydrophobicContact CG1-CG1 3.93Å; V131-V161 HydrophobicContact CG1-CG2 3.17Å; V131-M172 HydrophobicContact CG2-CE 4.36Å; V131-M172 HydrophobicContact CG2-CG 3.94Å; V131-M172 HydrophobicContact CG2-SD 4.07Å
132	A	98	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	97.5	171.3	0	0	0	0	0	109.3	F101 V103 F158 Y159 F160 V161	F101-A132 HydrophobicContact CD1-CB 4.48Å; F101-A132 HydrophobicContact CE1-CB 3.59Å; F101-A132 HydrophobicContact CE2-CB 4.18Å; F101-A132 HydrophobicContact CZ-CB 3.42Å; F101-A132 VanDerWaalsContact CZ-CB 3.42Å; V103-A132 HydrophobicContact CG1-CB 3.64Å; A132-F158 HydrophobicContact CB-CE1 4.04Å; A132-F158 HydrophobicContact CB-CE2 4.3Å; A132-F158 HydrophobicContact CB-CZ 3.51Å; A132-Y159 PolarHBondContact N-O 2.61Å; A132-F160 HydrophobicContact CB-CD1 3.63Å; A132-F160 HydrophobicContact CB-CE1 3.94Å; A132-F160 HydrophobicContact CB-CG 4.49Å; A132-V161 PolarHBondContact O-N 3.49Å
133	N	97.8	Very high	91.8	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	163.7	-177.2	-168.9	30.1	0	0	0	112.3	V32 L37 V100 F101 V103 V161 A163	V32-N133 PolarHBondContact O-ND2 2.78Å; L37-N133 HydrophobicContact CD1-CB 4.38Å; V100-N133 HydrophobicContact CG1-CB 3.79Å; F101-N133 PolarHBondContact O-N 2.9Å; V103-N133 WeakPolarHBondContact CG1-O 3.39Å; V103-N133 WeakPolarHBondContact CG2-O 3.08Å; V103-N133 PolarHBondContact N-O 3.44Å; V103-N133 VanDerWaalsContact N-O 3.11Å; N133-V161 CarbonylContact C-O 3.49Å; N133-V161 WeakPolarHBondContact CA-O 3.24Å; N133-V161 HydrophobicContact CB-CG2 3.95Å; N133-V161 PolarHBondContact OD1-O 2.62Å; N133-A163 PolarHBondContact OD1-N 3.15Å
134	K	96.4	Very high	91.4	Very high	53 Å²	53	44.5 Å²	44.5	23%	0.23	26%	0.255	C	S	.	.			trans	67.3	35.2	179.2	-46.5	-170.6	-167.3	169.8	0	114.2	A31 D102 V103 D136 A137 V161	A31-K134 WeakPolarHBondContact O-CE 3.3Å; A31-K134 PolarHBondContact O-NZ 2.91Å; D102-K134 WeakPolarHBondContact OD2-CD 3.43Å; D102-K134 WeakPolarHBondContact OD2-CE 3.23Å; D102-K134 IonicContact OD2-NZ 2.69Å; D102-K134 PolarHBondContact OD2-NZ 3.47Å; V103-K134 VanDerWaalsContact CG2-O 3.31Å; V103-K134 WeakPolarHBondContact CG2-O 3.47Å; K134-D136 WeakPolarHBondContact CA-OD1 3.43Å; K134-D136 PolarHBondContact O-N 3.03Å; K134-A137 HydrophobicContact CB-CB 4.4Å; K134-A137 PolarHBondContact O-N 3.46Å; K134-A137 VanDerWaalsContact O-N 3.13Å; K134-V161 PolarHBondContact N-O 2.87Å
135	I	95.9	Very high	91.1	Very high	23 Å²	23	48.9 Å²	48.9	12%	0.118	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-62.7	-25.4	176.5	65.4	-179.2	0	0	0	112.7	V103 A137 A138 V143 T144 F160 V161 T167	V103-I135 HydrophobicContact CG1-CG2 4.18Å; I135-A137 VanDerWaalsContact C-N 3.29Å; I135-A137 PolarHBondContact O-N 3.31Å; I135-A138 WeakPolarHBondContact O-CB 3.25Å; I135-A138 PolarHBondContact O-N 2.9Å; I135-V143 HydrophobicContact CB-CG1 4.22Å; I135-T144 HydrophobicContact CD1-CG2 4.38Å; I135-F160 HydrophobicContact CD1-CB 4.15Å; I135-F160 HydrophobicContact CG2-CB 4.08Å; I135-F160 HydrophobicContact CG2-CD1 3.81Å; I135-F160 HydrophobicContact CG2-CG 4.42Å; I135-V161 WeakPolarHBondContact CG1-O 3.5Å; I135-V161 PolarHBondContact N-O 2.91Å; I135-T167 HydrophobicContact CD1-CG2 3.84Å
136	D	92.9	Very high	90.7	Very high	76 Å²	76	49.3 Å²	49.3	41%	0.406	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-62.2	-34.5	173.7	57.1	-75.5	0	0	0	112.8	K134 A138 S162	K134-D136 WeakPolarHBondContact CA-OD1 3.43Å; K134-D136 PolarHBondContact O-N 3.03Å; D136-A138 VanDerWaalsContact C-N 3.32Å; D136-S162 WeakPolarHBondContact OD1-CB 3.33Å; D136-S162 PolarHBondContact OD1-OG 3.38Å
137	A	89.3	Confident	90.2	Very high	41 Å²	41	54.6 Å²	54.6	34%	0.339	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-86.8	-4.5	-177.4	0	0	0	0	0	112.6	Q104 K134 I135 A139	Q104-A137 PolarHBondContact NE2-O 2.69Å; K134-A137 HydrophobicContact CB-CB 4.4Å; K134-A137 PolarHBondContact O-N 3.46Å; K134-A137 VanDerWaalsContact O-N 3.13Å; I135-A137 VanDerWaalsContact C-N 3.29Å; I135-A137 PolarHBondContact O-N 3.31Å; A137-A139 PolarHBondContact O-N 3.1Å
138	A	83.3	Confident	89.8	Confident	20 Å²	20	55.1 Å²	55.1	17%	0.165	31%	0.306	C	S	.	.			trans	-71.9	119.2	-179.7	0	0	0	0	0	110.5	V103 I135 D136 D140 V143	V103-A138 HydrophobicContact CG2-CB 4.35Å; I135-A138 WeakPolarHBondContact O-CB 3.25Å; I135-A138 PolarHBondContact O-N 2.9Å; D136-A138 VanDerWaalsContact C-N 3.32Å; A138-D140 PolarHBondContact O-N 2.93Å; A138-V143 HydrophobicContact CB-CB 3.66Å; A138-V143 HydrophobicContact CB-CG1 3.6Å; A138-V143 HydrophobicContact CB-CG2 3.84Å
139	A	79.9	Confident	89.6	Confident	109 Å²	109	57.8 Å²	57.8	90%	0.901	32%	0.324	S	S	*	.	S	Bend	trans	-62.6	-22.3	172.7	0	0	0	0	0	112.7	A137	A137-A139 PolarHBondContact O-N 3.1Å
140	D	80.9	Confident	89.5	Confident	58 Å²	58	58.9 Å²	58.9	31%	0.31	33%	0.329	S	S	.	.			trans	-90.2	108	177.4	177.8	12.1	0	0	0	110.5	A138 K142 V143 R146	A138-D140 PolarHBondContact O-N 2.93Å; D140-K142 PolarHBondContact O-N 3.41Å; D140-K142 WeakPolarHBondContact OD1-CA 3.31Å; D140-K142 WeakPolarHBondContact OD1-CB 3.35Å; D140-K142 PolarHBondContact OD1-N 2.93Å; D140-V143 WeakPolarHBondContact O-CB 3.08Å; D140-V143 PolarHBondContact O-N 3.16Å; D140-R146 IonicContact OD2-CZ 3.42Å; D140-R146 IonicContact OD2-NE 3.25Å; D140-R146 PolarHBondContact OD2-NE 3.11Å; D140-R146 IonicContact OD2-NH2 2.75Å; D140-R146 PolarHBondContact OD2-NH2 2.85Å
141	L	78.8	Confident	89.3	Confident	166 Å²	166	59 Å²	59	87%	0.869	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.9	176	-65.5	171.2	0	0	0	113.2
142	K	84.9	Confident	89.1	Confident	127 Å²	127	67.4 Å²	67.4	55%	0.552	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	14.3	176	-59.5	-177.9	179	179.8	0	112.9	D140 T144 Q145 R146	D140-K142 PolarHBondContact O-N 3.41Å; D140-K142 WeakPolarHBondContact OD1-CA 3.31Å; D140-K142 WeakPolarHBondContact OD1-CB 3.35Å; D140-K142 PolarHBondContact OD1-N 2.93Å; K142-T144 PolarHBondContact O-N 3.29Å; K142-T144 VanDerWaalsContact O-N 3.14Å; K142-Q145 HydrophobicContact CB-CB 4.32Å; K142-Q145 HydrophobicContact CB-CG 4.33Å; K142-Q145 WeakPolarHBondContact O-CA 3.29Å; K142-Q145 WeakPolarHBondContact O-CB 3.47Å; K142-Q145 PolarHBondContact O-N 3.35Å; K142-R146 PolarHBondContact O-N 3.19Å
143	V	84.1	Confident	89	Confident	6 Å²	6	75.2 Å²	75.2	4%	0.036	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-53.7	-36.2	178.3	68.7	0	0	0	0	112.5	V103 I135 A138 D140 Q145 R146 F160	V103-V143 HydrophobicContact CB-CG2 3.93Å; V103-V143 HydrophobicContact CG1-CG2 4.26Å; V103-V143 HydrophobicContact CG2-CG2 4.05Å; I135-V143 HydrophobicContact CB-CG1 4.22Å; A138-V143 HydrophobicContact CB-CB 3.66Å; A138-V143 HydrophobicContact CB-CG1 3.6Å; A138-V143 HydrophobicContact CB-CG2 3.84Å; D140-V143 WeakPolarHBondContact O-CB 3.08Å; D140-V143 PolarHBondContact O-N 3.16Å; V143-Q145 VanDerWaalsContact C-N 3.25Å; V143-Q145 PolarHBondContact O-N 3.19Å; V143-R146 WeakPolarHBondContact O-CB 3.44Å; V143-R146 WeakPolarHBondContact O-CG 3.4Å; V143-R146 PolarHBondContact O-N 3.3Å; V143-F160 WeakPolarHBondContact O-CE1 3.42Å
144	T	86.2	Confident	88.9	Confident	68 Å²	68	79.2 Å²	79.2	42%	0.417	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-75.5	-10.2	178.1	55.4	0	0	0	0	113.8	I135 K142 F160	I135-T144 HydrophobicContact CD1-CG2 4.38Å; K142-T144 PolarHBondContact O-N 3.29Å; K142-T144 VanDerWaalsContact O-N 3.14Å; T144-F160 HydrophobicContact CG2-CB 4.14Å; T144-F160 HydrophobicContact CG2-CD1 4.23Å; T144-F160 HydrophobicContact CG2-CD2 4.34Å; T144-F160 HydrophobicContact CG2-CG 4Å; T144-F160 WeakPolarHBondContact O-CE2 3.44Å; T144-F160 WeakPolarHBondContact O-CZ 3.39Å
145	Q	86.1	Confident	88.9	Confident	142 Å²	142	80 Å²	80	66%	0.664	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-92.7	-7.2	173.4	-56.3	179.2	7.4	0	0	111.9	K142 V143	K142-Q145 HydrophobicContact CB-CB 4.32Å; K142-Q145 HydrophobicContact CB-CG 4.33Å; K142-Q145 WeakPolarHBondContact O-CA 3.29Å; K142-Q145 WeakPolarHBondContact O-CB 3.47Å; K142-Q145 PolarHBondContact O-N 3.35Å; V143-Q145 VanDerWaalsContact C-N 3.25Å; V143-Q145 PolarHBondContact O-N 3.19Å
146	R	85	Confident	88.9	Confident	116 Å²	116	79.9 Å²	79.9	44%	0.438	44%	0.441	S	S	.	.			trans	-68.4	136.6	178.3	-65	-179.4	-177.8	-174.7	-0.3	110.2	D140 K142 V143 F148	D140-R146 IonicContact OD2-CZ 3.42Å; D140-R146 IonicContact OD2-NE 3.25Å; D140-R146 PolarHBondContact OD2-NE 3.11Å; D140-R146 IonicContact OD2-NH2 2.75Å; D140-R146 PolarHBondContact OD2-NH2 2.85Å; K142-R146 PolarHBondContact O-N 3.19Å; V143-R146 WeakPolarHBondContact O-CB 3.44Å; V143-R146 WeakPolarHBondContact O-CG 3.4Å; V143-R146 PolarHBondContact O-N 3.3Å; R146-F148 HydrophobicContact CB-CE2 3.77Å; R146-F148 HydrophobicContact CB-CZ 4.13Å
147	S	84.9	Confident	89.1	Confident	112 Å²	112	77.6 Å²	77.6	78%	0.783	43%	0.43	S	S	*	.			trans	-91.9	128.1	175.4	-176.4	0	0	0	0	110.8
148	F	89.3	Confident	89.5	Confident	34 Å²	34	78.3 Å²	78.3	15%	0.149	43%	0.426	C	S	.	.			trans	-112.7	101	176	-65.8	-85.6	0	0	0	109.1	F101 Y109 R146 F150 F158 F160	F101-F148 HydrophobicContact CE2-CD1 4.2Å; F101-F148 AromaticContact CE2-CE1 3.64Å; F101-F148 HydrophobicContact CE2-CE1 3.64Å; F101-F148 AromaticContact CE2-CZ 3.95Å; F101-F148 HydrophobicContact CE2-CZ 3.95Å; F101-F148 AromaticContact CZ-CD1 3.73Å; F101-F148 HydrophobicContact CZ-CD1 3.73Å; F101-F148 HydrophobicContact CZ-CD2 4.34Å; F101-F148 AromaticContact CZ-CE1 3.55Å; F101-F148 HydrophobicContact CZ-CE1 3.55Å; F101-F148 HydrophobicContact CZ-CE2 4.19Å; F101-F148 HydrophobicContact CZ-CG 4.11Å; F101-F148 AromaticContact CZ-CZ 3.79Å; F101-F148 HydrophobicContact CZ-CZ 3.79Å; Y109-F148 HydrophobicContact CD1-CD1 4.31Å; Y109-F148 AromaticContact CD2-CD1 3.68Å; Y109-F148 HydrophobicContact CD2-CD1 3.68Å; Y109-F148 HydrophobicContact CD2-CE1 4.3Å; Y109-F148 HydrophobicContact CE1-CD1 4.14Å; Y109-F148 HydrophobicContact CE2-CB 3.75Å; Y109-F148 AromaticContact CE2-CD1 3.49Å; Y109-F148 HydrophobicContact CE2-CD1 3.49Å; Y109-F148 VanDerWaalsContact CE2-CD1 3.49Å; Y109-F148 HydrophobicContact CE2-CG 4.03Å; Y109-F148 HydrophobicContact CG-CD1 4.09Å; Y109-F148 HydrophobicContact CG-CE1 4.41Å; Y109-F148 AromaticContact CZ-CD1 3.72Å; R146-F148 HydrophobicContact CB-CE2 3.77Å; R146-F148 HydrophobicContact CB-CZ 4.13Å; F148-F150 VanDerWaalsContact C-N 3.26Å; F148-F150 PolarHBondContact O-N 2.87Å; F148-F158 HydrophobicContact CB-CD2 4.34Å; F148-F158 HydrophobicContact CB-CE2 3.62Å; F148-F158 HydrophobicContact CB-CZ 3.98Å; F148-F158 HydrophobicContact CD2-CE1 4.05Å; F148-F158 AromaticContact CD2-CE2 3.83Å; F148-F158 HydrophobicContact CD2-CE2 3.83Å; F148-F158 AromaticContact CD2-CZ 3.26Å; F148-F158 HydrophobicContact CD2-CZ 3.26Å; F148-F158 AromaticContact CE2-CZ 3.91Å; F148-F158 HydrophobicContact CE2-CZ 3.91Å; F148-F158 AromaticContact CG-CE2 3.85Å; F148-F158 HydrophobicContact CG-CE2 3.85Å; F148-F158 AromaticContact CG-CZ 3.78Å; F148-F158 HydrophobicContact CG-CZ 3.78Å; F148-F160 HydrophobicContact CD2-CE1 4.34Å; F148-F160 HydrophobicContact CD2-CZ 4.12Å; F148-F160 AromaticContact CE2-CE1 3.71Å; F148-F160 HydrophobicContact CE2-CE1 3.71Å; F148-F160 AromaticContact CE2-CZ 3.82Å; F148-F160 HydrophobicContact CE2-CZ 3.82Å
149	S	93.8	Very high	90.2	Very high	59 Å²	59	79.2 Å²	79.2	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-69.2	-18.9	-171.7	60.1	0	0	0	0	114.5	Y109 K152 K153	Y109-S149 PolarHBondContact OH-N 3.17Å; S149-K152 PolarHBondContact O-N 2.56Å; S149-K153 WeakPolarHBondContact O-CB 3.14Å; S149-K153 VanDerWaalsContact O-CG 3.23Å; S149-K153 WeakPolarHBondContact O-CG 3.49Å; S149-K153 PolarHBondContact O-N 3.44Å
150	F	95.9	Very high	91.1	Very high	24 Å²	24	75.6 Å²	75.6	11%	0.105	39%	0.39	C	S	.	.	H	α-helix	trans	-59.6	-53.9	-177.9	174.6	-101.5	0	0	0	111.4	M99 Y109 L112 A113 Y116 V130 F148 K152 K153 Q154 L156	M99-F150 HydrophobicContact CE-CE1 4.1Å; Y109-F150 HydrophobicContact CE2-CB 3.87Å; Y109-F150 WeakPolarHBondContact OH-CB 3.32Å; Y109-F150 PolarHBondContact OH-N 3.09Å; L112-F150 HydrophobicContact CB-CD1 4.22Å; L112-F150 HydrophobicContact CB-CE1 3.98Å; L112-F150 HydrophobicContact CB-CZ 4.32Å; L112-F150 HydrophobicContact CD1-CD1 4.29Å; A113-F150 HydrophobicContact CB-CE2 4.08Å; Y116-F150 HydrophobicContact CD1-CZ 4.1Å; Y116-F150 AromaticContact CG-CZ 3.92Å; Y116-F150 HydrophobicContact CG-CZ 3.92Å; V130-F150 HydrophobicContact CG2-CD1 3.9Å; V130-F150 HydrophobicContact CG2-CE1 3.93Å; F148-F150 VanDerWaalsContact C-N 3.26Å; F148-F150 PolarHBondContact O-N 2.87Å; F150-K152 VanDerWaalsContact C-N 3.32Å; F150-K152 PolarHBondContact O-N 3.32Å; F150-K153 PolarHBondContact O-N 3.07Å; F150-Q154 HydrophobicContact CD2-CG 4.29Å; F150-Q154 HydrophobicContact CE2-CG 3.92Å; F150-Q154 HydrophobicContact CZ-CG 4.05Å; F150-Q154 WeakPolarHBondContact O-CG 3.17Å; F150-Q154 PolarHBondContact O-N 3.11Å; F150-L156 HydrophobicContact CE1-CD1 4.43Å
151	A	94.4	Very high	91.8	Very high	2 Å²	2	72.9 Å²	72.9	2%	0.017	38%	0.375	C	S	.	.	H	α-helix	trans	-59.4	-44.4	179.2	0	0	0	0	0	111.5	V130 K153 Q154 G155 L156 F158	V130-A151 HydrophobicContact CB-CB 3.97Å; V130-A151 HydrophobicContact CG2-CB 3.86Å; A151-K153 PolarHBondContact O-N 3.31Å; A151-Q154 CarbonylContact O-C 3.05Å; A151-Q154 PolarHBondContact O-N 2.63Å; A151-G155 PolarHBondContact O-N 3.05Å; A151-L156 HydrophobicContact CB-CB 4.39Å; A151-L156 PolarHBondContact O-N 2.87Å; A151-F158 HydrophobicContact CB-CB 4Å; A151-F158 HydrophobicContact CB-CD2 3.81Å; A151-F158 HydrophobicContact CB-CG 4.36Å
152	K	93.9	Very high	92.6	Very high	176 Å²	176	65 Å²	65	77%	0.765	33%	0.334	S	S	*	.	H	α-helix	trans	-61.4	-43.7	177.3	-173.3	176.4	-179	178	0	112.7	S149 F150 Q154 G155	S149-K152 PolarHBondContact O-N 2.56Å; F150-K152 VanDerWaalsContact C-N 3.32Å; F150-K152 PolarHBondContact O-N 3.32Å; K152-Q154 VanDerWaalsContact C-N 3.28Å; K152-Q154 PolarHBondContact O-N 2.97Å; K152-G155 PolarHBondContact O-N 3.49Å
153	K	96.2	Very high	93.1	Very high	165 Å²	165	59.4 Å²	59.4	72%	0.717	31%	0.311	S	S	*	.	H	α-helix	trans	-64	-34.8	178.7	-76.9	176.6	179.4	-170.8	0	112.2	S149 F150 A151	S149-K153 WeakPolarHBondContact O-CB 3.14Å; S149-K153 VanDerWaalsContact O-CG 3.23Å; S149-K153 WeakPolarHBondContact O-CG 3.49Å; S149-K153 PolarHBondContact O-N 3.44Å; F150-K153 PolarHBondContact O-N 3.07Å; A151-K153 PolarHBondContact O-N 3.31Å
154	Q	95.9	Very high	93.4	Very high	87 Å²	87	61.9 Å²	61.9	41%	0.407	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.3	-179.6	-59.5	-57.4	-24.7	0	0	113.3	Y116 F150 A151 K152 L156	Y116-Q154 HydrophobicContact CD1-CG 4.33Å; Y116-Q154 HydrophobicContact CE1-CB 4.34Å; Y116-Q154 HydrophobicContact CE1-CG 3.97Å; F150-Q154 HydrophobicContact CD2-CG 4.29Å; F150-Q154 HydrophobicContact CE2-CG 3.92Å; F150-Q154 HydrophobicContact CZ-CG 4.05Å; F150-Q154 WeakPolarHBondContact O-CG 3.17Å; F150-Q154 PolarHBondContact O-N 3.11Å; A151-Q154 CarbonylContact O-C 3.05Å; A151-Q154 PolarHBondContact O-N 2.63Å; K152-Q154 VanDerWaalsContact C-N 3.28Å; K152-Q154 PolarHBondContact O-N 2.97Å; Q154-L156 VanDerWaalsContact C-N 3.27Å; Q154-L156 HydrophobicContact CB-CD1 3.81Å; Q154-L156 HydrophobicContact CB-CG 3.7Å; Q154-L156 PolarHBondContact O-N 2.81Å
155	G	95.3	Very high	93.6	Very high	68 Å²	68	63.2 Å²	63.2	70%	0.701	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	24.7	-177.6	0	0	0	0	0	114.5	A151 K152	A151-G155 PolarHBondContact O-N 3.05Å; K152-G155 PolarHBondContact O-N 3.49Å
156	L	96.6	Very high	93.9	Very high	21 Å²	21	57.5 Å²	57.5	11%	0.11	32%	0.317	C	S	.	.			trans	-95.2	140.1	-173.8	-55.5	179	0	0	0	111.9	M99 Y116 C128 V130 F150 A151 Q154	M99-L156 HydrophobicContact CE-CD1 3.35Å; Y116-L156 HydrophobicContact CD2-CD1 4.3Å; Y116-L156 HydrophobicContact CE2-CD1 3.91Å; Y116-L156 HydrophobicContact CE2-CD2 4.5Å; C128-L156 HydrophobicContact CB-CD1 4.39Å; C128-L156 HydrophobicContact CB-CD2 4Å; V130-L156 HydrophobicContact CG2-CB 4.38Å; V130-L156 HydrophobicContact CG2-CD1 4.04Å; F150-L156 HydrophobicContact CE1-CD1 4.43Å; A151-L156 HydrophobicContact CB-CB 4.39Å; A151-L156 PolarHBondContact O-N 2.87Å; Q154-L156 VanDerWaalsContact C-N 3.27Å; Q154-L156 HydrophobicContact CB-CD1 3.81Å; Q154-L156 HydrophobicContact CB-CG 3.7Å; Q154-L156 PolarHBondContact O-N 2.81Å
157	P	97.4	Very high	94.3	Very high	28 Å²	28	54.7 Å²	54.7	18%	0.182	31%	0.312	C	S	.	.			trans	-54	143.9	165.8	-24.4	33.3	0	0	0	111.8	C128 C129 V130 Y159	C128-P157 WeakPolarHBondContact O-CD 3.44Å; C129-P157 WeakPolarHBondContact CA-O 3.18Å; C129-P157 HydrophobicContact CB-CB 4.11Å; V130-P157 PolarHBondContact N-O 3.3Å; P157-Y159 HydrophobicContact CB-CE2 3.8Å
158	F	97.6	Very high	94.8	Very high	57 Å²	57	52.8 Å²	52.8	25%	0.25	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.7	-178.8	-175.8	-84.1	0	0	0	111.2	F101 V130 A132 F148 A151 F160	F101-F158 AromaticContact CE1-CE2 3.82Å; F101-F158 HydrophobicContact CE1-CE2 3.82Å; F101-F158 HydrophobicContact CE1-CZ 4.14Å; F101-F158 HydrophobicContact CZ-CE2 4.16Å; F101-F158 HydrophobicContact CZ-CZ 4.13Å; V130-F158 HydrophobicContact CB-CD2 3.86Å; V130-F158 HydrophobicContact CB-CE2 4.47Å; V130-F158 HydrophobicContact CG1-CD2 3.64Å; V130-F158 HydrophobicContact CG1-CE2 3.75Å; V130-F158 CarbonylContact O-C 3.53Å; V130-F158 VanDerWaalsContact O-CA 3.29Å; V130-F158 WeakPolarHBondContact O-CA 3.35Å; A132-F158 HydrophobicContact CB-CE1 4.04Å; A132-F158 HydrophobicContact CB-CE2 4.3Å; A132-F158 HydrophobicContact CB-CZ 3.51Å; F148-F158 HydrophobicContact CB-CD2 4.34Å; F148-F158 HydrophobicContact CB-CE2 3.62Å; F148-F158 HydrophobicContact CB-CZ 3.98Å; F148-F158 HydrophobicContact CD2-CE1 4.05Å; F148-F158 AromaticContact CD2-CE2 3.83Å; F148-F158 HydrophobicContact CD2-CE2 3.83Å; F148-F158 AromaticContact CD2-CZ 3.26Å; F148-F158 HydrophobicContact CD2-CZ 3.26Å; F148-F158 AromaticContact CE2-CZ 3.91Å; F148-F158 HydrophobicContact CE2-CZ 3.91Å; F148-F158 AromaticContact CG-CE2 3.85Å; F148-F158 HydrophobicContact CG-CE2 3.85Å; F148-F158 AromaticContact CG-CZ 3.78Å; F148-F158 HydrophobicContact CG-CZ 3.78Å; A151-F158 HydrophobicContact CB-CB 4Å; A151-F158 HydrophobicContact CB-CD2 3.81Å; A151-F158 HydrophobicContact CB-CG 4.36Å; F158-F160 HydrophobicContact CD1-CD2 4.41Å; F158-F160 HydrophobicContact CD1-CE2 4.26Å; F158-F160 HydrophobicContact CE1-CD1 4.08Å; F158-F160 AromaticContact CE1-CD2 3.83Å; F158-F160 HydrophobicContact CE1-CD2 3.83Å; F158-F160 AromaticContact CE1-CE1 3.83Å; F158-F160 HydrophobicContact CE1-CE1 3.83Å; F158-F160 AromaticContact CE1-CE2 3.56Å; F158-F160 HydrophobicContact CE1-CE2 3.56Å; F158-F160 HydrophobicContact CE1-CG 4.09Å; F158-F160 AromaticContact CE1-CZ 3.57Å; F158-F160 HydrophobicContact CE1-CZ 3.57Å; F158-F160 HydrophobicContact CZ-CE1 4.13Å; F158-F160 HydrophobicContact CZ-CZ 4.12Å
159	Y	97.7	Very high	95	Very high	38 Å²	38	51.2 Å²	51.2	15%	0.149	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	132.4	-179.3	-62.2	-82.7	0	0	0	112	C129 V130 V131 A132 P157 M172 E175	C129-Y159 HydrophobicContact CB-CD2 4.25Å; C129-Y159 HydrophobicContact CB-CE2 4.11Å; V130-Y159 PolarHBondContact O-N 3.01Å; V131-Y159 WeakPolarHBondContact CA-O 3.46Å; A132-Y159 PolarHBondContact N-O 2.61Å; P157-Y159 HydrophobicContact CB-CE2 3.8Å; Y159-M172 HydrophobicContact CD1-CB 4.24Å; Y159-M172 HydrophobicContact CD1-CG 4.49Å; Y159-M172 HydrophobicContact CD2-CB 4.31Å; Y159-M172 HydrophobicContact CD2-CG 3.69Å; Y159-M172 HydrophobicContact CE2-CG 4.25Å; Y159-M172 HydrophobicContact CG-CB 4.05Å; Y159-M172 HydrophobicContact CG-CG 3.84Å; Y159-E175 WeakPolarHBondContact OH-CG 3.48Å
160	F	97.6	Very high	95	Very high	34 Å²	34	51.5 Å²	51.5	15%	0.149	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.1	161.4	-73.1	-71.7	0	0	0	108.9	A132 I135 V143 T144 F148 F158 N168	A132-F160 HydrophobicContact CB-CD1 3.63Å; A132-F160 HydrophobicContact CB-CE1 3.94Å; A132-F160 HydrophobicContact CB-CG 4.49Å; I135-F160 HydrophobicContact CD1-CB 4.15Å; I135-F160 HydrophobicContact CG2-CB 4.08Å; I135-F160 HydrophobicContact CG2-CD1 3.81Å; I135-F160 HydrophobicContact CG2-CG 4.42Å; V143-F160 WeakPolarHBondContact O-CE1 3.42Å; T144-F160 HydrophobicContact CG2-CB 4.14Å; T144-F160 HydrophobicContact CG2-CD1 4.23Å; T144-F160 HydrophobicContact CG2-CD2 4.34Å; T144-F160 HydrophobicContact CG2-CG 4Å; T144-F160 WeakPolarHBondContact O-CE2 3.44Å; T144-F160 WeakPolarHBondContact O-CZ 3.39Å; F148-F160 HydrophobicContact CD2-CE1 4.34Å; F148-F160 HydrophobicContact CD2-CZ 4.12Å; F148-F160 AromaticContact CE2-CE1 3.71Å; F148-F160 HydrophobicContact CE2-CE1 3.71Å; F148-F160 AromaticContact CE2-CZ 3.82Å; F148-F160 HydrophobicContact CE2-CZ 3.82Å; F158-F160 HydrophobicContact CD1-CD2 4.41Å; F158-F160 HydrophobicContact CD1-CE2 4.26Å; F158-F160 HydrophobicContact CE1-CD1 4.08Å; F158-F160 AromaticContact CE1-CD2 3.83Å; F158-F160 HydrophobicContact CE1-CD2 3.83Å; F158-F160 AromaticContact CE1-CE1 3.83Å; F158-F160 HydrophobicContact CE1-CE1 3.83Å; F158-F160 AromaticContact CE1-CE2 3.56Å; F158-F160 HydrophobicContact CE1-CE2 3.56Å; F158-F160 HydrophobicContact CE1-CG 4.09Å; F158-F160 AromaticContact CE1-CZ 3.57Å; F158-F160 HydrophobicContact CE1-CZ 3.57Å; F158-F160 HydrophobicContact CZ-CE1 4.13Å; F158-F160 HydrophobicContact CZ-CZ 4.12Å; F160-N168 VanDerWaalsContact O-CB 3.32Å; F160-N168 WeakPolarHBondContact O-CB 3.23Å; F160-N168 PolarHBondContact O-ND2 2.83Å
161	V	97.1	Very high	95	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.			trans	-135.6	157.5	-177.1	-53.2	0	0	0	0	111.9	L37 V131 A132 N133 K134 I135 T167 N168 V169 M172	L37-V161 HydrophobicContact CD1-CG2 4.34Å; L37-V161 HydrophobicContact CD2-CB 4.32Å; L37-V161 HydrophobicContact CD2-CG2 3.65Å; V131-V161 HydrophobicContact CG1-CB 4.2Å; V131-V161 HydrophobicContact CG1-CG1 3.93Å; V131-V161 HydrophobicContact CG1-CG2 3.17Å; A132-V161 PolarHBondContact O-N 3.49Å; N133-V161 CarbonylContact C-O 3.49Å; N133-V161 WeakPolarHBondContact CA-O 3.24Å; N133-V161 HydrophobicContact CB-CG2 3.95Å; N133-V161 PolarHBondContact OD1-O 2.62Å; K134-V161 PolarHBondContact N-O 2.87Å; I135-V161 WeakPolarHBondContact CG1-O 3.5Å; I135-V161 PolarHBondContact N-O 2.91Å; V161-T167 VanDerWaalsContact CA-O 3.25Å; V161-T167 WeakPolarHBondContact CA-O 3.31Å; V161-T167 WeakPolarHBondContact CB-O 3.11Å; V161-N168 HydrophobicContact CG1-CB 4.06Å; V161-V169 HydrophobicContact CB-CG2 4.46Å; V161-M172 HydrophobicContact CG1-CB 4.39Å
162	S	95.5	Very high	95.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.308	C	S	.	.			trans	-129.4	118.3	163.1	170.8	0	0	0	0	109.5	D136 A164 D165 G166 T167 V169	D136-S162 WeakPolarHBondContact OD1-CB 3.33Å; D136-S162 PolarHBondContact OD1-OG 3.38Å; S162-A164 PolarHBondContact O-N 2.88Å; S162-A164 WeakPolarHBondContact OG-CB 3.48Å; S162-A164 PolarHBondContact OG-N 3.07Å; S162-A164 VanDerWaalsContact OG-N 3.07Å; S162-D165 WeakPolarHBondContact CB-OD1 3.35Å; S162-D165 PolarHBondContact OG-N 2.56Å; S162-D165 VanDerWaalsContact OG-N 3.15Å; S162-D165 PolarHBondContact OG-OD1 3.5Å; S162-G166 CarbonylContact O-C 3.56Å; S162-G166 WeakPolarHBondContact O-CA 3.42Å; S162-G166 PolarHBondContact O-N 2.89Å; S162-T167 PolarHBondContact N-O 2.9Å; S162-T167 VanDerWaalsContact N-O 3.08Å; S162-T167 PolarHBondContact O-N 2.81Å; S162-V169 VanDerWaalsContact O-CG2 3.26Å; S162-V169 WeakPolarHBondContact O-CG2 3.42Å
163	A	93.7	Very high	95.2	Very high	10 Å²	10	48.5 Å²	48.5	8%	0.083	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.2	167.3	0	0	0	0	0	112.4	K36 L37 R40 N133	K36-A163 HydrophobicContact CB-CB 3.81Å; L37-A163 HydrophobicContact CD2-CB 3.84Å; L37-A163 HydrophobicContact CG-CB 4.03Å; R40-A163 PolarHBondContact NE-O 3.44Å; N133-A163 PolarHBondContact OD1-N 3.15Å
164	A	92.1	Very high	95.2	Very high	58 Å²	58	48.6 Å²	48.6	48%	0.479	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-50.8	-175.4	0	0	0	0	0	111.3	R40 S162	R40-A164 PolarHBondContact NH2-O 3.23Å; S162-A164 PolarHBondContact O-N 2.88Å; S162-A164 WeakPolarHBondContact OG-CB 3.48Å; S162-A164 PolarHBondContact OG-N 3.07Å; S162-A164 VanDerWaalsContact OG-N 3.07Å
165	D	90.4	Very high	95.2	Very high	96 Å²	96	47.4 Å²	47.4	51%	0.513	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-8.6	-178.7	68.2	27.3	0	0	0	114.1	S162 T167	S162-D165 WeakPolarHBondContact CB-OD1 3.35Å; S162-D165 PolarHBondContact OG-N 2.56Å; S162-D165 VanDerWaalsContact OG-N 3.15Å; S162-D165 PolarHBondContact OG-OD1 3.5Å; D165-T167 WeakPolarHBondContact OD1-CB 3.09Å; D165-T167 PolarHBondContact OD1-N 2.77Å; D165-T167 PolarHBondContact OD1-OG1 3.09Å; D165-T167 PolarHBondContact OD2-OG1 3.05Å
166	G	90.9	Very high	95.4	Very high	23 Å²	23	44.1 Å²	44.1	24%	0.237	23%	0.229	C	C	.	.			trans	89.5	0.4	178.7	0	0	0	0	0	115	S162 N168 V169	S162-G166 CarbonylContact O-C 3.56Å; S162-G166 WeakPolarHBondContact O-CA 3.42Å; S162-G166 PolarHBondContact O-N 2.89Å; G166-N168 PolarHBondContact O-N 3.18Å; G166-N168 VanDerWaalsContact O-N 3.15Å; G166-V169 PolarHBondContact O-N 2.92Å; G166-V169 VanDerWaalsContact O-N 3.14Å
167	T	93.4	Very high	95.4	Very high	56 Å²	56	43.3 Å²	43.3	34%	0.344	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	121.6	-178.3	-64.4	0	0	0	0	111.2	I135 V161 S162 D165 V169	I135-T167 HydrophobicContact CD1-CG2 3.84Å; V161-T167 VanDerWaalsContact CA-O 3.25Å; V161-T167 WeakPolarHBondContact CA-O 3.31Å; V161-T167 WeakPolarHBondContact CB-O 3.11Å; S162-T167 PolarHBondContact N-O 2.9Å; S162-T167 VanDerWaalsContact N-O 3.08Å; S162-T167 PolarHBondContact O-N 2.81Å; D165-T167 WeakPolarHBondContact OD1-CB 3.09Å; D165-T167 PolarHBondContact OD1-N 2.77Å; D165-T167 PolarHBondContact OD1-OG1 3.09Å; D165-T167 PolarHBondContact OD2-OG1 3.05Å; T167-V169 PolarHBondContact O-N 2.82Å
168	N	95.3	Very high	95.3	Very high	72 Å²	72	44.9 Å²	44.9	39%	0.385	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	5.5	178.9	-65	-39	0	0	0	116.8	F160 V161 G166 K171 M172	F160-N168 VanDerWaalsContact O-CB 3.32Å; F160-N168 WeakPolarHBondContact O-CB 3.23Å; F160-N168 PolarHBondContact O-ND2 2.83Å; V161-N168 HydrophobicContact CG1-CB 4.06Å; G166-N168 PolarHBondContact O-N 3.18Å; G166-N168 VanDerWaalsContact O-N 3.15Å; N168-K171 PolarHBondContact O-N 3.31Å; N168-M172 WeakPolarHBondContact O-CB 3.06Å; N168-M172 PolarHBondContact O-N 3.41Å
169	V	95.1	Very high	95.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-55	-176.5	176.1	0	0	0	0	111	L37 R40 F41 V161 S162 G166 T167 K171 M172 F173	L37-V169 HydrophobicContact CD2-CG1 4.45Å; L37-V169 HydrophobicContact CD2-CG2 3.81Å; R40-V169 HydrophobicContact CB-CG1 4.35Å; R40-V169 HydrophobicContact CG-CB 4.26Å; R40-V169 HydrophobicContact CG-CG1 4.01Å; R40-V169 HydrophobicContact CG-CG2 4.12Å; F41-V169 HydrophobicContact CB-CG1 3.91Å; V161-V169 HydrophobicContact CB-CG2 4.46Å; S162-V169 VanDerWaalsContact O-CG2 3.26Å; S162-V169 WeakPolarHBondContact O-CG2 3.42Å; G166-V169 PolarHBondContact O-N 2.92Å; G166-V169 VanDerWaalsContact O-N 3.14Å; T167-V169 PolarHBondContact O-N 2.82Å; V169-K171 VanDerWaalsContact C-N 3.32Å; V169-K171 PolarHBondContact O-N 3.25Å; V169-M172 PolarHBondContact O-N 2.76Å; V169-F173 HydrophobicContact CG1-CD2 3.77Å; V169-F173 HydrophobicContact CG1-CE2 3.88Å; V169-F173 WeakPolarHBondContact O-CD2 3.5Å; V169-F173 PolarHBondContact O-N 3.33Å
170	V	93.3	Very high	95.1	Very high	65 Å²	65	44.5 Å²	44.5	39%	0.394	23%	0.228	S	C	.	.	H	α-helix	trans	-59.8	-42.7	-179.4	176.8	0	0	0	0	111.8	F41 M172 F173 R174	F41-V170 HydrophobicContact CD2-CG2 4.38Å; F41-V170 HydrophobicContact CE2-CG1 4.46Å; V170-M172 PolarHBondContact O-N 3.29Å; V170-F173 PolarHBondContact O-N 2.82Å; V170-R174 HydrophobicContact CG1-CG 4.3Å; V170-R174 WeakPolarHBondContact O-CB 3.43Å; V170-R174 WeakPolarHBondContact O-CG 3.31Å; V170-R174 PolarHBondContact O-N 3.09Å
171	K	94.8	Very high	94.9	Very high	139 Å²	139	43.1 Å²	43.1	60%	0.604	22%	0.223	S	C	*	.	H	α-helix	trans	-60.3	-47.2	178.6	-178	179.3	178.5	178.9	0	111.4	N168 V169 E175	N168-K171 PolarHBondContact O-N 3.31Å; V169-K171 VanDerWaalsContact C-N 3.32Å; V169-K171 PolarHBondContact O-N 3.25Å; K171-E175 PolarHBondContact O-N 3.49Å
172	M	97.4	Very high	94.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-47.6	-179.8	178.4	-80.1	-63.9	0	0	111.4	I98 V131 Y159 V161 N168 V169 V170 E175 M176	I98-M172 HydrophobicContact CD1-CE 4.42Å; I98-M172 HydrophobicContact CD1-SD 3.82Å; I98-M172 HydrophobicContact CG1-SD 4.2Å; I98-M172 HydrophobicContact CG2-CE 4.39Å; I98-M172 HydrophobicContact CG2-SD 4.07Å; V131-M172 HydrophobicContact CG2-CE 4.36Å; V131-M172 HydrophobicContact CG2-CG 3.94Å; V131-M172 HydrophobicContact CG2-SD 4.07Å; Y159-M172 HydrophobicContact CD1-CB 4.24Å; Y159-M172 HydrophobicContact CD1-CG 4.49Å; Y159-M172 HydrophobicContact CD2-CB 4.31Å; Y159-M172 HydrophobicContact CD2-CG 3.69Å; Y159-M172 HydrophobicContact CE2-CG 4.25Å; Y159-M172 HydrophobicContact CG-CB 4.05Å; Y159-M172 HydrophobicContact CG-CG 3.84Å; V161-M172 HydrophobicContact CG1-CB 4.39Å; N168-M172 WeakPolarHBondContact O-CB 3.06Å; N168-M172 PolarHBondContact O-N 3.41Å; V169-M172 PolarHBondContact O-N 2.76Å; V170-M172 PolarHBondContact O-N 3.29Å; M172-E175 PolarHBondContact O-N 2.94Å; M172-M176 WeakPolarHBondContact O-CG 3.44Å; M172-M176 PolarHBondContact O-N 3.2Å; M172-M176 VanDerWaalsContact O-N 3.09Å; M172-M176 HydrophobicContact SD-CG 4.16Å
173	F	96.8	Very high	94.6	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-65.4	-42.5	-179.9	-86.3	-78.9	0	0	0	112.8	L37 M38 F41 F74 I98 V169 V170 E175 M176 I177	L37-F173 HydrophobicContact CB-CE2 4.03Å; L37-F173 HydrophobicContact CB-CZ 4.2Å; L37-F173 WeakPolarHBondContact O-CE2 3.44Å; M38-F173 HydrophobicContact CG-CE1 4.48Å; M38-F173 HydrophobicContact CG-CZ 4.11Å; F41-F173 HydrophobicContact CB-CD2 3.49Å; F41-F173 VanDerWaalsContact CB-CD2 3.49Å; F41-F173 HydrophobicContact CB-CE2 3.66Å; F41-F173 HydrophobicContact CB-CG 4Å; F41-F173 HydrophobicContact CB-CZ 4.3Å; F41-F173 HydrophobicContact CD1-CB 3.92Å; F41-F173 AromaticContact CD1-CD1 3.91Å; F41-F173 HydrophobicContact CD1-CD1 3.91Å; F41-F173 HydrophobicContact CD1-CD2 4.15Å; F41-F173 HydrophobicContact CD1-CE1 4.44Å; F41-F173 AromaticContact CD1-CG 3.74Å; F41-F173 HydrophobicContact CD1-CG 3.74Å; F41-F173 HydrophobicContact CD2-CB 3.44Å; F41-F173 VanDerWaalsContact CD2-CB 3.44Å; F41-F173 AromaticContact CD2-CD2 3.86Å; F41-F173 HydrophobicContact CD2-CD2 3.86Å; F41-F173 AromaticContact CD2-CG 3.8Å; F41-F173 HydrophobicContact CD2-CG 3.8Å; F41-F173 HydrophobicContact CE1-CB 3.92Å; F41-F173 HydrophobicContact CE1-CD1 4.31Å; F41-F173 HydrophobicContact CE1-CG 4.19Å; F41-F173 HydrophobicContact CE2-CB 3.43Å; F41-F173 VanDerWaalsContact CE2-CB 3.43Å; F41-F173 HydrophobicContact CE2-CG 4.23Å; F41-F173 HydrophobicContact CG-CB 3.7Å; F41-F173 HydrophobicContact CG-CD1 4.15Å; F41-F173 AromaticContact CG-CD2 3.55Å; F41-F173 HydrophobicContact CG-CD2 3.55Å; F41-F173 HydrophobicContact CG-CE2 4.16Å; F41-F173 AromaticContact CG-CG 3.54Å; F41-F173 HydrophobicContact CG-CG 3.54Å; F41-F173 HydrophobicContact CZ-CB 3.69Å; F41-F173 HydrophobicContact CZ-CG 4.42Å; F74-F173 HydrophobicContact CD1-CD1 4.18Å; F74-F173 AromaticContact CD1-CE1 3.84Å; F74-F173 HydrophobicContact CD1-CE1 3.84Å; F74-F173 AromaticContact CE1-CD1 3.41Å; F74-F173 HydrophobicContact CE1-CD1 3.41Å; F74-F173 VanDerWaalsContact CE1-CD1 3.41Å; F74-F173 AromaticContact CE1-CE1 3.56Å; F74-F173 HydrophobicContact CE1-CE1 3.56Å; F74-F173 AromaticContact CZ-CD1 3.69Å; F74-F173 HydrophobicContact CZ-CD1 3.69Å; F74-F173 HydrophobicContact CZ-CE1 4.12Å; I98-F173 HydrophobicContact CD1-CD1 3.88Å; I98-F173 HydrophobicContact CD1-CE1 3.62Å; I98-F173 HydrophobicContact CD1-CZ 4.28Å; V169-F173 HydrophobicContact CG1-CD2 3.77Å; V169-F173 HydrophobicContact CG1-CE2 3.88Å; V169-F173 WeakPolarHBondContact O-CD2 3.5Å; V169-F173 PolarHBondContact O-N 3.33Å; V170-F173 PolarHBondContact O-N 2.82Å; F173-E175 VanDerWaalsContact C-N 3.34Å; F173-E175 PolarHBondContact O-N 3.26Å; F173-M176 PolarHBondContact O-N 2.85Å; F173-M176 VanDerWaalsContact O-N 3.16Å; F173-I177 VanDerWaalsContact O-CG1 3.26Å; F173-I177 WeakPolarHBondContact O-CG1 3.39Å; F173-I177 PolarHBondContact O-N 3.44Å
174	R	95.2	Very high	94.4	Very high	166 Å²	166	50.5 Å²	50.5	63%	0.626	26%	0.257	S	S	*	.	H	α-helix	trans	-59.4	-43.8	176.5	-76	-179.1	177.2	174.5	-0	112.4	V170 M176 I177 N178	V170-R174 HydrophobicContact CG1-CG 4.3Å; V170-R174 WeakPolarHBondContact O-CB 3.43Å; V170-R174 WeakPolarHBondContact O-CG 3.31Å; V170-R174 PolarHBondContact O-N 3.09Å; R174-M176 VanDerWaalsContact C-N 3.32Å; R174-M176 PolarHBondContact O-N 3.37Å; R174-I177 PolarHBondContact O-N 3.38Å; R174-N178 PolarHBondContact O-N 3.06Å; R174-N178 PolarHBondContact O-ND2 3.26Å
175	E	96.9	Very high	94.2	Very high	62 Å²	62	52.2 Å²	52.2	29%	0.29	26%	0.255	S	S	.	.	H	α-helix	trans	-60.4	-43.6	175.4	178.6	71.2	-176.2	0	0	111.5	Y159 K171 M172 F173 N178 R179	Y159-E175 WeakPolarHBondContact OH-CG 3.48Å; K171-E175 PolarHBondContact O-N 3.49Å; M172-E175 PolarHBondContact O-N 2.94Å; F173-E175 VanDerWaalsContact C-N 3.34Å; F173-E175 PolarHBondContact O-N 3.26Å; E175-N178 PolarHBondContact O-N 2.98Å; E175-R179 WeakPolarHBondContact O-CG 3.44Å; E175-R179 PolarHBondContact O-N 3.06Å; E175-R179 IonicContact OE1-CZ 3.02Å; E175-R179 VanDerWaalsContact OE1-CZ 3.24Å; E175-R179 IonicContact OE1-NE 2.53Å; E175-R179 PolarHBondContact OE1-NE 3.46Å; E175-R179 IonicContact OE1-NH2 3.23Å; E175-R179 PolarHBondContact OE1-NH2 3.13Å
176	M	97.9	Very high	93.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-70.1	-33.3	-179.6	-67.9	-53.9	-56.3	0	0	112.9	A96 I98 C129 M172 F173 R174 A180	A96-M176 HydrophobicContact CB-CE 3.82Å; I98-M176 HydrophobicContact CD1-CB 4.29Å; I98-M176 HydrophobicContact CD1-CG 4.26Å; I98-M176 HydrophobicContact CG1-CB 4.34Å; I98-M176 HydrophobicContact CG1-CE 4.44Å; I98-M176 HydrophobicContact CG1-CG 3.95Å; C129-M176 HydrophobicContact CB-CE 4.37Å; C129-M176 HydrophobicContact CB-SD 3.54Å; C129-M176 VanDerWaalsContact CB-SD 3.54Å; C129-M176 PolarHBondContact SG-SD 3.31Å; M172-M176 WeakPolarHBondContact O-CG 3.44Å; M172-M176 PolarHBondContact O-N 3.2Å; M172-M176 VanDerWaalsContact O-N 3.09Å; M172-M176 HydrophobicContact SD-CG 4.16Å; F173-M176 PolarHBondContact O-N 2.85Å; F173-M176 VanDerWaalsContact O-N 3.16Å; R174-M176 VanDerWaalsContact C-N 3.32Å; R174-M176 PolarHBondContact O-N 3.37Å; M176-A180 WeakPolarHBondContact O-CB 3.24Å; M176-A180 PolarHBondContact O-N 3.27Å
177	I	96.6	Very high	93.3	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-50.1	171.2	-68.8	163.7	0	0	0	110.1	I24 F41 A63 V65 V72 F74 F173 R174 R179 A180 V181	I24-I177 HydrophobicContact CD1-CG1 3.91Å; F41-I177 HydrophobicContact CE1-CD1 4.09Å; F41-I177 HydrophobicContact CZ-CD1 3.81Å; A63-I177 HydrophobicContact CB-CD1 4.27Å; A63-I177 HydrophobicContact CB-CG2 3.98Å; V65-I177 HydrophobicContact CG2-CG2 3.69Å; V72-I177 HydrophobicContact CG1-CG1 4.2Å; V72-I177 HydrophobicContact CG2-CD1 4.32Å; V72-I177 HydrophobicContact CG2-CG1 4.1Å; V72-I177 HydrophobicContact CG2-CG2 3.96Å; F74-I177 HydrophobicContact CZ-CD1 4.05Å; F74-I177 HydrophobicContact CZ-CG1 4.09Å; F173-I177 VanDerWaalsContact O-CG1 3.26Å; F173-I177 WeakPolarHBondContact O-CG1 3.39Å; F173-I177 PolarHBondContact O-N 3.44Å; R174-I177 PolarHBondContact O-N 3.38Å; I177-R179 VanDerWaalsContact C-N 3.34Å; I177-R179 PolarHBondContact O-N 3.39Å; I177-A180 PolarHBondContact O-N 3.46Å; I177-V181 HydrophobicContact CG2-CG2 4.48Å; I177-V181 WeakPolarHBondContact O-CG2 3.44Å; I177-V181 PolarHBondContact O-N 2.87Å
178	N	95.6	Very high	92.4	Very high	62 Å²	62	56.2 Å²	56.2	33%	0.332	28%	0.278	S	S	.	.	H	α-helix	trans	-57.1	-48.9	178.8	-69.2	-17.6	0	0	0	111	V65 R174 E175 A180 V181 D182	V65-N178 WeakPolarHBondContact CG1-OD1 3.46Å; R174-N178 PolarHBondContact O-N 3.06Å; R174-N178 PolarHBondContact O-ND2 3.26Å; E175-N178 PolarHBondContact O-N 2.98Å; N178-A180 VanDerWaalsContact C-N 3.33Å; N178-A180 PolarHBondContact O-N 3.33Å; N178-V181 PolarHBondContact O-N 2.99Å; N178-D182 VanDerWaalsContact O-CG 3.22Å; N178-D182 PolarHBondContact O-N 2.82Å
179	R	96.1	Very high	91.5	Very high	86 Å²	86	53 Å²	53	33%	0.325	26%	0.261	S	S	.	.	H	α-helix	trans	-60.2	-40.4	177.6	-70.7	173.4	-179.2	-98.4	-8.1	113	P127 E175 I177 V181 D182 Y183	P127-R179 HydrophobicContact CB-CB 3.85Å; P127-R179 HydrophobicContact CG-CB 3.98Å; E175-R179 WeakPolarHBondContact O-CG 3.44Å; E175-R179 PolarHBondContact O-N 3.06Å; E175-R179 IonicContact OE1-CZ 3.02Å; E175-R179 VanDerWaalsContact OE1-CZ 3.24Å; E175-R179 IonicContact OE1-NE 2.53Å; E175-R179 PolarHBondContact OE1-NE 3.46Å; E175-R179 IonicContact OE1-NH2 3.23Å; E175-R179 PolarHBondContact OE1-NH2 3.13Å; I177-R179 VanDerWaalsContact C-N 3.34Å; I177-R179 PolarHBondContact O-N 3.39Å; R179-V181 VanDerWaalsContact C-N 3.35Å; R179-D182 PolarHBondContact O-N 2.87Å; R179-Y183 VanDerWaalsContact O-CB 3.28Å; R179-Y183 WeakPolarHBondContact O-CB 3.27Å; R179-Y183 PolarHBondContact O-N 3.16Å
180	A	95.8	Very high	90.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-41.1	177.6	0	0	0	0	0	111.7	V22 I24 H95 A96 M176 I177 N178 K184	V22-A180 HydrophobicContact CB-CB 4.28Å; V22-A180 HydrophobicContact CG2-CB 4.47Å; I24-A180 HydrophobicContact CD1-CB 4.05Å; I24-A180 HydrophobicContact CG1-CB 4.04Å; H95-A180 HydrophobicContact CB-CB 4.11Å; A96-A180 HydrophobicContact CB-CB 3.75Å; M176-A180 WeakPolarHBondContact O-CB 3.24Å; M176-A180 PolarHBondContact O-N 3.27Å; I177-A180 PolarHBondContact O-N 3.46Å; N178-A180 VanDerWaalsContact C-N 3.33Å; N178-A180 PolarHBondContact O-N 3.33Å; A180-K184 WeakPolarHBondContact O-CB 3.42Å; A180-K184 PolarHBondContact O-N 3.41Å
181	V	94	Very high	89.9	Confident	6 Å²	6	60.3 Å²	60.3	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-67.2	-45.1	176.9	172.7	0	0	0	0	111	V22 V65 V70 I177 N178 R179 Y183 K184 Q185	V22-V181 HydrophobicContact CG1-CG2 3.93Å; V22-V181 HydrophobicContact CG2-CG2 4.28Å; V65-V181 HydrophobicContact CG1-CB 4.33Å; V65-V181 HydrophobicContact CG1-CG1 4.14Å; V65-V181 HydrophobicContact CG1-CG2 4.5Å; V65-V181 HydrophobicContact CG2-CG2 4.23Å; V70-V181 HydrophobicContact CB-CG2 4.37Å; V70-V181 HydrophobicContact CG1-CG2 4.08Å; V70-V181 HydrophobicContact CG2-CG2 3.93Å; I177-V181 HydrophobicContact CG2-CG2 4.48Å; I177-V181 WeakPolarHBondContact O-CG2 3.44Å; I177-V181 PolarHBondContact O-N 2.87Å; N178-V181 PolarHBondContact O-N 2.99Å; R179-V181 VanDerWaalsContact C-N 3.35Å; V181-Y183 VanDerWaalsContact C-N 3.33Å; V181-Y183 PolarHBondContact O-N 3.11Å; V181-K184 PolarHBondContact O-N 2.91Å; V181-Q185 WeakPolarHBondContact O-CG 3.19Å; V181-Q185 PolarHBondContact O-N 3Å; V181-Q185 VanDerWaalsContact O-N 3.09Å
182	D	92.9	Very high	89.2	Confident	89 Å²	89	54.8 Å²	54.8	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-43.4	178.3	-68.1	-16.8	0	0	0	111.4	N178 R179 Q185 N186	N178-D182 VanDerWaalsContact O-CG 3.22Å; N178-D182 PolarHBondContact O-N 2.82Å; R179-D182 PolarHBondContact O-N 2.87Å; D182-Q185 PolarHBondContact O-N 3.3Å; D182-N186 PolarHBondContact O-N 3Å; D182-N186 PolarHBondContact O-ND2 3.27Å; D182-N186 VanDerWaalsContact O-ND2 3.1Å
183	Y	93.1	Very high	88.2	Confident	19 Å²	19	60.2 Å²	60.2	8%	0.075	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-46.5	175.3	176.8	-87.9	0	0	0	111.6	H95 R123 E125 I126 P127 R179 V181 Q185 N186 P187 D189 D192	H95-Y183 HydrophobicContact CB-CD1 4.48Å; R123-Y183 PolarHBondContact NH2-OH 3.02Å; E125-Y183 HydrophobicContact CB-CE2 4.1Å; I126-Y183 HydrophobicContact CG2-CD1 4.46Å; I126-Y183 HydrophobicContact CG2-CE1 3.83Å; I126-Y183 HydrophobicContact CG2-CE2 4.17Å; P127-Y183 HydrophobicContact CG-CG 4.4Å; R179-Y183 VanDerWaalsContact O-CB 3.28Å; R179-Y183 WeakPolarHBondContact O-CB 3.27Å; R179-Y183 PolarHBondContact O-N 3.16Å; V181-Y183 VanDerWaalsContact C-N 3.33Å; V181-Y183 PolarHBondContact O-N 3.11Å; Y183-Q185 PolarHBondContact O-N 2.74Å; Y183-N186 CarbonylContact O-C 3.54Å; Y183-N186 PolarHBondContact O-N 3.5Å; Y183-N186 VanDerWaalsContact O-N 3.08Å; Y183-P187 WeakPolarHBondContact O-CA 3.35Å; Y183-P187 VanDerWaalsContact O-N 3.1Å; Y183-D189 WeakPolarHBondContact OH-CB 3.21Å; Y183-D192 WeakPolarHBondContact CE1-OD2 3.46Å; Y183-D192 VanDerWaalsContact CZ-OD2 3.23Å; Y183-D192 PolarHBondContact OH-OD2 2.93Å
184	K	89.9	Confident	87.4	Confident	57 Å²	57	62.3 Å²	62.3	25%	0.248	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-33.8	179.3	-168.5	176.8	-174.7	-170.3	0	112.5	A18 R19 Q21 V22 H95 A180 V181 N186	A18-K184 PolarHBondContact O-NZ 2.79Å; R19-K184 VanDerWaalsContact C-NZ 3.29Å; R19-K184 WeakPolarHBondContact O-CE 3.4Å; R19-K184 PolarHBondContact O-NZ 2.98Å; Q21-K184 PolarHBondContact O-NZ 2.8Å; V22-K184 HydrophobicContact CG1-CB 4.29Å; V22-K184 HydrophobicContact CG1-CD 3.9Å; H95-K184 WeakPolarHBondContact NE2-CD 3.35Å; A180-K184 WeakPolarHBondContact O-CB 3.42Å; A180-K184 PolarHBondContact O-N 3.41Å; V181-K184 PolarHBondContact O-N 2.91Å; K184-N186 VanDerWaalsContact C-N 3.32Å
185	Q	86	Confident	86.5	Confident	94 Å²	94	55.5 Å²	55.5	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-76.5	-21.8	178.6	-70	176.6	18.4	0	0	113	V181 D182 Y183	V181-Q185 WeakPolarHBondContact O-CG 3.19Å; V181-Q185 PolarHBondContact O-N 3Å; V181-Q185 VanDerWaalsContact O-N 3.09Å; D182-Q185 PolarHBondContact O-N 3.3Å; Y183-Q185 PolarHBondContact O-N 2.74Å
186	N	84.6	Confident	85.6	Confident	117 Å²	117	57.8 Å²	57.8	63%	0.626	29%	0.292	S	S	*	.	S	Bend	trans	-136.5	65.7	-178.3	-52.2	-82.2	0	0	0	109.1	D182 Y183 K184 S188	D182-N186 PolarHBondContact O-N 3Å; D182-N186 PolarHBondContact O-ND2 3.27Å; D182-N186 VanDerWaalsContact O-ND2 3.1Å; Y183-N186 CarbonylContact O-C 3.54Å; Y183-N186 PolarHBondContact O-N 3.5Å; Y183-N186 VanDerWaalsContact O-N 3.08Å; K184-N186 VanDerWaalsContact C-N 3.32Å; N186-S188 PolarHBondContact O-N 3.22Å
187	P	77.9	Confident	84.7	Confident	64 Å²	64	63.6 Å²	63.6	42%	0.416	32%	0.319	S	S	.	.			trans	-62.2	133.7	-178.6	25.8	-31.9	0	0	0	109.2	Y183 D192	Y183-P187 WeakPolarHBondContact O-CA 3.35Å; Y183-P187 VanDerWaalsContact O-N 3.1Å; P187-D192 HydrophobicContact CB-CB 3.8Å
188	S	75.4	Confident	83.7	Confident	78 Å²	78	68.5 Å²	68.5	55%	0.545	34%	0.344	S	S	.	.			trans	-117.4	2	178.4	62.7	0	0	0	0	112.7	E125 N186	E125-S188 WeakPolarHBondContact CB-OG 3.3Å; N186-S188 PolarHBondContact O-N 3.22Å
189	D	75.4	Confident	82.9	Confident	5 Å²	5	70 Å²	70	3%	0.027	35%	0.349	C	S	.	.			trans	-100.7	127	-175.4	-167.2	-22.9	0	0	0	109.8	P124 E125 Y183 M191 D192	P124-D189 WeakPolarHBondContact CD-OD2 3.33Å; P124-D189 VanDerWaalsContact CG-OD1 3.32Å; P124-D189 WeakPolarHBondContact CG-OD1 3.41Å; P124-D189 WeakPolarHBondContact CG-OD2 3.4Å; E125-D189 HydrophobicContact CB-CB 4.12Å; E125-D189 HydrophobicContact CG-CB 4.34Å; Y183-D189 WeakPolarHBondContact OH-CB 3.21Å; D189-M191 PolarHBondContact O-N 2.95Å; D189-M191 VanDerWaalsContact O-N 3.11Å; D189-M191 WeakPolarHBondContact OD1-CB 3.14Å; D189-M191 WeakPolarHBondContact OD1-CG 3.15Å; D189-M191 PolarHBondContact OD1-N 3.33Å; D189-D192 WeakPolarHBondContact O-CB 3.35Å; D189-D192 PolarHBondContact O-N 2.82Å
190	F	76.9	Confident	82	Confident	138 Å²	138	69.5 Å²	69.5	61%	0.605	35%	0.353	S	S	*	.	H	α-helix	trans	-53.2	-31.6	172.9	174.5	-104.3	0	0	0	112.1	D192 E193 V194	F190-D192 PolarHBondContact O-N 3.16Å; F190-E193 PolarHBondContact O-N 3.19Å; F190-V194 HydrophobicContact CD1-CG2 4.02Å; F190-V194 HydrophobicContact CE1-CG2 3.48Å; F190-V194 VanDerWaalsContact CE1-CG2 3.48Å; F190-V194 HydrophobicContact CE2-CG2 4.03Å; F190-V194 HydrophobicContact CZ-CG2 3.49Å; F190-V194 VanDerWaalsContact CZ-CG2 3.49Å; F190-V194 WeakPolarHBondContact O-CG2 3.33Å; F190-V194 PolarHBondContact O-N 2.7Å
191	M	78.9	Confident	81.1	Confident	81 Å²	81	75.1 Å²	75.1	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-27.4	176	-66.2	-59.9	-61.2	0	0	112.8	D189 L195	D189-M191 PolarHBondContact O-N 2.95Å; D189-M191 VanDerWaalsContact O-N 3.11Å; D189-M191 WeakPolarHBondContact OD1-CB 3.14Å; D189-M191 WeakPolarHBondContact OD1-CG 3.15Å; D189-M191 PolarHBondContact OD1-N 3.33Å; M191-L195 WeakPolarHBondContact O-CB 3.48Å; M191-L195 WeakPolarHBondContact O-CD1 3.36Å; M191-L195 WeakPolarHBondContact O-CG 3.45Å; M191-L195 PolarHBondContact O-N 3.08Å; M191-L195 VanDerWaalsContact O-N 3.15Å
192	D	79.8	Confident	80.1	Confident	22 Å²	22	77.4 Å²	77.4	12%	0.118	40%	0.397	C	S	.	.	H	α-helix	trans	-73.1	-41.4	174.2	-70.8	-35.8	0	0	0	111.5	R123 Y183 P187 D189 F190 V194 L195 E196	R123-D192 IonicContact CZ-OD1 3.76Å; R123-D192 IonicContact CZ-OD2 2.63Å; R123-D192 IonicContact NH1-OD1 3.62Å; R123-D192 PolarHBondContact NH1-OD1 2.98Å; R123-D192 IonicContact NH1-OD2 3.05Å; R123-D192 IonicContact NH2-OD1 2.95Å; R123-D192 PolarHBondContact NH2-OD1 2.91Å; R123-D192 IonicContact NH2-OD2 2.69Å; R123-D192 PolarHBondContact NH2-OD2 3.14Å; Y183-D192 WeakPolarHBondContact CE1-OD2 3.46Å; Y183-D192 VanDerWaalsContact CZ-OD2 3.23Å; Y183-D192 PolarHBondContact OH-OD2 2.93Å; P187-D192 HydrophobicContact CB-CB 3.8Å; D189-D192 WeakPolarHBondContact O-CB 3.35Å; D189-D192 PolarHBondContact O-N 2.82Å; F190-D192 PolarHBondContact O-N 3.16Å; D192-V194 PolarHBondContact O-N 3.44Å; D192-L195 PolarHBondContact O-N 2.88Å; D192-E196 WeakPolarHBondContact O-CB 3.46Å; D192-E196 PolarHBondContact O-N 2.98Å
193	E	76.9	Confident	79.2	Confident	115 Å²	115	77.7 Å²	77.7	54%	0.537	40%	0.398	S	S	.	.	H	α-helix	trans	-58.2	-48	174.9	-62.2	178	175.4	0	0	111	F190 L195 E196 E197	F190-E193 PolarHBondContact O-N 3.19Å; E193-L195 VanDerWaalsContact C-N 3.3Å; E193-L195 PolarHBondContact O-N 2.79Å; E193-E196 PolarHBondContact O-N 2.92Å; E193-E197 PolarHBondContact O-N 2.97Å
194	V	78.5	Confident	78.4	Confident	44 Å²	44	81.7 Å²	81.7	27%	0.267	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-40.4	177.2	174.4	0	0	0	0	111.5	F190 D192 L198	F190-V194 HydrophobicContact CD1-CG2 4.02Å; F190-V194 HydrophobicContact CE1-CG2 3.48Å; F190-V194 VanDerWaalsContact CE1-CG2 3.48Å; F190-V194 HydrophobicContact CE2-CG2 4.03Å; F190-V194 HydrophobicContact CZ-CG2 3.49Å; F190-V194 VanDerWaalsContact CZ-CG2 3.49Å; F190-V194 WeakPolarHBondContact O-CG2 3.33Å; F190-V194 PolarHBondContact O-N 2.7Å; D192-V194 PolarHBondContact O-N 3.44Å; V194-L198 HydrophobicContact CG1-CD1 4.08Å; V194-L198 WeakPolarHBondContact O-CB 3.37Å; V194-L198 VanDerWaalsContact O-CG 3.23Å; V194-L198 WeakPolarHBondContact O-CG 3.49Å; V194-L198 PolarHBondContact O-N 3.38Å
195	L	77.3	Confident	77.5	Confident	23 Å²	23	85.5 Å²	85.5	12%	0.12	43%	0.434	C	S	.	.	H	α-helix	trans	-68.9	-38.3	179.2	-74.2	171.6	0	0	0	112.3	H92 K93 M191 D192 E193 L198 E199	H92-L195 WeakPolarHBondContact CE1-CD2 3.36Å; K93-L195 HydrophobicContact CG-CD1 3.97Å; M191-L195 WeakPolarHBondContact O-CB 3.48Å; M191-L195 WeakPolarHBondContact O-CD1 3.36Å; M191-L195 WeakPolarHBondContact O-CG 3.45Å; M191-L195 PolarHBondContact O-N 3.08Å; M191-L195 VanDerWaalsContact O-N 3.15Å; D192-L195 PolarHBondContact O-N 2.88Å; E193-L195 VanDerWaalsContact C-N 3.3Å; E193-L195 PolarHBondContact O-N 2.79Å; L195-L198 PolarHBondContact O-N 3.01Å; L195-E199 WeakPolarHBondContact O-CG 3.36Å; L195-E199 PolarHBondContact O-N 2.86Å
196	E	78.5	Confident	76.8	Confident	111 Å²	111	88.2 Å²	88.2	52%	0.519	44%	0.444	S	S	.	.	H	α-helix	trans	-65.4	-45.1	176.1	-172.8	171.6	-170.7	0	0	111.1	D192 E193 L198 E199 N200	D192-E196 WeakPolarHBondContact O-CB 3.46Å; D192-E196 PolarHBondContact O-N 2.98Å; E193-E196 PolarHBondContact O-N 2.92Å; E196-L198 PolarHBondContact O-N 3.45Å; E196-E199 PolarHBondContact O-N 2.94Å; E196-N200 VanDerWaalsContact O-CG 3.25Å; E196-N200 PolarHBondContact O-N 3.14Å; E196-N200 PolarHBondContact O-ND2 2.93Å
197	E	78	Confident	76.1	Confident	122 Å²	122	88.6 Å²	88.6	57%	0.57	44%	0.442	S	S	*	.	H	α-helix	trans	-58.6	-46.3	173.9	-73.7	-172.5	168.9	0	0	111.7	E193 E199 N200 F201	E193-E197 PolarHBondContact O-N 2.97Å; E197-E199 VanDerWaalsContact C-N 3.32Å; E197-E199 PolarHBondContact O-N 3.03Å; E197-N200 PolarHBondContact O-N 3.18Å; E197-F201 WeakPolarHBondContact O-CD2 3.43Å; E197-F201 PolarHBondContact O-N 3.19Å
198	L	76.3	Confident	75.7	Confident	106 Å²	106	91.3 Å²	91.3	56%	0.555	45%	0.45	S	S	*	.	H	α-helix	trans	-63.4	-36.1	177.8	-71.9	173.4	0	0	0	112.8	V194 L195 E196 A202	V194-L198 HydrophobicContact CG1-CD1 4.08Å; V194-L198 WeakPolarHBondContact O-CB 3.37Å; V194-L198 VanDerWaalsContact O-CG 3.23Å; V194-L198 WeakPolarHBondContact O-CG 3.49Å; V194-L198 PolarHBondContact O-N 3.38Å; L195-L198 PolarHBondContact O-N 3.01Å; E196-L198 PolarHBondContact O-N 3.45Å; L198-A202 WeakPolarHBondContact O-CB 3.33Å; L198-A202 PolarHBondContact O-N 3.27Å; L198-A202 VanDerWaalsContact O-N 3.1Å
199	E	78.5	Confident	75.4	Confident	92 Å²	92	92.5 Å²	92.5	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-65.5	-44	173.5	-79.8	-176.1	179.2	0	0	111.5	K93 L195 E196 E197 A202 L203	K93-E199 VanDerWaalsContact CE-OE1 3.22Å; K93-E199 WeakPolarHBondContact CE-OE1 3.46Å; K93-E199 IonicContact NZ-OE1 2.8Å; K93-E199 PolarHBondContact NZ-OE1 3.5Å; L195-E199 WeakPolarHBondContact O-CG 3.36Å; L195-E199 PolarHBondContact O-N 2.86Å; E196-E199 PolarHBondContact O-N 2.94Å; E197-E199 VanDerWaalsContact C-N 3.32Å; E197-E199 PolarHBondContact O-N 3.03Å; E199-A202 PolarHBondContact O-N 2.9Å; E199-A202 VanDerWaalsContact O-N 3.16Å; E199-L203 WeakPolarHBondContact O-CG 3.4Å; E199-L203 PolarHBondContact O-N 3.24Å
200	N	78.1	Confident	75.1	Confident	76 Å²	76	94.8 Å²	94.8	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-60.9	-47.3	177.4	-68.2	-22.3	0	0	0	111.1	E196 E197 A202 L203 E204	E196-N200 VanDerWaalsContact O-CG 3.25Å; E196-N200 PolarHBondContact O-N 3.14Å; E196-N200 PolarHBondContact O-ND2 2.93Å; E197-N200 PolarHBondContact O-N 3.18Å; N200-A202 VanDerWaalsContact C-N 3.26Å; N200-A202 PolarHBondContact O-N 3.27Å; N200-L203 WeakPolarHBondContact O-CB 3.4Å; N200-L203 PolarHBondContact O-N 3.22Å; N200-L203 VanDerWaalsContact O-N 3.09Å; N200-E204 WeakPolarHBondContact O-CG 3.32Å; N200-E204 PolarHBondContact O-N 2.86Å
201	F	75.3	Confident	74.4	Confident	119 Å²	119	93.6 Å²	93.6	52%	0.522	46%	0.462	S	S	.	.	H	α-helix	trans	-59	-36.4	174.4	-82	-64.5	0	0	0	113.1	E197 K205	E197-F201 WeakPolarHBondContact O-CD2 3.43Å; E197-F201 PolarHBondContact O-N 3.19Å; F201-K205 WeakPolarHBondContact O-CG 3.33Å; F201-K205 PolarHBondContact O-N 3.33Å
202	A	74.4	Confident	73.7	Confident	53 Å²	53	94.5 Å²	94.5	44%	0.438	47%	0.469	S	S	.	.	H	α-helix	trans	-72.7	-31	178	0	0	0	0	0	112.5	L198 E199 N200 K206	L198-A202 WeakPolarHBondContact O-CB 3.33Å; L198-A202 PolarHBondContact O-N 3.27Å; L198-A202 VanDerWaalsContact O-N 3.1Å; E199-A202 PolarHBondContact O-N 2.9Å; E199-A202 VanDerWaalsContact O-N 3.16Å; N200-A202 VanDerWaalsContact C-N 3.26Å; N200-A202 PolarHBondContact O-N 3.27Å; A202-K206 WeakPolarHBondContact O-CG 3.23Å; A202-K206 PolarHBondContact O-N 2.75Å
203	L	73.2	Confident	72.8	Confident	95 Å²	95	100.1 Å²	100.1	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-71.7	-47.7	174.2	-70.7	168.5	0	0	0	111	E199 N200 K205 K206 E207	E199-L203 WeakPolarHBondContact O-CG 3.4Å; E199-L203 PolarHBondContact O-N 3.24Å; N200-L203 WeakPolarHBondContact O-CB 3.4Å; N200-L203 PolarHBondContact O-N 3.22Å; N200-L203 VanDerWaalsContact O-N 3.09Å; L203-K205 VanDerWaalsContact C-N 3.32Å; L203-K205 PolarHBondContact O-N 2.97Å; L203-K206 WeakPolarHBondContact O-CA 3.36Å; L203-K206 WeakPolarHBondContact O-CB 3.45Å; L203-K206 PolarHBondContact O-N 2.85Å; L203-E207 PolarHBondContact O-N 2.7Å
204	E	75.8	Confident	71.9	Confident	103 Å²	103	100.2 Å²	100.2	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-54.4	-47.5	176	-72.1	173.1	178.5	0	0	111.3	N200 K206 E207 E208	N200-E204 WeakPolarHBondContact O-CG 3.32Å; N200-E204 PolarHBondContact O-N 2.86Å; E204-K206 VanDerWaalsContact C-N 3.29Å; E204-K206 PolarHBondContact O-N 3.15Å; E204-E207 PolarHBondContact O-N 3.01Å; E204-E208 WeakPolarHBondContact O-CG 3.21Å; E204-E208 PolarHBondContact O-N 3.29Å
205	K	72.3	Confident	71	Confident	137 Å²	137	104.8 Å²	104.8	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-63.5	-31.7	176.2	-76.5	-175.4	178.6	-177.9	0	114.1	F201 L203 N209	F201-K205 WeakPolarHBondContact O-CG 3.33Å; F201-K205 PolarHBondContact O-N 3.33Å; L203-K205 VanDerWaalsContact C-N 3.32Å; L203-K205 PolarHBondContact O-N 2.97Å; K205-N209 WeakPolarHBondContact O-CB 3.34Å; K205-N209 VanDerWaalsContact O-CG 3.27Å; K205-N209 PolarHBondContact O-N 3.28Å; K205-N209 VanDerWaalsContact O-N 3.13Å; K205-N209 PolarHBondContact O-ND2 3.31Å
206	K	71.1	Confident	70.2	Confident	151 Å²	151	107.4 Å²	107.4	66%	0.657	54%	0.539	S	S	*	.	H	α-helix	trans	-72.6	-38.7	175.8	-83.7	-176.8	177.9	-178.6	0	111.3	A202 L203 E204 S210	A202-K206 WeakPolarHBondContact O-CG 3.23Å; A202-K206 PolarHBondContact O-N 2.75Å; L203-K206 WeakPolarHBondContact O-CA 3.36Å; L203-K206 WeakPolarHBondContact O-CB 3.45Å; L203-K206 PolarHBondContact O-N 2.85Å; E204-K206 VanDerWaalsContact C-N 3.29Å; E204-K206 PolarHBondContact O-N 3.15Å; K206-S210 WeakPolarHBondContact O-CB 3.34Å; K206-S210 PolarHBondContact O-N 3.28Å; K206-S210 PolarHBondContact O-OG 3.16Å
207	E	69.9	Low	69.1	Low	125 Å²	125	110.1 Å²	110.1	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-64.4	-47.8	175.7	-70.6	-179.1	171.9	0	0	110.4	L203 E204 N209 S210 E211	L203-E207 PolarHBondContact O-N 2.7Å; E204-E207 PolarHBondContact O-N 3.01Å; E207-N209 PolarHBondContact O-N 2.93Å; E207-S210 WeakPolarHBondContact CA-OG 3.41Å; E207-S210 PolarHBondContact O-N 3.43Å; E207-S210 VanDerWaalsContact O-N 3.12Å; E207-S210 PolarHBondContact O-OG 3.45Å; E207-E211 PolarHBondContact O-N 3.42Å
208	E	69.4	Low	68.1	Low	122 Å²	122	108.9 Å²	108.9	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-55.7	-49.6	174.8	-73.3	179.2	164	0	0	112.3	E204 S210 E211 D212	E204-E208 WeakPolarHBondContact O-CG 3.21Å; E204-E208 PolarHBondContact O-N 3.29Å; E208-S210 VanDerWaalsContact C-N 3.29Å; E208-S210 PolarHBondContact O-N 2.99Å; E208-E211 PolarHBondContact O-N 2.84Å; E208-D212 PolarHBondContact O-N 3.13Å; E208-D212 VanDerWaalsContact O-N 3.07Å
209	N	68.8	Low	67.1	Low	102 Å²	102	109.2 Å²	109.2	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-62.2	-36.2	178	-76.4	-11.2	0	0	0	112.6	K205 E207 E213	K205-N209 WeakPolarHBondContact O-CB 3.34Å; K205-N209 VanDerWaalsContact O-CG 3.27Å; K205-N209 PolarHBondContact O-N 3.28Å; K205-N209 VanDerWaalsContact O-N 3.13Å; K205-N209 PolarHBondContact O-ND2 3.31Å; E207-N209 PolarHBondContact O-N 2.93Å; N209-E213 WeakPolarHBondContact O-CG 3.27Å; N209-E213 PolarHBondContact O-N 2.97Å; N209-E213 VanDerWaalsContact O-N 3.12Å
210	S	68.2	Low	66.1	Low	53 Å²	53	113.4 Å²	113.4	37%	0.371	59%	0.585	S	S	.	*	H	α-helix	trans	-71.6	-34.8	179	70	0	0	0	0	112.8	K206 E207 E208 L214	K206-S210 WeakPolarHBondContact O-CB 3.34Å; K206-S210 PolarHBondContact O-N 3.28Å; K206-S210 PolarHBondContact O-OG 3.16Å; E207-S210 WeakPolarHBondContact CA-OG 3.41Å; E207-S210 PolarHBondContact O-N 3.43Å; E207-S210 VanDerWaalsContact O-N 3.12Å; E207-S210 PolarHBondContact O-OG 3.45Å; E208-S210 VanDerWaalsContact C-N 3.29Å; E208-S210 PolarHBondContact O-N 2.99Å; S210-L214 WeakPolarHBondContact O-CD1 3.49Å; S210-L214 WeakPolarHBondContact O-CG 3.44Å; S210-L214 PolarHBondContact O-N 3.45Å; S210-L214 VanDerWaalsContact O-N 3.08Å
211	E	63.9	Low	64.5	Low	113 Å²	113	118.9 Å²	118.9	53%	0.528	61%	0.613	S	S	.	*	H	α-helix	trans	-69.8	-36	174.9	-72	-168	174.7	0	0	112.3	E207 E208 L214 K215	E207-E211 PolarHBondContact O-N 3.42Å; E208-E211 PolarHBondContact O-N 2.84Å; E211-L214 PolarHBondContact O-N 2.8Å; E211-K215 WeakPolarHBondContact O-CG 3.42Å; E211-K215 PolarHBondContact O-N 3.36Å
212	D	64.2	Low	63.1	Low	100 Å²	100	120.6 Å²	120.6	54%	0.535	65%	0.649	S	S	.	*	H	α-helix	trans	-69	-37.3	175.8	-78.2	-17.2	0	0	0	112	E208 K215 A216	E208-D212 PolarHBondContact O-N 3.13Å; E208-D212 VanDerWaalsContact O-N 3.07Å; D212-K215 PolarHBondContact O-N 3.14Å; D212-A216 WeakPolarHBondContact O-CB 3.49Å; D212-A216 PolarHBondContact O-N 3.25Å; D212-A216 VanDerWaalsContact O-N 3.09Å
213	E	59.6	Low	62.5	Low	141 Å²	141	124 Å²	124	66%	0.659	66%	0.66	S	S	*	*	H	α-helix	trans	-65.3	-42.2	172.2	-76.1	-179.8	171.3	0	0	112.1	N209 K215 A216 E217	N209-E213 WeakPolarHBondContact O-CG 3.27Å; N209-E213 PolarHBondContact O-N 2.97Å; N209-E213 VanDerWaalsContact O-N 3.12Å; E213-K215 VanDerWaalsContact C-N 3.35Å; E213-K215 PolarHBondContact O-N 2.75Å; E213-A216 PolarHBondContact O-N 3.43Å; E213-E217 PolarHBondContact O-N 3.28Å
214	L	59.3	Low	62	Low	116 Å²	116	125.5 Å²	125.5	61%	0.607	67%	0.669	S	S	*	*	H	α-helix	trans	-65.1	-34.5	177	-78.7	158.5	0	0	0	113.1	S210 E211 S218	S210-L214 WeakPolarHBondContact O-CD1 3.49Å; S210-L214 WeakPolarHBondContact O-CG 3.44Å; S210-L214 PolarHBondContact O-N 3.45Å; S210-L214 VanDerWaalsContact O-N 3.08Å; E211-L214 PolarHBondContact O-N 2.8Å; L214-S218 PolarHBondContact O-OG 3.25Å
215	K	58.7	Low	61.2	Low	141 Å²	141	126.8 Å²	126.8	61%	0.613	68%	0.679	S	S	*	*	H	α-helix	trans	-72.6	-32.8	174.3	-76.7	169.2	-178.2	152.8	0	112.4	E211 D212 E213 E217	E211-K215 WeakPolarHBondContact O-CG 3.42Å; E211-K215 PolarHBondContact O-N 3.36Å; D212-K215 PolarHBondContact O-N 3.14Å; E213-K215 VanDerWaalsContact C-N 3.35Å; E213-K215 PolarHBondContact O-N 2.75Å; K215-E217 VanDerWaalsContact C-N 3.34Å
216	A	60	Low	60.5	Low	78 Å²	78	126.2 Å²	126.2	65%	0.645	68%	0.684	S	S	*	*	H	α-helix	trans	-71	-27.8	177.4	0	0	0	0	0	113.1	D212 E213	D212-A216 WeakPolarHBondContact O-CB 3.49Å; D212-A216 PolarHBondContact O-N 3.25Å; D212-A216 VanDerWaalsContact O-N 3.09Å; E213-A216 PolarHBondContact O-N 3.43Å
217	E	56.2	Low	59.9	Low	168 Å²	168	124.6 Å²	124.6	79%	0.785	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-1.7	178.4	-70.7	-167.4	159.4	0	0	114.8	E213 K215 P219	E213-E217 PolarHBondContact O-N 3.28Å; K215-E217 VanDerWaalsContact C-N 3.34Å; E217-P219 VanDerWaalsContact O-CD 3.24Å; E217-P219 WeakPolarHBondContact O-CD 3.46Å
218	S	56.7	Low	59.2	Low	95 Å²	95	124.6 Å²	124.6	66%	0.664	69%	0.692	S	S	*	*			trans	-112.1	69.7	176.2	-57.3	0	0	0	0	113.5	L214 E220	L214-S218 PolarHBondContact O-OG 3.25Å; S218-E220 PolarHBondContact O-N 3.04Å
219	P	54.8	Low	58.5	Low	113 Å²	113	124.8 Å²	124.8	73%	0.734	70%	0.701	S	S	*	*			trans	-76.6	115.3	163.4	5.5	10.8	0	0	0	110.2	E217	E217-P219 VanDerWaalsContact O-CD 3.24Å; E217-P219 WeakPolarHBondContact O-CD 3.46Å
220	E	57.7	Low	57.7	Low	181 Å²	181	126.5 Å²	126.5	85%	0.846	71%	0.713	S	S	*	*			trans	25.2	113.1	157.2	-67.7	178.8	156.3	0	0	119.4	S218	S218-E220 PolarHBondContact O-N 3.04Å
221	L	45.4	Very low	56.8	Low	190 Å²	190	132.7 Å²	132.7	100%	0.995	74%	0.742	S	S	*	*			trans	-95.1	92.4	142.2	-84.2	157.3	0	0	0	107.7
222	A	45.1	Very low	56.2	Low	156 Å²	156	134.5 Å²	134.5	100%	1.289	76%	0.761	S	S	*	*			trans	-77.1	0	158.6	0	0	0	0	0	110.7

Retrieved 222 of 222 residues in 372.8 ms (Link to these results)

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