A0A087WWR4_HUMAN Loading...

Transcriptional adaptor 2 (ADA2 homolog, yeast)-like, isoform CRA_c

AlphaFold DB , UniProt , Accession A0A087WWR4, Species HUMAN (Homo sapiens, Human), Gene TADA2A, Length 305 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	38.8	Very low	238 Å²	238	128.8 Å²	128.8	100%	1.172	68%	0.677	S	S	*	*				0	83.6	0	-78.8	177.9	176.8	0	0	105.4	R3	M1-R3 PolarHBondContact O-N 2.79Å
2	D	30.1	Very low	39.4	Very low	157 Å²	157	125.4 Å²	125.4	84%	0.84	67%	0.672	S	S	*	*			trans	-67.9	127.3	-175.2	-60.4	-62.6	0	0	0	109	L4	D2-L4 PolarHBondContact O-N 3.06Å
3	R	34.9	Very low	41.1	Very low	245 Å²	245	124.8 Å²	124.8	93%	0.925	67%	0.669	S	S	*	*			trans	-67.7	103.9	172.2	-71.2	-178.6	176.9	-176.2	-2.2	106.9	M1 G5	M1-R3 PolarHBondContact O-N 2.79Å; R3-G5 PolarHBondContact O-N 3.5Å; R3-G5 VanDerWaalsContact O-N 3.14Å
4	L	34.4	Very low	43.4	Very low	154 Å²	154	120.9 Å²	120.9	81%	0.806	64%	0.643	S	S	*	*			trans	-61.4	113.1	166.3	-70.9	164.7	0	0	0	106.8	D2	D2-L4 PolarHBondContact O-N 3.06Å
5	G	33.2	Very low	46.1	Very low	52 Å²	52	115.2 Å²	115.2	54%	0.536	62%	0.615	S	S	.	*			trans	-65.7	151.4	177	0	0	0	0	0	111.2	R3 F7	R3-G5 PolarHBondContact O-N 3.5Å; R3-G5 VanDerWaalsContact O-N 3.14Å; G5-F7 WeakPolarHBondContact O-CD2 3.33Å; G5-F7 PolarHBondContact O-N 3.49Å
6	S	36.7	Very low	48.9	Very low	61 Å²	61	111.5 Å²	111.5	43%	0.427	60%	0.6	S	S	.	*			trans	-55.2	120.3	173.1	-174.6	0	0	0	0	109.9	S8	S6-S8 VanDerWaalsContact C-N 3.29Å; S6-S8 PolarHBondContact O-N 3.07Å
7	F	42.2	Very low	51.5	Low	164 Å²	164	105.1 Å²	105.1	72%	0.719	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	12.7	-168.2	-94	-78.4	0	0	0	115.5	G5	G5-F7 WeakPolarHBondContact O-CD2 3.33Å; G5-F7 PolarHBondContact O-N 3.49Å
8	S	45.4	Very low	53.8	Low	48 Å²	48	105.1 Å²	105.1	34%	0.336	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-139	0.2	-168.7	52.7	0	0	0	0	116.2	S6 E85	S6-S8 VanDerWaalsContact C-N 3.29Å; S6-S8 PolarHBondContact O-N 3.07Å; S8-E85 WeakPolarHBondContact CB-OE2 3.25Å; S8-E85 PolarHBondContact OG-OE2 2.89Å
9	N	44.3	Very low	55.6	Low	129 Å²	129	100.9 Å²	100.9	69%	0.69	54%	0.541	S	S	*	.			trans	-126.6	15.4	179.4	-88.5	-40	0	0	0	115	P11	N9-P11 VanDerWaalsContact O-CD 3.29Å; N9-P11 WeakPolarHBondContact O-CD 3.36Å
10	D	45.3	Very low	57.4	Low	84 Å²	84	99.1 Å²	99.1	45%	0.449	54%	0.535	S	S	.	.			trans	-74.2	119.1	167.7	-158.3	-32.9	0	0	0	108.7	S12 D13	D10-S12 PolarHBondContact O-N 3.11Å; D10-S12 VanDerWaalsContact OD1-CB 3.25Å; D10-S12 WeakPolarHBondContact OD1-CB 3.38Å; D10-S12 PolarHBondContact OD1-N 2.94Å; D10-S12 VanDerWaalsContact OD1-N 3.14Å; D10-S12 PolarHBondContact OD1-OG 2.97Å; D10-D13 PolarHBondContact O-N 3.48Å; D10-D13 VanDerWaalsContact O-N 3.15Å
11	P	46.7	Very low	59	Low	85 Å²	85	99 Å²	99	55%	0.552	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-54.9	-16.5	174.6	-23.3	34	0	0	0	113.4	N9	N9-P11 VanDerWaalsContact O-CD 3.29Å; N9-P11 WeakPolarHBondContact O-CD 3.36Å
12	S	46.6	Very low	61.7	Low	88 Å²	88	90.2 Å²	90.2	62%	0.615	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-73.2	-18.8	-179.6	-50.5	0	0	0	0	114.6	D10	D10-S12 PolarHBondContact O-N 3.11Å; D10-S12 VanDerWaalsContact OD1-CB 3.25Å; D10-S12 WeakPolarHBondContact OD1-CB 3.38Å; D10-S12 PolarHBondContact OD1-N 2.94Å; D10-S12 VanDerWaalsContact OD1-N 3.14Å; D10-S12 PolarHBondContact OD1-OG 2.97Å
13	D	61.7	Low	64.6	Low	118 Å²	118	89.9 Å²	89.9	63%	0.631	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-91	-7.8	-178	-74.5	-32.5	0	0	0	113.9	D10	D10-D13 PolarHBondContact O-N 3.48Å; D10-D13 VanDerWaalsContact O-N 3.15Å
14	K	73.3	Confident	67.2	Low	70 Å²	70	78.5 Å²	78.5	30%	0.304	45%	0.45	S	S	.	.	S	Bend	trans	-80.8	125.1	-178.9	-68.1	178.3	-178.6	175.9	0	110.4	Y23 M25	K14-Y23 HydrophobicContact CB-CD1 4.4Å; K14-Y23 WeakPolarHBondContact O-CD1 3.47Å; K14-M25 HydrophobicContact CD-SD 3.91Å; K14-M25 PolarHBondContact NZ-SD 3.25Å
15	P	83.9	Confident	69.6	Low	35 Å²	35	77 Å²	77	23%	0.227	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-63.1	140.1	-179.5	23.4	-31	0	0	0	110.8	L24 Y28 F40	P15-L24 HydrophobicContact CB-CD1 4.41Å; P15-L24 HydrophobicContact CG-CD1 4.19Å; P15-L24 VanDerWaalsContact O-CB 3.24Å; P15-L24 WeakPolarHBondContact O-CB 3.2Å; P15-L24 WeakPolarHBondContact O-CD1 3.17Å; P15-L24 WeakPolarHBondContact O-CG 3.38Å; P15-L24 PolarHBondContact O-N 3.14Å; P15-Y28 HydrophobicContact CG-CE2 4.37Å; P15-F40 HydrophobicContact CB-CD2 3.61Å; P15-F40 HydrophobicContact CB-CE2 3.86Å; P15-F40 HydrophobicContact CB-CG 4.4Å; P15-F40 HydrophobicContact CG-CD2 4.17Å; P15-F40 HydrophobicContact CG-CE2 4.31Å
16	P	91.3	Very high	72.1	Confident	56 Å²	56	78.6 Å²	78.6	36%	0.364	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-77.9	144	175.8	30.4	-33.9	0	0	0	111.3	R18	P16-R18 PolarHBondContact O-N 3.38Å
17	C	92.9	Very high	74.7	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.014	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-62.6	129.2	169.9	180	0	0	0	0	110.3	G19 C20 S21 S22 L24 C42	C17-G19 PolarHBondContact O-N 2.94Å; C17-G19 PolarHBondContact SG-N 2.93Å; C17-G19 VanDerWaalsContact SG-N 3.37Å; C17-C20 VanDerWaalsContact CB-SG 3.52Å; C17-C20 PolarHBondContact SG-SG 3.42Å; C17-S21 WeakPolarHBondContact O-CA 3.29Å; C17-S21 PolarHBondContact O-N 3.46Å; C17-S22 WeakPolarHBondContact CB-O 3.19Å; C17-S22 PolarHBondContact N-O 3.48Å; C17-L24 HydrophobicContact CB-CD2 3.72Å; C17-L24 HydrophobicContact CB-CG 4.25Å; C17-C42 HydrophobicContact CB-CB 4.36Å; C17-C42 PolarHBondContact SG-N 3.14Å
18	R	91.6	Very high	77.1	Confident	106 Å²	106	72 Å²	72	40%	0.4	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.3	177	-65.9	-62.4	-172.3	-154.9	-3.4	113.9	P16 F39 F40 L41	P16-R18 PolarHBondContact O-N 3.38Å; R18-F39 HydrophobicContact CB-CD1 4.35Å; R18-F39 HydrophobicContact CB-CD2 4.21Å; R18-F39 HydrophobicContact CB-CE1 3.89Å; R18-F39 HydrophobicContact CB-CE2 3.74Å; R18-F39 HydrophobicContact CB-CZ 3.56Å; R18-F39 HydrophobicContact CG-CD1 4.31Å; R18-F39 HydrophobicContact CG-CD2 3.85Å; R18-F39 HydrophobicContact CG-CE1 4.33Å; R18-F39 HydrophobicContact CG-CE2 3.88Å; R18-F39 HydrophobicContact CG-CG 4.08Å; R18-F39 HydrophobicContact CG-CZ 4.13Å; R18-F40 PolarHBondContact N-O 3Å; R18-L41 HydrophobicContact CB-CD2 4.31Å
19	G	89.4	Confident	79.3	Confident	26 Å²	26	70.1 Å²	70.1	27%	0.268	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-49.1	179.8	0	0	0	0	0	114.8	C17 F50	C17-G19 PolarHBondContact O-N 2.94Å; C17-G19 PolarHBondContact SG-N 2.93Å; C17-G19 VanDerWaalsContact SG-N 3.37Å; G19-F50 VanDerWaalsContact CA-CZ 3.42Å
20	C	92	Very high	81.7	Confident	64 Å²	64	67 Å²	67	43%	0.432	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-1.6	-175.2	59.7	0	0	0	0	114.2	C17 S22	C17-C20 VanDerWaalsContact CB-SG 3.52Å; C17-C20 PolarHBondContact SG-SG 3.42Å; C20-S22 PolarHBondContact O-N 3.23Å; C20-S22 PolarHBondContact SG-OG 3.07Å
21	S	90.8	Very high	83.9	Confident	97 Å²	97	63.2 Å²	63.2	68%	0.678	35%	0.349	S	S	*	.			trans	59.2	9.6	-176.5	-52.7	0	0	0	0	115.4	C17	C17-S21 WeakPolarHBondContact O-CA 3.29Å; C17-S21 PolarHBondContact O-N 3.46Å
22	S	89.9	Confident	86.1	Confident	54 Å²	54	61.6 Å²	61.6	38%	0.378	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-74.1	148.5	173	69.6	0	0	0	0	110.9	C17 C20 L24	C17-S22 WeakPolarHBondContact CB-O 3.19Å; C17-S22 PolarHBondContact N-O 3.48Å; C20-S22 PolarHBondContact O-N 3.23Å; C20-S22 PolarHBondContact SG-OG 3.07Å; S22-L24 PolarHBondContact O-N 3.09Å
23	Y	90.6	Very high	88.3	Confident	150 Å²	150	62.4 Å²	62.4	59%	0.588	34%	0.337	S	S	*	.	B	Isolated β-bridge	trans	-60.5	133.9	170.1	-64	-73.9	0	0	0	110.6	K14	K14-Y23 HydrophobicContact CB-CD1 4.4Å; K14-Y23 WeakPolarHBondContact O-CD1 3.47Å
24	L	88.9	Confident	89.7	Confident	5 Å²	5	57.8 Å²	57.8	3%	0.026	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-79.7	134.3	-179.1	-67	170.8	0	0	0	110.6	P15 C17 S22 Y28 F40 C42	P15-L24 HydrophobicContact CB-CD1 4.41Å; P15-L24 HydrophobicContact CG-CD1 4.19Å; P15-L24 VanDerWaalsContact O-CB 3.24Å; P15-L24 WeakPolarHBondContact O-CB 3.2Å; P15-L24 WeakPolarHBondContact O-CD1 3.17Å; P15-L24 WeakPolarHBondContact O-CG 3.38Å; P15-L24 PolarHBondContact O-N 3.14Å; C17-L24 HydrophobicContact CB-CD2 3.72Å; C17-L24 HydrophobicContact CB-CG 4.25Å; S22-L24 PolarHBondContact O-N 3.09Å; L24-Y28 HydrophobicContact CB-CD1 4Å; L24-Y28 HydrophobicContact CB-CG 4Å; L24-Y28 HydrophobicContact CD1-CD2 3.76Å; L24-Y28 HydrophobicContact CD1-CE2 4.27Å; L24-Y28 HydrophobicContact CD1-CG 4.01Å; L24-Y28 HydrophobicContact CG-CG 4.4Å; L24-F40 HydrophobicContact CD1-CB 3.32Å; L24-F40 HydrophobicContact CD1-CG 4.22Å; L24-C42 HydrophobicContact CD2-CB 3.62Å
25	M	85.4	Confident	90.2	Very high	123 Å²	123	57.2 Å²	57.2	61%	0.606	33%	0.328	S	S	*	.			trans	-110.2	139.2	166.5	-65.6	-65.2	-64.2	0	0	106.8	K14 P27	K14-M25 HydrophobicContact CD-SD 3.91Å; K14-M25 PolarHBondContact NZ-SD 3.25Å; M25-P27 CarbonylContact O-C 3.44Å
26	E	85.8	Confident	90.2	Very high	86 Å²	86	61.9 Å²	61.9	40%	0.402	36%	0.358	S	S	.	.	S	Bend	trans	-61.8	143	172	-69.2	-174.4	-176.4	0	0	110.5	Y28 S66	E26-Y28 HydrophobicContact CG-CD1 3.87Å; E26-Y28 HydrophobicContact CG-CE1 3.66Å; E26-S66 VanDerWaalsContact OE2-CB 3.26Å; E26-S66 WeakPolarHBondContact OE2-CB 3.36Å; E26-S66 PolarHBondContact OE2-N 3.46Å; E26-S66 PolarHBondContact OE2-OG 2.6Å
27	P	90.3	Very high	89.9	Confident	60 Å²	60	63.4 Å²	63.4	39%	0.39	37%	0.368	S	S	.	.	S	Bend	cis	-80.8	142.6	-3.5	30.9	-32.6	0	0	0	113.3	M25 L43 I63 M64	M25-P27 CarbonylContact O-C 3.44Å; P27-L43 HydrophobicContact CG-CD1 4.23Å; P27-I63 HydrophobicContact CB-CG2 4.34Å; P27-M64 VanDerWaalsContact CA-O 3.26Å; P27-M64 WeakPolarHBondContact CA-O 3.15Å
28	Y	92.2	Very high	89.6	Confident	27 Å²	27	66.2 Å²	66.2	11%	0.106	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	165.7	175.1	64.9	-91.8	0	0	0	112.3	P15 L24 E26 F40 M64	P15-Y28 HydrophobicContact CG-CE2 4.37Å; L24-Y28 HydrophobicContact CB-CD1 4Å; L24-Y28 HydrophobicContact CB-CG 4Å; L24-Y28 HydrophobicContact CD1-CD2 3.76Å; L24-Y28 HydrophobicContact CD1-CE2 4.27Å; L24-Y28 HydrophobicContact CD1-CG 4.01Å; L24-Y28 HydrophobicContact CG-CG 4.4Å; E26-Y28 HydrophobicContact CG-CD1 3.87Å; E26-Y28 HydrophobicContact CG-CE1 3.66Å; Y28-F40 HydrophobicContact CD2-CB 4.41Å; Y28-F40 HydrophobicContact CD2-CD1 4.12Å; Y28-F40 AromaticContact CE2-CD1 3.67Å; Y28-F40 HydrophobicContact CE2-CD1 3.67Å; Y28-F40 HydrophobicContact CE2-CE1 4.02Å; Y28-F40 HydrophobicContact CE2-CG 4.24Å; Y28-M64 HydrophobicContact CD1-CB 4.21Å; Y28-M64 HydrophobicContact CD2-CB 3.99Å; Y28-M64 HydrophobicContact CD2-CG 4Å; Y28-M64 HydrophobicContact CE1-CB 3.9Å; Y28-M64 HydrophobicContact CE2-CB 3.69Å; Y28-M64 HydrophobicContact CE2-CG 3.54Å; Y28-M64 HydrophobicContact CG-CB 4.24Å; Y28-M64 PolarHBondContact N-O 3.16Å; Y28-M64 VanDerWaalsContact N-O 3.15Å; Y28-M64 PolarHBondContact O-N 3.48Å
29	I	93.1	Very high	89.6	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.036	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.7	-173.8	-57.1	-82.5	0	0	0	109.5	F40 L41 L43 F46 Y61 I63	I29-F40 CarbonylContact O-C 3.37Å; I29-F40 VanDerWaalsContact O-CA 3.29Å; I29-F40 WeakPolarHBondContact O-CA 3.19Å; I29-L41 HydrophobicContact CB-CB 4.34Å; I29-L41 PolarHBondContact N-O 3.5Å; I29-L41 PolarHBondContact O-N 2.97Å; I29-L43 HydrophobicContact CD1-CD2 4.4Å; I29-L43 HydrophobicContact CG1-CD2 4.17Å; I29-F46 HydrophobicContact CB-CD2 4.29Å; I29-F46 HydrophobicContact CB-CG 4.4Å; I29-F46 HydrophobicContact CD1-CD1 3.88Å; I29-F46 HydrophobicContact CD1-CD2 4.29Å; I29-F46 HydrophobicContact CD1-CE1 4.02Å; I29-F46 HydrophobicContact CD1-CE2 4.42Å; I29-F46 HydrophobicContact CD1-CG 4.02Å; I29-F46 HydrophobicContact CD1-CZ 4.29Å; I29-F46 HydrophobicContact CG1-CB 3.88Å; I29-F46 HydrophobicContact CG1-CD1 4Å; I29-F46 HydrophobicContact CG1-CD2 4.02Å; I29-F46 HydrophobicContact CG1-CG 3.69Å; I29-F46 HydrophobicContact CG2-CD2 3.82Å; I29-F46 HydrophobicContact CG2-CE2 4.05Å; I29-F46 HydrophobicContact CG2-CG 4.38Å; I29-Y61 HydrophobicContact CD1-CD2 3.74Å; I29-Y61 HydrophobicContact CD1-CE2 3.94Å; I29-Y61 HydrophobicContact CG2-CD2 4.08Å; I29-Y61 HydrophobicContact CG2-CG 4.18Å; I29-I63 HydrophobicContact CD1-CG1 4.15Å
30	K	93.6	Very high	89.8	Confident	63 Å²	63	62.5 Å²	62.5	27%	0.274	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.9	166.6	176.7	-173.3	164.1	-147.5	0	108.6	A32 F40 Y61 E62 M64	K30-A32 PolarHBondContact O-N 3Å; K30-F40 HydrophobicContact CB-CD1 3.76Å; K30-F40 HydrophobicContact CB-CE1 3.8Å; K30-F40 HydrophobicContact CD-CE1 3.87Å; K30-F40 HydrophobicContact CG-CD1 3.92Å; K30-F40 HydrophobicContact CG-CE1 3.6Å; K30-Y61 CarbonylContact O-C 3.6Å; K30-Y61 WeakPolarHBondContact O-CA 3.35Å; K30-E62 HydrophobicContact CB-CB 4.4Å; K30-E62 WeakPolarHBondContact CD-OE2 3.49Å; K30-E62 PolarHBondContact N-O 2.94Å; K30-E62 IonicContact NZ-OE2 2.83Å; K30-E62 PolarHBondContact NZ-OE2 3.2Å; K30-E62 PolarHBondContact O-N 2.89Å; K30-M64 HydrophobicContact CB-CG 3.95Å; K30-M64 HydrophobicContact CB-SD 4.17Å; K30-M64 HydrophobicContact CD-SD 4.08Å
31	C	93.1	Very high	89.9	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.034	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.6	172	-175	0	0	0	0	109.5	C34 F39 H55 H59	C31-C34 HydrophobicContact CB-CB 3.93Å; C31-C34 PolarHBondContact SG-N 3.27Å; C31-F39 HydrophobicContact CB-CB 4.07Å; C31-F39 HydrophobicContact CB-CD1 4.45Å; C31-F39 PolarHBondContact N-O 3.36Å; C31-H55 PolarHBondContact SG-ND1 3.22Å; C31-H59 VanDerWaalsContact SG-CB 3.57Å; C31-H59 PolarHBondContact SG-ND1 3.29Å; C31-H59 VanDerWaalsContact SG-ND1 3.44Å
32	A	92.8	Very high	90	Very high	51 Å²	51	56 Å²	56	42%	0.421	32%	0.32	S	S	.	.	S	Bend	trans	-77.9	-26.5	179.4	0	0	0	0	0	112.2	K30 T60	K30-A32 PolarHBondContact O-N 3Å; A32-T60 WeakPolarHBondContact CB-O 3.46Å; A32-T60 PolarHBondContact N-O 3.26Å
33	E	91.9	Very high	90.1	Very high	105 Å²	105	57.2 Å²	57.2	49%	0.491	32%	0.322	S	S	.	.	S	Bend	trans	-91.7	-24.1	-176.6	-67.1	173.6	-134.8	0	0	114.3	H59 T60	E33-H59 HydrophobicContact CB-CB 4.38Å; E33-H59 IonicContact OE2-CD2 2.82Å; E33-H59 PolarHBondContact OE2-CD2 3.42Å; E33-H59 IonicContact OE2-CG 3.75Å; E33-H59 IonicContact OE2-NE2 3.99Å; E33-T60 WeakPolarHBondContact CG-OG1 3.33Å; E33-T60 WeakPolarHBondContact OE1-CB 3.44Å; E33-T60 PolarHBondContact OE1-N 3Å; E33-T60 PolarHBondContact OE1-OG1 3.29Å
34	C	90.6	Very high	90.3	Very high	22 Å²	22	56.5 Å²	56.5	15%	0.149	32%	0.324	C	S	.	.			trans	-92.8	116.3	-173.9	-73	0	0	0	0	112.6	C31 F39 H55 H59	C31-C34 HydrophobicContact CB-CB 3.93Å; C31-C34 PolarHBondContact SG-N 3.27Å; C34-F39 HydrophobicContact CB-CB 3.56Å; C34-F39 HydrophobicContact CB-CG 4.23Å; C34-H55 VanDerWaalsContact SG-CA 3.59Å; C34-H59 VanDerWaalsContact SG-CE1 3.53Å; C34-H59 PolarHBondContact SG-ND1 3.3Å
35	G	84.3	Confident	90.4	Very high	58 Å²	58	56.8 Å²	56.8	60%	0.598	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	174.2	170.9	166.4	0	0	0	0	0	113.1
36	P	83.4	Confident	90.8	Very high	133 Å²	133	53.4 Å²	53.4	86%	0.864	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87	148.2	-15.3	32	-30.2	0	0	0	112.9
37	P	85.2	Confident	91	Very high	88 Å²	88	54.7 Å²	54.7	57%	0.571	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	cis	-78	158.2	3.2	32.8	-36	0	0	0	113.2
38	P	87.4	Confident	91.1	Very high	61 Å²	61	61.5 Å²	61.5	40%	0.396	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	146.9	178	25.4	-34.4	0	0	0	111.5	F40	P38-F40 HydrophobicContact CB-CE1 4.47Å; P38-F40 HydrophobicContact CB-CE2 3.95Å; P38-F40 HydrophobicContact CB-CZ 3.84Å; P38-F40 HydrophobicContact CG-CE2 3.83Å; P38-F40 HydrophobicContact CG-CZ 4.04Å
39	F	91.4	Very high	91	Very high	20 Å²	20	61.8 Å²	61.8	9%	0.088	35%	0.351	C	S	.	.			trans	-110.7	111.3	-174.4	-160.7	-81.9	0	0	0	110.4	R18 C31 C34 L41 F50 Y52 H55	R18-F39 HydrophobicContact CB-CD1 4.35Å; R18-F39 HydrophobicContact CB-CD2 4.21Å; R18-F39 HydrophobicContact CB-CE1 3.89Å; R18-F39 HydrophobicContact CB-CE2 3.74Å; R18-F39 HydrophobicContact CB-CZ 3.56Å; R18-F39 HydrophobicContact CG-CD1 4.31Å; R18-F39 HydrophobicContact CG-CD2 3.85Å; R18-F39 HydrophobicContact CG-CE1 4.33Å; R18-F39 HydrophobicContact CG-CE2 3.88Å; R18-F39 HydrophobicContact CG-CG 4.08Å; R18-F39 HydrophobicContact CG-CZ 4.13Å; C31-F39 HydrophobicContact CB-CB 4.07Å; C31-F39 HydrophobicContact CB-CD1 4.45Å; C31-F39 PolarHBondContact N-O 3.36Å; C34-F39 HydrophobicContact CB-CB 3.56Å; C34-F39 HydrophobicContact CB-CG 4.23Å; F39-L41 HydrophobicContact CD1-CD1 4.49Å; F39-L41 HydrophobicContact CD1-CD2 4.43Å; F39-L41 HydrophobicContact CD1-CG 4.09Å; F39-L41 HydrophobicContact CE1-CD1 3.96Å; F39-L41 HydrophobicContact CE1-CD2 3.66Å; F39-L41 HydrophobicContact CE1-CG 3.7Å; F39-L41 HydrophobicContact CZ-CD2 4.41Å; F39-F50 HydrophobicContact CZ-CD1 4.38Å; F39-F50 HydrophobicContact CZ-CE1 4.07Å; F39-Y52 HydrophobicContact CE2-CD1 4.42Å; F39-H55 HydrophobicContact CD1-CB 4.34Å; F39-H55 AromaticContact CD1-CD2 3.92Å; F39-H55 AromaticContact CD1-CG 3.84Å; F39-H55 HydrophobicContact CD2-CB 4.24Å; F39-H55 HydrophobicContact CE1-CB 4Å; F39-H55 AromaticContact CE1-CD2 3.23Å; F39-H55 WeakPolarHBondContact CE1-CD2 3.21Å; F39-H55 AromaticContact CE1-CG 3.51Å; F39-H55 AromaticContact CE1-NE2 3.69Å; F39-H55 HydrophobicContact CE2-CB 3.91Å; F39-H55 HydrophobicContact CG-CB 4.44Å; F39-H55 HydrophobicContact CZ-CB 3.77Å; F39-H55 AromaticContact CZ-CD2 3.62Å; F39-H55 AromaticContact CZ-CG 3.79Å
40	F	94.1	Very high	90.8	Very high	34 Å²	34	64.1 Å²	64.1	15%	0.149	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.6	-178.7	-55.3	-66.4	0	0	0	111.8	P15 R18 L24 Y28 I29 K30 P38	P15-F40 HydrophobicContact CB-CD2 3.61Å; P15-F40 HydrophobicContact CB-CE2 3.86Å; P15-F40 HydrophobicContact CB-CG 4.4Å; P15-F40 HydrophobicContact CG-CD2 4.17Å; P15-F40 HydrophobicContact CG-CE2 4.31Å; R18-F40 PolarHBondContact N-O 3Å; L24-F40 HydrophobicContact CD1-CB 3.32Å; L24-F40 HydrophobicContact CD1-CG 4.22Å; Y28-F40 HydrophobicContact CD2-CB 4.41Å; Y28-F40 HydrophobicContact CD2-CD1 4.12Å; Y28-F40 AromaticContact CE2-CD1 3.67Å; Y28-F40 HydrophobicContact CE2-CD1 3.67Å; Y28-F40 HydrophobicContact CE2-CE1 4.02Å; Y28-F40 HydrophobicContact CE2-CG 4.24Å; I29-F40 CarbonylContact O-C 3.37Å; I29-F40 VanDerWaalsContact O-CA 3.29Å; I29-F40 WeakPolarHBondContact O-CA 3.19Å; K30-F40 HydrophobicContact CB-CD1 3.76Å; K30-F40 HydrophobicContact CB-CE1 3.8Å; K30-F40 HydrophobicContact CD-CE1 3.87Å; K30-F40 HydrophobicContact CG-CD1 3.92Å; K30-F40 HydrophobicContact CG-CE1 3.6Å; P38-F40 HydrophobicContact CB-CE1 4.47Å; P38-F40 HydrophobicContact CB-CE2 3.95Å; P38-F40 HydrophobicContact CB-CZ 3.84Å; P38-F40 HydrophobicContact CG-CE2 3.83Å; P38-F40 HydrophobicContact CG-CZ 4.04Å
41	L	92.7	Very high	90.7	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.016	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	142.9	178.7	-68.6	177.9	0	0	0	111.1	R18 I29 F39 C45 F46 F50 H55	R18-L41 HydrophobicContact CB-CD2 4.31Å; I29-L41 HydrophobicContact CB-CB 4.34Å; I29-L41 PolarHBondContact N-O 3.5Å; I29-L41 PolarHBondContact O-N 2.97Å; F39-L41 HydrophobicContact CD1-CD1 4.49Å; F39-L41 HydrophobicContact CD1-CD2 4.43Å; F39-L41 HydrophobicContact CD1-CG 4.09Å; F39-L41 HydrophobicContact CE1-CD1 3.96Å; F39-L41 HydrophobicContact CE1-CD2 3.66Å; F39-L41 HydrophobicContact CE1-CG 3.7Å; F39-L41 HydrophobicContact CZ-CD2 4.41Å; L41-C45 HydrophobicContact CB-CB 4.5Å; L41-C45 HydrophobicContact CD2-CB 3.98Å; L41-F46 HydrophobicContact CB-CB 4.44Å; L41-F46 HydrophobicContact CD1-CD2 4.46Å; L41-F50 HydrophobicContact CD2-CD1 3.71Å; L41-F50 HydrophobicContact CD2-CE1 4.34Å; L41-F50 HydrophobicContact CD2-CG 4.45Å; L41-H55 WeakPolarHBondContact CD1-NE2 3.2Å
42	C	94.2	Very high	90.4	Very high	20 Å²	20	71 Å²	71	14%	0.135	39%	0.39	C	S	.	.			trans	-73.4	158.2	164.4	73.2	0	0	0	0	109.4	C17 L24 Q44 C45 F46	C17-C42 HydrophobicContact CB-CB 4.36Å; C17-C42 PolarHBondContact SG-N 3.14Å; L24-C42 HydrophobicContact CD2-CB 3.62Å; C42-Q44 PolarHBondContact O-N 3.3Å; C42-Q44 VanDerWaalsContact O-N 3.14Å; C42-C45 PolarHBondContact O-N 2.93Å; C42-C45 VanDerWaalsContact O-N 3.11Å; C42-C45 PolarHBondContact SG-N 3.26Å; C42-C45 VanDerWaalsContact SG-N 3.38Å; C42-C45 VanDerWaalsContact SG-SG 3.6Å; C42-F46 PolarHBondContact O-N 2.98Å
43	L	91.8	Very high	90.1	Very high	81 Å²	81	76.7 Å²	76.7	42%	0.424	41%	0.405	S	S	.	.	H	α-helix	trans	-55.7	-34.8	179.9	-61.9	179.3	0	0	0	112.9	P27 I29 F46 T47	P27-L43 HydrophobicContact CG-CD1 4.23Å; I29-L43 HydrophobicContact CD1-CD2 4.4Å; I29-L43 HydrophobicContact CG1-CD2 4.17Å; L43-F46 PolarHBondContact O-N 3.46Å; L43-T47 WeakPolarHBondContact O-CB 3.34Å; L43-T47 VanDerWaalsContact O-CG2 3.32Å; L43-T47 WeakPolarHBondContact O-CG2 3.42Å; L43-T47 PolarHBondContact O-N 3.38Å; L43-T47 PolarHBondContact O-OG1 2.85Å
44	Q	93.3	Very high	90	Very high	134 Å²	134	80.5 Å²	80.5	63%	0.626	42%	0.42	S	S	*	.	H	α-helix	trans	-69	-40.7	179.6	-64.1	-178.9	2.5	0	0	112.5	C42 T47 R48	C42-Q44 PolarHBondContact O-N 3.3Å; C42-Q44 VanDerWaalsContact O-N 3.14Å; Q44-T47 PolarHBondContact O-OG1 2.92Å; Q44-R48 WeakPolarHBondContact O-CD 3.43Å; Q44-R48 VanDerWaalsContact O-CG 3.26Å; Q44-R48 WeakPolarHBondContact O-CG 3.23Å; Q44-R48 PolarHBondContact O-N 2.88Å
45	C	92.8	Very high	90	Very high	12 Å²	12	80 Å²	80	8%	0.081	42%	0.415	C	S	.	.	H	α-helix	trans	-69.7	-38.8	175.3	-72.9	0	0	0	0	111.2	L41 C42 R48 F50	L41-C45 HydrophobicContact CB-CB 4.5Å; L41-C45 HydrophobicContact CD2-CB 3.98Å; C42-C45 PolarHBondContact O-N 2.93Å; C42-C45 VanDerWaalsContact O-N 3.11Å; C42-C45 PolarHBondContact SG-N 3.26Å; C42-C45 VanDerWaalsContact SG-N 3.38Å; C42-C45 VanDerWaalsContact SG-SG 3.6Å; C45-R48 PolarHBondContact O-N 2.74Å; C45-F50 HydrophobicContact CB-CB 4.06Å; C45-F50 HydrophobicContact CB-CG 4.48Å; C45-F50 WeakPolarHBondContact O-CB 3.35Å; C45-F50 PolarHBondContact O-N 3.38Å
46	F	92.5	Very high	90.3	Very high	52 Å²	52	80.7 Å²	80.7	23%	0.228	40%	0.403	C	S	.	.	H	α-helix	trans	-63	-50.9	177.6	-178.8	-105.7	0	0	0	112.3	I29 L41 C42 L43 R48 G49 Y61	I29-F46 HydrophobicContact CB-CD2 4.29Å; I29-F46 HydrophobicContact CB-CG 4.4Å; I29-F46 HydrophobicContact CD1-CD1 3.88Å; I29-F46 HydrophobicContact CD1-CD2 4.29Å; I29-F46 HydrophobicContact CD1-CE1 4.02Å; I29-F46 HydrophobicContact CD1-CE2 4.42Å; I29-F46 HydrophobicContact CD1-CG 4.02Å; I29-F46 HydrophobicContact CD1-CZ 4.29Å; I29-F46 HydrophobicContact CG1-CB 3.88Å; I29-F46 HydrophobicContact CG1-CD1 4Å; I29-F46 HydrophobicContact CG1-CD2 4.02Å; I29-F46 HydrophobicContact CG1-CG 3.69Å; I29-F46 HydrophobicContact CG2-CD2 3.82Å; I29-F46 HydrophobicContact CG2-CE2 4.05Å; I29-F46 HydrophobicContact CG2-CG 4.38Å; L41-F46 HydrophobicContact CB-CB 4.44Å; L41-F46 HydrophobicContact CD1-CD2 4.46Å; C42-F46 PolarHBondContact O-N 2.98Å; L43-F46 PolarHBondContact O-N 3.46Å; F46-R48 PolarHBondContact O-N 3.45Å; F46-G49 PolarHBondContact O-N 2.88Å; F46-Y61 HydrophobicContact CE1-CE1 4.48Å; F46-Y61 HydrophobicContact CE1-CE2 4.42Å; F46-Y61 AromaticContact CE2-CD1 4Å; F46-Y61 HydrophobicContact CE2-CD1 4Å; F46-Y61 HydrophobicContact CE2-CE1 4.3Å; F46-Y61 HydrophobicContact CE2-CG 4.12Å; F46-Y61 AromaticContact CZ-CD1 3.74Å; F46-Y61 HydrophobicContact CZ-CD1 3.74Å; F46-Y61 HydrophobicContact CZ-CD2 4.19Å; F46-Y61 AromaticContact CZ-CE1 3.57Å; F46-Y61 HydrophobicContact CZ-CE1 3.57Å; F46-Y61 HydrophobicContact CZ-CE2 4.03Å; F46-Y61 HydrophobicContact CZ-CG 4.06Å; F46-Y61 AromaticContact CZ-CZ 3.72Å
47	T	90.4	Very high	90.6	Very high	113 Å²	113	77 Å²	77	69%	0.693	38%	0.38	S	S	*	.	H	α-helix	trans	-64.6	-21	179.5	49.4	0	0	0	0	114.5	L43 Q44 G49	L43-T47 WeakPolarHBondContact O-CB 3.34Å; L43-T47 VanDerWaalsContact O-CG2 3.32Å; L43-T47 WeakPolarHBondContact O-CG2 3.42Å; L43-T47 PolarHBondContact O-N 3.38Å; L43-T47 PolarHBondContact O-OG1 2.85Å; Q44-T47 PolarHBondContact O-OG1 2.92Å; T47-G49 VanDerWaalsContact C-N 3.28Å
48	R	92.6	Very high	90.9	Very high	203 Å²	203	79.1 Å²	79.1	77%	0.766	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.4	172.5	-72.7	175.8	179.2	175.5	1.8	113.5	Q44 C45 F46	Q44-R48 WeakPolarHBondContact O-CD 3.43Å; Q44-R48 VanDerWaalsContact O-CG 3.26Å; Q44-R48 WeakPolarHBondContact O-CG 3.23Å; Q44-R48 PolarHBondContact O-N 2.88Å; C45-R48 PolarHBondContact O-N 2.74Å; F46-R48 PolarHBondContact O-N 3.45Å
49	G	89.9	Confident	91.1	Very high	32 Å²	32	77.6 Å²	77.6	33%	0.33	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	45.9	-175	0	0	0	0	0	111.8	F46 T47 E51	F46-G49 PolarHBondContact O-N 2.88Å; T47-G49 VanDerWaalsContact C-N 3.28Å; G49-E51 PolarHBondContact O-N 3.43Å
50	F	89.5	Confident	91.2	Very high	57 Å²	57	80.7 Å²	80.7	25%	0.25	40%	0.395	C	S	.	.			trans	-64.1	117.3	-179.9	179.4	-94.4	0	0	0	111.4	G19 F39 L41 C45 Y52 H55	G19-F50 VanDerWaalsContact CA-CZ 3.42Å; F39-F50 HydrophobicContact CZ-CD1 4.38Å; F39-F50 HydrophobicContact CZ-CE1 4.07Å; L41-F50 HydrophobicContact CD2-CD1 3.71Å; L41-F50 HydrophobicContact CD2-CE1 4.34Å; L41-F50 HydrophobicContact CD2-CG 4.45Å; C45-F50 HydrophobicContact CB-CB 4.06Å; C45-F50 HydrophobicContact CB-CG 4.48Å; C45-F50 WeakPolarHBondContact O-CB 3.35Å; C45-F50 PolarHBondContact O-N 3.38Å; F50-Y52 HydrophobicContact CE1-CG 4.41Å; F50-Y52 HydrophobicContact CZ-CD2 4.45Å; F50-Y52 HydrophobicContact CZ-CG 4.34Å; F50-H55 PolarHBondContact O-CD2 3.18Å; F50-H55 VanDerWaalsContact O-CD2 3.25Å; F50-H55 PolarHBondContact O-NE2 3.38Å
51	E	91.5	Very high	91.1	Very high	95 Å²	95	84.7 Å²	84.7	44%	0.444	41%	0.41	S	S	.	.			trans	-113.4	140.1	178.1	-66.8	179	170.6	0	0	110.5	G49 Q56 S57	G49-E51 PolarHBondContact O-N 3.43Å; E51-Q56 VanDerWaalsContact CD-OE1 3.3Å; E51-Q56 PolarHBondContact OE1-OE1 3.01Å; E51-Q56 PolarHBondContact OE2-OE1 3.38Å; E51-S57 VanDerWaalsContact OE1-CB 3.31Å; E51-S57 WeakPolarHBondContact OE1-CB 3.28Å; E51-S57 PolarHBondContact OE1-N 2.95Å; E51-S57 VanDerWaalsContact OE1-N 3.13Å; E51-S57 PolarHBondContact OE1-OG 3.11Å
52	Y	85.8	Confident	91	Very high	118 Å²	118	88.9 Å²	88.9	46%	0.463	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-155.5	122.7	180	-173.7	-105.4	0	0	0	112.6	F39 F50 K54 H55	F39-Y52 HydrophobicContact CE2-CD1 4.42Å; F50-Y52 HydrophobicContact CE1-CG 4.41Å; F50-Y52 HydrophobicContact CZ-CD2 4.45Å; F50-Y52 HydrophobicContact CZ-CG 4.34Å; Y52-K54 PolarHBondContact O-N 3.15Å; Y52-H55 PolarHBondContact N-O 3.2Å; Y52-H55 VanDerWaalsContact N-O 3.1Å; Y52-H55 WeakPolarHBondContact O-CB 3.26Å; Y52-H55 PolarHBondContact O-N 3.13Å
53	K	87.1	Confident	90.8	Very high	169 Å²	169	92.9 Å²	92.9	74%	0.735	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	-102.1	-179.1	-65.6	177.7	174.9	167.8	0	111.7
54	K	89	Confident	90.7	Very high	186 Å²	186	91.8 Å²	91.8	81%	0.809	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-10.9	-178	-65.1	-173.7	177.1	-175.2	0	112.8	Y52 H59	Y52-K54 PolarHBondContact O-N 3.15Å; K54-H59 PolarHBondContact O-CE1 3.14Å
55	H	91.2	Very high	90.4	Very high	10 Å²	10	88 Å²	88	5%	0.046	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-85	126.5	177.8	178.2	60.2	0	0	0	110.1	C31 C34 F39 L41 F50 Y52 H59	C31-H55 PolarHBondContact SG-ND1 3.22Å; C34-H55 VanDerWaalsContact SG-CA 3.59Å; F39-H55 HydrophobicContact CD1-CB 4.34Å; F39-H55 AromaticContact CD1-CD2 3.92Å; F39-H55 AromaticContact CD1-CG 3.84Å; F39-H55 HydrophobicContact CD2-CB 4.24Å; F39-H55 HydrophobicContact CE1-CB 4Å; F39-H55 AromaticContact CE1-CD2 3.23Å; F39-H55 WeakPolarHBondContact CE1-CD2 3.21Å; F39-H55 AromaticContact CE1-CG 3.51Å; F39-H55 AromaticContact CE1-NE2 3.69Å; F39-H55 HydrophobicContact CE2-CB 3.91Å; F39-H55 HydrophobicContact CG-CB 4.44Å; F39-H55 HydrophobicContact CZ-CB 3.77Å; F39-H55 AromaticContact CZ-CD2 3.62Å; F39-H55 AromaticContact CZ-CG 3.79Å; L41-H55 WeakPolarHBondContact CD1-NE2 3.2Å; F50-H55 PolarHBondContact O-CD2 3.18Å; F50-H55 VanDerWaalsContact O-CD2 3.25Å; F50-H55 PolarHBondContact O-NE2 3.38Å; Y52-H55 PolarHBondContact N-O 3.2Å; Y52-H55 VanDerWaalsContact N-O 3.1Å; Y52-H55 WeakPolarHBondContact O-CB 3.26Å; Y52-H55 PolarHBondContact O-N 3.13Å; H55-H59 AromaticContact ND1-ND1 3.64Å
56	Q	91.6	Very high	89.9	Confident	73 Å²	73	89.1 Å²	89.1	34%	0.341	44%	0.436	S	S	.	.			trans	-111.7	154.6	171.8	-58.3	-59.9	-32.5	0	0	110.2	E51 D58 H59	E51-Q56 VanDerWaalsContact CD-OE1 3.3Å; E51-Q56 PolarHBondContact OE1-OE1 3.01Å; E51-Q56 PolarHBondContact OE2-OE1 3.38Å; Q56-D58 WeakPolarHBondContact CB-OD1 3.4Å; Q56-D58 PolarHBondContact O-N 2.94Å; Q56-H59 PolarHBondContact N-CE1 3.4Å; Q56-H59 PolarHBondContact O-N 3.43Å
57	S	89.6	Confident	89.5	Confident	57 Å²	57	92.2 Å²	92.2	40%	0.399	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-13.4	-175.7	58.5	0	0	0	0	113.7	E51	E51-S57 VanDerWaalsContact OE1-CB 3.31Å; E51-S57 WeakPolarHBondContact OE1-CB 3.28Å; E51-S57 PolarHBondContact OE1-N 2.95Å; E51-S57 VanDerWaalsContact OE1-N 3.13Å; E51-S57 PolarHBondContact OE1-OG 3.11Å
58	D	89.9	Confident	89.1	Confident	132 Å²	132	91.4 Å²	91.4	71%	0.706	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-2.4	178.7	65.3	-15.1	0	0	0	114	Q56	Q56-D58 WeakPolarHBondContact CB-OD1 3.4Å; Q56-D58 PolarHBondContact O-N 2.94Å
59	H	92.8	Very high	88.6	Confident	29 Å²	29	85.1 Å²	85.1	13%	0.134	43%	0.427	C	S	.	.	S	Bend	trans	-60.1	143.3	176.5	-74.5	-171.7	0	0	0	111.8	C31 E33 C34 K54 H55 Q56	C31-H59 VanDerWaalsContact SG-CB 3.57Å; C31-H59 PolarHBondContact SG-ND1 3.29Å; C31-H59 VanDerWaalsContact SG-ND1 3.44Å; E33-H59 HydrophobicContact CB-CB 4.38Å; E33-H59 IonicContact OE2-CD2 2.82Å; E33-H59 PolarHBondContact OE2-CD2 3.42Å; E33-H59 IonicContact OE2-CG 3.75Å; E33-H59 IonicContact OE2-NE2 3.99Å; C34-H59 VanDerWaalsContact SG-CE1 3.53Å; C34-H59 PolarHBondContact SG-ND1 3.3Å; K54-H59 PolarHBondContact O-CE1 3.14Å; H55-H59 AromaticContact ND1-ND1 3.64Å; Q56-H59 PolarHBondContact N-CE1 3.4Å; Q56-H59 PolarHBondContact O-N 3.43Å
60	T	93.1	Very high	88	Confident	85 Å²	85	85.6 Å²	85.6	52%	0.521	42%	0.424	S	S	.	.			trans	-58.2	142.5	169.6	54.6	0	0	0	0	110.7	A32 E33	A32-T60 WeakPolarHBondContact CB-O 3.46Å; A32-T60 PolarHBondContact N-O 3.26Å; E33-T60 WeakPolarHBondContact CG-OG1 3.33Å; E33-T60 WeakPolarHBondContact OE1-CB 3.44Å; E33-T60 PolarHBondContact OE1-N 3Å; E33-T60 PolarHBondContact OE1-OG1 3.29Å
61	Y	91.8	Very high	87.6	Confident	118 Å²	118	84.6 Å²	84.6	46%	0.463	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	154.6	-170.3	67.6	-89.6	0	0	0	112.4	I29 K30 F46 I63	I29-Y61 HydrophobicContact CD1-CD2 3.74Å; I29-Y61 HydrophobicContact CD1-CE2 3.94Å; I29-Y61 HydrophobicContact CG2-CD2 4.08Å; I29-Y61 HydrophobicContact CG2-CG 4.18Å; K30-Y61 CarbonylContact O-C 3.6Å; K30-Y61 WeakPolarHBondContact O-CA 3.35Å; F46-Y61 HydrophobicContact CE1-CE1 4.48Å; F46-Y61 HydrophobicContact CE1-CE2 4.42Å; F46-Y61 AromaticContact CE2-CD1 4Å; F46-Y61 HydrophobicContact CE2-CD1 4Å; F46-Y61 HydrophobicContact CE2-CE1 4.3Å; F46-Y61 HydrophobicContact CE2-CG 4.12Å; F46-Y61 AromaticContact CZ-CD1 3.74Å; F46-Y61 HydrophobicContact CZ-CD1 3.74Å; F46-Y61 HydrophobicContact CZ-CD2 4.19Å; F46-Y61 AromaticContact CZ-CE1 3.57Å; F46-Y61 HydrophobicContact CZ-CE1 3.57Å; F46-Y61 HydrophobicContact CZ-CE2 4.03Å; F46-Y61 HydrophobicContact CZ-CG 4.06Å; F46-Y61 AromaticContact CZ-CZ 3.72Å; Y61-I63 HydrophobicContact CD2-CG1 4.2Å; Y61-I63 HydrophobicContact CE2-CD1 4.27Å; Y61-I63 HydrophobicContact CE2-CG1 3.94Å
62	E	91.1	Very high	87	Confident	90 Å²	90	81.6 Å²	81.6	42%	0.421	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.7	175.1	-66.2	170.8	178.8	0	0	108.7	K30	K30-E62 HydrophobicContact CB-CB 4.4Å; K30-E62 WeakPolarHBondContact CD-OE2 3.49Å; K30-E62 PolarHBondContact N-O 2.94Å; K30-E62 IonicContact NZ-OE2 2.83Å; K30-E62 PolarHBondContact NZ-OE2 3.2Å; K30-E62 PolarHBondContact O-N 2.89Å
63	I	90	Very high	86.8	Confident	104 Å²	104	81.8 Å²	81.8	53%	0.533	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116.8	173.4	-56.8	175.1	0	0	0	107.8	P27 I29 Y61 T65	P27-I63 HydrophobicContact CB-CG2 4.34Å; I29-I63 HydrophobicContact CD1-CG1 4.15Å; Y61-I63 HydrophobicContact CD2-CG1 4.2Å; Y61-I63 HydrophobicContact CE2-CD1 4.27Å; Y61-I63 HydrophobicContact CE2-CG1 3.94Å; I63-T65 HydrophobicContact CG2-CG2 4.48Å
64	M	89.4	Confident	86.7	Confident	58 Å²	58	77 Å²	77	29%	0.286	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112.3	176.3	-55.8	-58.5	-60.2	0	0	108.7	P27 Y28 K30	P27-M64 VanDerWaalsContact CA-O 3.26Å; P27-M64 WeakPolarHBondContact CA-O 3.15Å; Y28-M64 HydrophobicContact CD1-CB 4.21Å; Y28-M64 HydrophobicContact CD2-CB 3.99Å; Y28-M64 HydrophobicContact CD2-CG 4Å; Y28-M64 HydrophobicContact CE1-CB 3.9Å; Y28-M64 HydrophobicContact CE2-CB 3.69Å; Y28-M64 HydrophobicContact CE2-CG 3.54Å; Y28-M64 HydrophobicContact CG-CB 4.24Å; Y28-M64 PolarHBondContact N-O 3.16Å; Y28-M64 VanDerWaalsContact N-O 3.15Å; Y28-M64 PolarHBondContact O-N 3.48Å; K30-M64 HydrophobicContact CB-CG 3.95Å; K30-M64 HydrophobicContact CB-SD 4.17Å; K30-M64 HydrophobicContact CD-SD 4.08Å
65	T	86.4	Confident	86.6	Confident	56 Å²	56	68.7 Å²	68.7	34%	0.344	38%	0.375	S	S	.	.			trans	-152.5	143.1	177.5	-176.6	0	0	0	0	110.6	I63 D67 F68	I63-T65 HydrophobicContact CG2-CG2 4.48Å; T65-D67 PolarHBondContact OG1-N 3.32Å; T65-F68 VanDerWaalsContact O-CE1 3.25Å; T65-F68 WeakPolarHBondContact O-CE1 3.16Å
66	S	83.6	Confident	86.4	Confident	34 Å²	34	69.6 Å²	69.6	24%	0.238	38%	0.381	C	S	.	.			trans	-107.5	8.1	173.6	-51.7	0	0	0	0	113	E26 F68 A77 Q78	E26-S66 VanDerWaalsContact OE2-CB 3.26Å; E26-S66 WeakPolarHBondContact OE2-CB 3.36Å; E26-S66 PolarHBondContact OE2-N 3.46Å; E26-S66 PolarHBondContact OE2-OG 2.6Å; S66-F68 VanDerWaalsContact C-N 3.29Å; S66-F68 PolarHBondContact O-N 2.95Å; S66-F68 VanDerWaalsContact O-N 3.12Å; S66-A77 WeakPolarHBondContact O-CB 3.46Å; S66-A77 PolarHBondContact O-N 2.95Å; S66-Q78 PolarHBondContact O-N 3.25Å; S66-Q78 VanDerWaalsContact O-N 3.13Å
67	D	83.4	Confident	86.1	Confident	118 Å²	118	67 Å²	67	63%	0.631	37%	0.372	S	S	*	.			trans	-87.7	59.7	-179.3	-167.9	21.1	0	0	0	111.9	T65 T76	T65-D67 PolarHBondContact OG1-N 3.32Å; D67-T76 WeakPolarHBondContact OD1-CG2 3.41Å
68	F	80.9	Confident	86	Confident	96 Å²	96	70.1 Å²	70.1	42%	0.421	38%	0.38	S	S	.	.	S	Bend	trans	-146.1	148.2	176.4	65	-89.3	0	0	0	111.1	T65 S66 V70 T76 A77	T65-F68 VanDerWaalsContact O-CE1 3.25Å; T65-F68 WeakPolarHBondContact O-CE1 3.16Å; S66-F68 VanDerWaalsContact C-N 3.29Å; S66-F68 PolarHBondContact O-N 2.95Å; S66-F68 VanDerWaalsContact O-N 3.12Å; F68-V70 HydrophobicContact CD2-CG2 4.21Å; F68-V70 HydrophobicContact CE2-CG2 3.79Å; F68-T76 CarbonylContact O-C 3.5Å; F68-T76 WeakPolarHBondContact O-CA 3.46Å; F68-A77 HydrophobicContact CD1-CB 4.42Å; F68-A77 HydrophobicContact CD2-CB 4.49Å; F68-A77 HydrophobicContact CE1-CB 4.02Å; F68-A77 HydrophobicContact CE2-CB 4.11Å; F68-A77 HydrophobicContact CZ-CB 3.86Å; F68-A77 PolarHBondContact O-N 3.12Å
69	P	83.5	Confident	86	Confident	71 Å²	71	65.3 Å²	65.3	46%	0.461	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-75.3	138.7	-178.9	28.9	-33.7	0	0	0	112.9	D72 W75	P69-D72 WeakPolarHBondContact CB-O 3.38Å; P69-W75 WeakPolarHBondContact CA-O 3.24Å
70	V	77.8	Confident	85.8	Confident	42 Å²	42	64.5 Å²	64.5	26%	0.255	35%	0.35	S	S	.	.	S	Bend	trans	-109.9	-60	-178.6	-175.7	0	0	0	0	111.8	F68 A77 L131	F68-V70 HydrophobicContact CD2-CG2 4.21Å; F68-V70 HydrophobicContact CE2-CG2 3.79Å; V70-A77 HydrophobicContact CG2-CB 3.41Å; V70-A77 VanDerWaalsContact CG2-CB 3.41Å; V70-L131 HydrophobicContact CG1-CD1 3.85Å
71	L	79.9	Confident	85.5	Confident	36 Å²	36	65.7 Å²	65.7	19%	0.188	35%	0.351	C	S	.	.	S	Bend	trans	-104.5	-34.7	-173.9	-54.4	177.4	0	0	0	112.3	H117 F118 T127	L71-H117 HydrophobicContact CD1-CB 4.11Å; L71-F118 HydrophobicContact CD1-CE1 4.18Å; L71-F118 HydrophobicContact CD1-CE2 3.89Å; L71-F118 HydrophobicContact CD1-CZ 3.55Å; L71-T127 HydrophobicContact CD2-CG2 3.5Å; L71-T127 VanDerWaalsContact CD2-CG2 3.5Å
72	D	79.4	Confident	85.4	Confident	32 Å²	32	61.7 Å²	61.7	17%	0.171	34%	0.342	C	S	.	.	S	Bend	trans	-135	138.1	179.2	-167	-68.8	0	0	0	109.4	P69 S74 W75 K116 H117	P69-D72 WeakPolarHBondContact CB-O 3.38Å; D72-S74 PolarHBondContact O-N 3.45Å; D72-S74 WeakPolarHBondContact OD1-CB 3.45Å; D72-S74 PolarHBondContact OD1-N 2.95Å; D72-S74 PolarHBondContact OD1-OG 3.45Å; D72-W75 HydrophobicContact CB-CB 4.4Å; D72-W75 PolarHBondContact O-N 3.25Å; D72-W75 VanDerWaalsContact O-O 3.09Å; D72-K116 IonicContact OD2-NZ 3.16Å; D72-K116 PolarHBondContact OD2-NZ 2.84Å; D72-K116 VanDerWaalsContact OD2-NZ 3.16Å; D72-H117 IonicContact OD2-NE2 3.81Å
73	P	81.9	Confident	85.3	Confident	121 Å²	121	57.4 Å²	57.4	79%	0.786	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.5	178.3	-25.4	34.2	0	0	0	114.7
74	S	84.2	Confident	85.4	Confident	68 Å²	68	55.6 Å²	55.6	48%	0.476	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-1.2	179.4	63.7	0	0	0	0	114.5	D72 K105	D72-S74 PolarHBondContact O-N 3.45Å; D72-S74 WeakPolarHBondContact OD1-CB 3.45Å; D72-S74 PolarHBondContact OD1-N 2.95Å; D72-S74 PolarHBondContact OD1-OG 3.45Å; S74-K105 PolarHBondContact O-NZ 2.96Å
75	W	86.7	Confident	85.3	Confident	12 Å²	12	55 Å²	55	5%	0.045	31%	0.31	C	S	.	.	S	Bend	trans	-126.4	124.3	-176.7	-75.2	76	0	0	0	111.5	P69 D72 E79 E80 L83 M102 K105 E109 H113	P69-W75 WeakPolarHBondContact CA-O 3.24Å; D72-W75 HydrophobicContact CB-CB 4.4Å; D72-W75 PolarHBondContact O-N 3.25Å; D72-W75 VanDerWaalsContact O-O 3.09Å; W75-E79 WeakPolarHBondContact CA-OE2 3.34Å; W75-E79 HydrophobicContact CE3-CB 3.86Å; W75-E79 HydrophobicContact CZ3-CB 4.36Å; W75-E80 HydrophobicContact CB-CG 4.49Å; W75-E80 WeakPolarHBondContact CB-OE1 3.25Å; W75-L83 HydrophobicContact CH2-CD2 4.11Å; W75-L83 HydrophobicContact CZ3-CB 4.24Å; W75-L83 HydrophobicContact CZ3-CD2 3.88Å; W75-L83 HydrophobicContact CZ3-CG 4.48Å; W75-M102 HydrophobicContact CH2-CE 4.27Å; W75-M102 HydrophobicContact CZ3-CE 3.66Å; W75-K105 HydrophobicContact CH2-CB 4.03Å; W75-K105 HydrophobicContact CH2-CD 4.36Å; W75-K105 HydrophobicContact CH2-CG 3.63Å; W75-K105 HydrophobicContact CZ2-CB 4.32Å; W75-K105 HydrophobicContact CZ2-CD 4.09Å; W75-K105 HydrophobicContact CZ2-CG 3.84Å; W75-K105 HydrophobicContact CZ3-CG 4.02Å; W75-E109 HydrophobicContact CZ2-CB 4.41Å; W75-H113 AromaticContact CD1-CE1 3.58Å; W75-H113 AromaticContact CD1-ND1 3.57Å; W75-H113 AromaticContact CD2-CD2 3.66Å; W75-H113 AromaticContact CD2-CE1 3.82Å; W75-H113 AromaticContact CD2-CG 3.81Å; W75-H113 AromaticContact CD2-ND1 3.96Å; W75-H113 AromaticContact CD2-NE2 3.67Å; W75-H113 AromaticContact CE2-CD2 3.77Å; W75-H113 AromaticContact CE2-CG 3.46Å; W75-H113 VanDerWaalsContact CE2-CG 3.46Å; W75-H113 AromaticContact CE2-ND1 3.72Å; W75-H113 AromaticContact CE3-CD2 3.78Å; W75-H113 AromaticContact CE3-NE2 3.93Å; W75-H113 AromaticContact CG-CE1 3.54Å; W75-H113 AromaticContact CG-ND1 3.9Å; W75-H113 AromaticContact CG-NE2 3.76Å; W75-H113 HydrophobicContact CH2-CB 4.06Å; W75-H113 HydrophobicContact CZ2-CB 3.49Å; W75-H113 VanDerWaalsContact CZ2-CB 3.49Å; W75-H113 AromaticContact CZ2-CG 3.7Å; W75-H113 AromaticContact CZ3-CD2 4Å; W75-H113 AromaticContact NE1-CE1 3.91Å; W75-H113 AromaticContact NE1-CG 3.69Å; W75-H113 AromaticContact NE1-ND1 3.46Å; W75-H113 PolarHBondContact NE1-ND1 3.19Å
76	T	87.5	Confident	85.5	Confident	29 Å²	29	52.4 Å²	52.4	18%	0.178	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-83.8	158.2	177.7	71.3	0	0	0	0	112	D67 F68 Q78 E79 E80	D67-T76 WeakPolarHBondContact OD1-CG2 3.41Å; F68-T76 CarbonylContact O-C 3.5Å; F68-T76 WeakPolarHBondContact O-CA 3.46Å; T76-Q78 PolarHBondContact O-N 3.01Å; T76-E79 PolarHBondContact N-OE2 3.21Å; T76-E79 WeakPolarHBondContact O-CA 3.35Å; T76-E79 WeakPolarHBondContact O-CB 3.34Å; T76-E79 PolarHBondContact O-N 3.48Å; T76-E79 WeakPolarHBondContact OG1-CG 3.35Å; T76-E79 PolarHBondContact OG1-N 2.98Å; T76-E80 WeakPolarHBondContact O-CG 3.39Å; T76-E80 PolarHBondContact O-N 3.37Å
77	A	85.3	Confident	85.9	Confident	19 Å²	19	51.3 Å²	51.3	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-55	-36.3	175.9	0	0	0	0	0	111.9	S66 F68 V70 E80 M81	S66-A77 WeakPolarHBondContact O-CB 3.46Å; S66-A77 PolarHBondContact O-N 2.95Å; F68-A77 HydrophobicContact CD1-CB 4.42Å; F68-A77 HydrophobicContact CD2-CB 4.49Å; F68-A77 HydrophobicContact CE1-CB 4.02Å; F68-A77 HydrophobicContact CE2-CB 4.11Å; F68-A77 HydrophobicContact CZ-CB 3.86Å; F68-A77 PolarHBondContact O-N 3.12Å; V70-A77 HydrophobicContact CG2-CB 3.41Å; V70-A77 VanDerWaalsContact CG2-CB 3.41Å; A77-E80 PolarHBondContact O-N 3.17Å; A77-M81 PolarHBondContact O-N 3.06Å
78	Q	87.3	Confident	86.2	Confident	123 Å²	123	52.1 Å²	52.1	58%	0.575	29%	0.287	S	S	*	.	H	α-helix	trans	-63.3	-43.6	173.7	-170.5	178.1	-15.1	0	0	112.2	S66 T76 M81 A82	S66-Q78 PolarHBondContact O-N 3.25Å; S66-Q78 VanDerWaalsContact O-N 3.13Å; T76-Q78 PolarHBondContact O-N 3.01Å; Q78-M81 PolarHBondContact O-N 3.41Å; Q78-A82 WeakPolarHBondContact O-CB 3.3Å; Q78-A82 PolarHBondContact O-N 2.9Å
79	E	89.5	Confident	86.5	Confident	30 Å²	30	51.3 Å²	51.3	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-38.1	176.8	-69	178.2	138.1	0	0	112	W75 T76 A82 L83 M102 T104 K105	W75-E79 WeakPolarHBondContact CA-OE2 3.34Å; W75-E79 HydrophobicContact CE3-CB 3.86Å; W75-E79 HydrophobicContact CZ3-CB 4.36Å; T76-E79 PolarHBondContact N-OE2 3.21Å; T76-E79 WeakPolarHBondContact O-CA 3.35Å; T76-E79 WeakPolarHBondContact O-CB 3.34Å; T76-E79 PolarHBondContact O-N 3.48Å; T76-E79 WeakPolarHBondContact OG1-CG 3.35Å; T76-E79 PolarHBondContact OG1-N 2.98Å; E79-A82 PolarHBondContact O-N 3.3Å; E79-L83 WeakPolarHBondContact O-CB 3.21Å; E79-L83 PolarHBondContact O-N 3.2Å; E79-M102 HydrophobicContact CB-CE 4.27Å; E79-M102 WeakPolarHBondContact O-CE 3.24Å; E79-T104 WeakPolarHBondContact OE1-CB 3.2Å; E79-T104 PolarHBondContact OE1-OG1 2.63Å; E79-T104 VanDerWaalsContact OE1-OG1 3.1Å; E79-K105 VanDerWaalsContact OE1-CE 3.24Å; E79-K105 WeakPolarHBondContact OE1-CE 3.34Å; E79-K105 IonicContact OE1-NZ 3.19Å; E79-K105 WeakPolarHBondContact OE2-CE 3.43Å; E79-K105 IonicContact OE2-NZ 3.74Å
80	E	89.2	Confident	86.8	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-44.9	175.6	-62.5	-71.8	-173.4	0	0	111.1	W75 T76 A77 L83 L84 H113	W75-E80 HydrophobicContact CB-CG 4.49Å; W75-E80 WeakPolarHBondContact CB-OE1 3.25Å; T76-E80 WeakPolarHBondContact O-CG 3.39Å; T76-E80 PolarHBondContact O-N 3.37Å; A77-E80 PolarHBondContact O-N 3.17Å; E80-L83 PolarHBondContact O-N 2.98Å; E80-L84 WeakPolarHBondContact O-CG 3.3Å; E80-L84 PolarHBondContact O-N 3.34Å; E80-H113 IonicContact OE1-CE1 2.73Å; E80-H113 PolarHBondContact OE1-CE1 3.41Å; E80-H113 VanDerWaalsContact OE1-CE1 3.29Å; E80-H113 IonicContact OE1-NE2 3.74Å; E80-H113 PolarHBondContact OE1-NE2 3.28Å; E80-H113 IonicContact OE2-CD2 3.51Å; E80-H113 IonicContact OE2-CE1 3.39Å; E80-H113 IonicContact OE2-NE2 3.31Å; E80-H113 PolarHBondContact OE2-NE2 3.47Å
81	M	87.1	Confident	87.2	Confident	111 Å²	111	49.2 Å²	49.2	55%	0.547	28%	0.281	S	S	.	.	H	α-helix	trans	-64	-48.3	176.9	-167.2	65.7	65.3	0	0	111.3	A77 Q78 L83 L84 E85	A77-M81 PolarHBondContact O-N 3.06Å; Q78-M81 PolarHBondContact O-N 3.41Å; M81-L83 PolarHBondContact O-N 3.15Å; M81-L84 PolarHBondContact O-N 2.92Å; M81-E85 WeakPolarHBondContact O-CG 3.25Å; M81-E85 PolarHBondContact O-N 3.46Å
82	A	88.7	Confident	87.6	Confident	33 Å²	33	53.5 Å²	53.5	27%	0.273	30%	0.298	S	S	.	.	H	α-helix	trans	-60.1	-35.4	179.5	0	0	0	0	0	111.8	Q78 E79 A86 M102	Q78-A82 WeakPolarHBondContact O-CB 3.3Å; Q78-A82 PolarHBondContact O-N 2.9Å; E79-A82 PolarHBondContact O-N 3.3Å; A82-A86 WeakPolarHBondContact O-CB 3.29Å; A82-A86 PolarHBondContact O-N 2.89Å; A82-M102 HydrophobicContact CB-CE 4.42Å; A82-M102 HydrophobicContact CB-SD 3.41Å; A82-M102 WeakPolarHBondContact CB-SD 3.27Å
83	L	90.6	Very high	87.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-45.8	177.9	179.2	66.2	0	0	0	111	W75 E79 E80 M81 A86 V87 V98 M102 C110 Y114	W75-L83 HydrophobicContact CH2-CD2 4.11Å; W75-L83 HydrophobicContact CZ3-CB 4.24Å; W75-L83 HydrophobicContact CZ3-CD2 3.88Å; W75-L83 HydrophobicContact CZ3-CG 4.48Å; E79-L83 WeakPolarHBondContact O-CB 3.21Å; E79-L83 PolarHBondContact O-N 3.2Å; E80-L83 PolarHBondContact O-N 2.98Å; M81-L83 PolarHBondContact O-N 3.15Å; L83-A86 PolarHBondContact O-N 3.35Å; L83-V87 HydrophobicContact CD1-CG2 4.37Å; L83-V87 WeakPolarHBondContact O-CB 3.26Å; L83-V87 VanDerWaalsContact O-CG2 3.23Å; L83-V87 WeakPolarHBondContact O-CG2 3.43Å; L83-V87 PolarHBondContact O-N 3.25Å; L83-V98 HydrophobicContact CD1-CG1 3.78Å; L83-M102 WeakPolarHBondContact CA-SD 3.38Å; L83-M102 HydrophobicContact CB-CE 3.93Å; L83-M102 HydrophobicContact CB-SD 4Å; L83-M102 PolarHBondContact N-SD 3.04Å; L83-C110 HydrophobicContact CD1-CB 3.77Å; L83-Y114 HydrophobicContact CD2-CD2 4.34Å; L83-Y114 HydrophobicContact CG-CD2 4.47Å
84	L	90.4	Very high	88.3	Confident	66 Å²	66	51.2 Å²	51.2	35%	0.346	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-41.5	179.4	-66.9	179	0	0	0	111.8	E80 M81 V87 M88 Y114 F118	E80-L84 WeakPolarHBondContact O-CG 3.3Å; E80-L84 PolarHBondContact O-N 3.34Å; M81-L84 PolarHBondContact O-N 2.92Å; L84-V87 PolarHBondContact O-N 2.83Å; L84-M88 WeakPolarHBondContact O-CB 3.46Å; L84-M88 PolarHBondContact O-N 3.29Å; L84-Y114 HydrophobicContact CD2-CD2 4.39Å; L84-Y114 HydrophobicContact CD2-CE2 3.84Å; L84-F118 HydrophobicContact CD1-CE1 3.93Å; L84-F118 HydrophobicContact CD1-CZ 4.24Å; L84-F118 HydrophobicContact CD2-CD1 4Å; L84-F118 HydrophobicContact CD2-CE1 3.77Å; L84-F118 HydrophobicContact CD2-CE2 4.47Å; L84-F118 HydrophobicContact CD2-CG 4.44Å; L84-F118 HydrophobicContact CD2-CZ 4.01Å; L84-F118 HydrophobicContact CG-CE1 4.24Å; L84-F118 HydrophobicContact CG-CZ 4.27Å
85	E	88.5	Confident	88.7	Confident	47 Å²	47	48.8 Å²	48.8	22%	0.22	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-47.6	174.3	-71.5	179.6	179.5	0	0	111.4	S8 M81 V87 M88 D89	S8-E85 WeakPolarHBondContact CB-OE2 3.25Å; S8-E85 PolarHBondContact OG-OE2 2.89Å; M81-E85 WeakPolarHBondContact O-CG 3.25Å; M81-E85 PolarHBondContact O-N 3.46Å; E85-V87 VanDerWaalsContact C-N 3.32Å; E85-V87 PolarHBondContact O-N 2.95Å; E85-M88 WeakPolarHBondContact O-CB 3.25Å; E85-M88 PolarHBondContact O-N 3.03Å; E85-M88 VanDerWaalsContact O-N 3.11Å; E85-D89 PolarHBondContact O-N 3.04Å
86	A	90.4	Very high	89	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-38.4	178.7	0	0	0	0	0	112.2	A82 L83 D89 C90 V98 Q101 M102	A82-A86 WeakPolarHBondContact O-CB 3.29Å; A82-A86 PolarHBondContact O-N 2.89Å; L83-A86 PolarHBondContact O-N 3.35Å; A86-D89 PolarHBondContact O-N 3.46Å; A86-C90 WeakPolarHBondContact O-CB 3.46Å; A86-C90 PolarHBondContact O-N 3.38Å; A86-V98 HydrophobicContact CB-CB 4.4Å; A86-V98 HydrophobicContact CB-CG1 3.89Å; A86-Q101 HydrophobicContact CB-CB 4.01Å; A86-Q101 HydrophobicContact CB-CG 3.97Å; A86-M102 HydrophobicContact CB-CG 4.33Å
87	V	91.6	Very high	89	Confident	11 Å²	11	54.6 Å²	54.6	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-36.2	174.2	171.1	0	0	0	0	111.6	L83 L84 E85 G91 F92 W95 V98 Y114	L83-V87 HydrophobicContact CD1-CG2 4.37Å; L83-V87 WeakPolarHBondContact O-CB 3.26Å; L83-V87 VanDerWaalsContact O-CG2 3.23Å; L83-V87 WeakPolarHBondContact O-CG2 3.43Å; L83-V87 PolarHBondContact O-N 3.25Å; L84-V87 PolarHBondContact O-N 2.83Å; E85-V87 VanDerWaalsContact C-N 3.32Å; E85-V87 PolarHBondContact O-N 2.95Å; V87-G91 CarbonylContact O-C 3.46Å; V87-G91 WeakPolarHBondContact O-CA 3.48Å; V87-G91 PolarHBondContact O-N 2.82Å; V87-F92 HydrophobicContact CG1-CB 4.44Å; V87-W95 HydrophobicContact CG2-CH2 4.32Å; V87-W95 HydrophobicContact CG2-CZ3 3.73Å; V87-V98 HydrophobicContact CG2-CG1 4.04Å; V87-V98 HydrophobicContact CG2-CG2 4.05Å; V87-Y114 HydrophobicContact CB-CE2 4.33Å; V87-Y114 HydrophobicContact CG1-CE2 4.02Å; V87-Y114 HydrophobicContact CG2-CD2 4.12Å; V87-Y114 HydrophobicContact CG2-CE2 4.13Å
88	M	89	Confident	89.3	Confident	136 Å²	136	53.7 Å²	53.7	67%	0.67	29%	0.291	S	S	*	.	H	α-helix	trans	-65.4	-42.4	175	-178.6	-178.9	64.9	0	0	111.7	L84 E85	L84-M88 WeakPolarHBondContact O-CB 3.46Å; L84-M88 PolarHBondContact O-N 3.29Å; E85-M88 WeakPolarHBondContact O-CB 3.25Å; E85-M88 PolarHBondContact O-N 3.03Å; E85-M88 VanDerWaalsContact O-N 3.11Å
89	D	88.1	Confident	89.5	Confident	78 Å²	78	48.3 Å²	48.3	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-76.9	-47.6	-177.7	-72	-16.6	0	0	0	112.7	E85 A86 Q101	E85-D89 PolarHBondContact O-N 3.04Å; A86-D89 PolarHBondContact O-N 3.46Å; D89-Q101 PolarHBondContact OD2-NE2 2.84Å
90	C	90	Very high	89.5	Confident	38 Å²	38	51.3 Å²	51.3	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-89.1	-16.2	-173.7	-64.3	0	0	0	0	113.4	A86 D97 V98 Q101	A86-C90 WeakPolarHBondContact O-CB 3.46Å; A86-C90 PolarHBondContact O-N 3.38Å; C90-D97 HydrophobicContact CB-CB 4.1Å; C90-V98 HydrophobicContact CB-CG2 3.9Å; C90-Q101 PolarHBondContact SG-OE1 3.36Å
91	G	87.1	Confident	89.5	Confident	32 Å²	32	54.5 Å²	54.5	33%	0.33	30%	0.299	S	S	.	.			trans	84.9	146.1	-177.4	0	0	0	0	0	114.1	V87 G93 N94	V87-G91 CarbonylContact O-C 3.46Å; V87-G91 WeakPolarHBondContact O-CA 3.48Å; V87-G91 PolarHBondContact O-N 2.82Å; G91-G93 PolarHBondContact O-N 3.24Å; G91-N94 PolarHBondContact O-N 3.48Å
92	F	88.3	Confident	89.2	Confident	125 Å²	125	49.8 Å²	49.8	55%	0.548	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	133.7	178.3	177.2	-93.4	0	0	0	112.3	V87 W95 Y114 M115 I119	V87-F92 HydrophobicContact CG1-CB 4.44Å; F92-W95 HydrophobicContact CD2-CH2 4.06Å; F92-W95 HydrophobicContact CD2-CZ2 4.05Å; F92-W95 HydrophobicContact CE2-CH2 4.19Å; F92-W95 AromaticContact CE2-CZ2 3.96Å; F92-W95 HydrophobicContact CE2-CZ2 3.96Å; F92-Y114 HydrophobicContact CD2-CD1 4.19Å; F92-Y114 AromaticContact CD2-CE1 3.62Å; F92-Y114 HydrophobicContact CD2-CE1 3.62Å; F92-Y114 AromaticContact CE2-CD1 3.88Å; F92-Y114 HydrophobicContact CE2-CD1 3.88Å; F92-Y114 AromaticContact CE2-CE1 3.54Å; F92-Y114 HydrophobicContact CE2-CE1 3.54Å; F92-M115 HydrophobicContact CD2-CE 4.46Å; F92-M115 HydrophobicContact CE1-CE 4.36Å; F92-M115 HydrophobicContact CE2-CE 3.31Å; F92-M115 HydrophobicContact CE2-SD 4.34Å; F92-M115 HydrophobicContact CZ-CE 3.27Å; F92-M115 HydrophobicContact CZ-SD 4.2Å; F92-I119 HydrophobicContact CE2-CG1 4.47Å
93	G	84.5	Confident	89	Confident	46 Å²	46	53.6 Å²	53.6	47%	0.474	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	92	-14.8	-177.8	0	0	0	0	0	114.3	G91 W95	G91-G93 PolarHBondContact O-N 3.24Å; G93-W95 VanDerWaalsContact C-N 3.27Å; G93-W95 PolarHBondContact O-N 2.79Å; G93-W95 VanDerWaalsContact O-N 3.15Å
94	N	91.1	Very high	88.8	Confident	59 Å²	59	57.6 Å²	57.6	32%	0.316	32%	0.324	S	S	.	.			trans	-88.7	57.4	175	-166.1	4.8	0	0	0	112.2	G91 Q96 D97 V98	G91-N94 PolarHBondContact O-N 3.48Å; N94-Q96 PolarHBondContact O-N 2.84Å; N94-Q96 VanDerWaalsContact O-N 3.13Å; N94-D97 PolarHBondContact ND2-OD2 3.36Å; N94-D97 PolarHBondContact O-N 2.84Å; N94-D97 PolarHBondContact OD1-OD2 2.77Å; N94-V98 WeakPolarHBondContact O-CG2 3.39Å; N94-V98 PolarHBondContact O-N 2.93Å; N94-V98 VanDerWaalsContact O-N 3.11Å
95	W	92.6	Very high	88.7	Confident	17 Å²	17	56.4 Å²	56.4	6%	0.064	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-22.3	-172.4	-55	117.9	0	0	0	114.3	V87 F92 G93 V98 A99 K107 C110 E111 Y114 M115	V87-W95 HydrophobicContact CG2-CH2 4.32Å; V87-W95 HydrophobicContact CG2-CZ3 3.73Å; F92-W95 HydrophobicContact CD2-CH2 4.06Å; F92-W95 HydrophobicContact CD2-CZ2 4.05Å; F92-W95 HydrophobicContact CE2-CH2 4.19Å; F92-W95 AromaticContact CE2-CZ2 3.96Å; F92-W95 HydrophobicContact CE2-CZ2 3.96Å; G93-W95 VanDerWaalsContact C-N 3.27Å; G93-W95 PolarHBondContact O-N 2.79Å; G93-W95 VanDerWaalsContact O-N 3.15Å; W95-V98 HydrophobicContact CE3-CB 4.46Å; W95-V98 HydrophobicContact CE3-CG1 4.34Å; W95-V98 HydrophobicContact CE3-CG2 4.48Å; W95-A99 VanDerWaalsContact O-CB 3.28Å; W95-A99 WeakPolarHBondContact O-CB 3.43Å; W95-A99 PolarHBondContact O-N 3.14Å; W95-K107 HydrophobicContact CB-CB 3.95Å; W95-K107 WeakPolarHBondContact O-CB 3.36Å; W95-C110 HydrophobicContact CE3-CB 4.37Å; W95-E111 HydrophobicContact CB-CB 4.49Å; W95-E111 HydrophobicContact CD2-CB 3.7Å; W95-E111 HydrophobicContact CD2-CG 4.15Å; W95-E111 HydrophobicContact CE3-CB 4.26Å; W95-E111 HydrophobicContact CG-CB 3.76Å; W95-E111 HydrophobicContact CG-CG 4.24Å; W95-E111 HydrophobicContact CZ2-CB 4.5Å; W95-E111 HydrophobicContact CZ2-CG 4.27Å; W95-E111 VanDerWaalsContact NE1-CD 3.26Å; W95-E111 PolarHBondContact NE1-OE1 3.48Å; W95-E111 VanDerWaalsContact NE1-OE1 3.14Å; W95-Y114 AromaticContact CH2-CD1 3.63Å; W95-Y114 HydrophobicContact CH2-CD1 3.63Å; W95-Y114 HydrophobicContact CH2-CD2 4.5Å; W95-Y114 HydrophobicContact CH2-CE1 4.33Å; W95-Y114 AromaticContact CH2-CG 3.71Å; W95-Y114 HydrophobicContact CH2-CG 3.71Å; W95-Y114 HydrophobicContact CZ2-CD1 4.45Å; W95-Y114 HydrophobicContact CZ3-CD1 4.48Å; W95-Y114 HydrophobicContact CZ3-CG 4.13Å; W95-M115 HydrophobicContact CH2-CE 4.14Å; W95-M115 HydrophobicContact CZ2-CE 3.4Å
96	Q	91.9	Very high	88.9	Confident	90 Å²	90	57.2 Å²	57.2	42%	0.421	32%	0.324	S	S	.	.	H	α-helix	trans	-67	-47.5	176.9	-171.9	64.1	65.4	0	0	111	N94 N100 K107	N94-Q96 PolarHBondContact O-N 2.84Å; N94-Q96 VanDerWaalsContact O-N 3.13Å; Q96-N100 PolarHBondContact O-N 2.75Å; Q96-N100 VanDerWaalsContact O-N 3.12Å; Q96-N100 PolarHBondContact O-ND2 2.82Å; Q96-N100 PolarHBondContact O-OD1 3.12Å; Q96-K107 VanDerWaalsContact OE1-CD 3.32Å
97	D	88.8	Confident	89	Confident	73 Å²	73	60.9 Å²	60.9	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-74.9	-34.1	179	-68.1	-28.1	0	0	0	111.7	C90 N94 A99 N100 Q101	C90-D97 HydrophobicContact CB-CB 4.1Å; N94-D97 PolarHBondContact ND2-OD2 3.36Å; N94-D97 PolarHBondContact O-N 2.84Å; N94-D97 PolarHBondContact OD1-OD2 2.77Å; D97-A99 PolarHBondContact O-N 3.15Å; D97-N100 WeakPolarHBondContact O-CB 3.46Å; D97-N100 PolarHBondContact O-N 2.8Å; D97-Q101 PolarHBondContact O-N 3.13Å
98	V	90.9	Very high	89.1	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-58.2	-48.4	171.7	171.8	0	0	0	0	111.2	L83 A86 V87 C90 N94 W95 N100 Q101 M102 C110	L83-V98 HydrophobicContact CD1-CG1 3.78Å; A86-V98 HydrophobicContact CB-CB 4.4Å; A86-V98 HydrophobicContact CB-CG1 3.89Å; V87-V98 HydrophobicContact CG2-CG1 4.04Å; V87-V98 HydrophobicContact CG2-CG2 4.05Å; C90-V98 HydrophobicContact CB-CG2 3.9Å; N94-V98 WeakPolarHBondContact O-CG2 3.39Å; N94-V98 PolarHBondContact O-N 2.93Å; N94-V98 VanDerWaalsContact O-N 3.11Å; W95-V98 HydrophobicContact CE3-CB 4.46Å; W95-V98 HydrophobicContact CE3-CG1 4.34Å; W95-V98 HydrophobicContact CE3-CG2 4.48Å; V98-N100 VanDerWaalsContact C-N 3.32Å; V98-N100 PolarHBondContact O-N 3.1Å; V98-Q101 PolarHBondContact O-N 3.38Å; V98-M102 HydrophobicContact CG1-CG 4.45Å; V98-M102 WeakPolarHBondContact O-CB 3.46Å; V98-M102 VanDerWaalsContact O-CG 3.24Å; V98-M102 WeakPolarHBondContact O-CG 3.35Å; V98-M102 PolarHBondContact O-N 2.95Å; V98-C110 HydrophobicContact CG1-CB 4.39Å
99	A	91.5	Very high	89.3	Confident	10 Å²	10	63.5 Å²	63.5	8%	0.083	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-37.1	177.5	0	0	0	0	0	112.3	W95 D97 Q101 M102 C103 K107	W95-A99 VanDerWaalsContact O-CB 3.28Å; W95-A99 WeakPolarHBondContact O-CB 3.43Å; W95-A99 PolarHBondContact O-N 3.14Å; D97-A99 PolarHBondContact O-N 3.15Å; A99-Q101 VanDerWaalsContact C-N 3.31Å; A99-Q101 PolarHBondContact O-N 3.24Å; A99-M102 PolarHBondContact O-N 3.19Å; A99-C103 PolarHBondContact O-N 3.3Å; A99-K107 HydrophobicContact CB-CB 4.05Å
100	N	90.2	Very high	89.5	Confident	94 Å²	94	59.8 Å²	59.8	50%	0.503	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-37.4	175.7	-67.4	-22	0	0	0	111.9	Q96 D97 V98 C103	Q96-N100 PolarHBondContact O-N 2.75Å; Q96-N100 VanDerWaalsContact O-N 3.12Å; Q96-N100 PolarHBondContact O-ND2 2.82Å; Q96-N100 PolarHBondContact O-OD1 3.12Å; D97-N100 WeakPolarHBondContact O-CB 3.46Å; D97-N100 PolarHBondContact O-N 2.8Å; V98-N100 VanDerWaalsContact C-N 3.32Å; V98-N100 PolarHBondContact O-N 3.1Å; N100-C103 PolarHBondContact O-SG 2.78Å
101	Q	87.4	Confident	89.6	Confident	78 Å²	78	62.1 Å²	62.1	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-73.2	-37.2	176.1	-175.9	168.1	-10.2	0	0	112	A86 D89 C90 D97 V98 A99	A86-Q101 HydrophobicContact CB-CB 4.01Å; A86-Q101 HydrophobicContact CB-CG 3.97Å; D89-Q101 PolarHBondContact OD2-NE2 2.84Å; C90-Q101 PolarHBondContact SG-OE1 3.36Å; D97-Q101 PolarHBondContact O-N 3.13Å; V98-Q101 PolarHBondContact O-N 3.38Å; A99-Q101 VanDerWaalsContact C-N 3.31Å; A99-Q101 PolarHBondContact O-N 3.24Å
102	M	82.7	Confident	89.9	Confident	13 Å²	13	68 Å²	68	6%	0.064	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-37.8	177.7	-76.6	-74.1	-74.7	0	0	113.8	W75 E79 A82 L83 A86 V98 A99 T104 K105	W75-M102 HydrophobicContact CH2-CE 4.27Å; W75-M102 HydrophobicContact CZ3-CE 3.66Å; E79-M102 HydrophobicContact CB-CE 4.27Å; E79-M102 WeakPolarHBondContact O-CE 3.24Å; A82-M102 HydrophobicContact CB-CE 4.42Å; A82-M102 HydrophobicContact CB-SD 3.41Å; A82-M102 WeakPolarHBondContact CB-SD 3.27Å; L83-M102 WeakPolarHBondContact CA-SD 3.38Å; L83-M102 HydrophobicContact CB-CE 3.93Å; L83-M102 HydrophobicContact CB-SD 4Å; L83-M102 PolarHBondContact N-SD 3.04Å; A86-M102 HydrophobicContact CB-CG 4.33Å; V98-M102 HydrophobicContact CG1-CG 4.45Å; V98-M102 WeakPolarHBondContact O-CB 3.46Å; V98-M102 VanDerWaalsContact O-CG 3.24Å; V98-M102 WeakPolarHBondContact O-CG 3.35Å; V98-M102 PolarHBondContact O-N 2.95Å; A99-M102 PolarHBondContact O-N 3.19Å; M102-T104 PolarHBondContact O-N 2.76Å; M102-K105 HydrophobicContact CE-CG 4.41Å
103	C	84.1	Confident	90	Very high	113 Å²	113	62.4 Å²	62.4	76%	0.764	33%	0.33	S	S	*	.	S	Bend	trans	58.8	-15.3	-175.5	-59.9	0	0	0	0	117.1	A99 N100	A99-C103 PolarHBondContact O-N 3.3Å; N100-C103 PolarHBondContact O-SG 2.78Å
104	T	84.8	Confident	90.2	Very high	84 Å²	84	62 Å²	62	52%	0.515	31%	0.314	S	S	.	.	S	Bend	trans	-102.4	-24.4	-174.9	61.4	0	0	0	0	114.6	E79 M102	E79-T104 WeakPolarHBondContact OE1-CB 3.2Å; E79-T104 PolarHBondContact OE1-OG1 2.63Å; E79-T104 VanDerWaalsContact OE1-OG1 3.1Å; M102-T104 PolarHBondContact O-N 2.76Å
105	K	89.2	Confident	90.1	Very high	40 Å²	40	61.3 Å²	61.3	17%	0.174	31%	0.309	C	S	.	.	S	Bend	trans	-127.9	154	-173.6	-59.7	-65.8	-172.3	-172.7	0	111.6	S74 W75 E79 M102 E109	S74-K105 PolarHBondContact O-NZ 2.96Å; W75-K105 HydrophobicContact CH2-CB 4.03Å; W75-K105 HydrophobicContact CH2-CD 4.36Å; W75-K105 HydrophobicContact CH2-CG 3.63Å; W75-K105 HydrophobicContact CZ2-CB 4.32Å; W75-K105 HydrophobicContact CZ2-CD 4.09Å; W75-K105 HydrophobicContact CZ2-CG 3.84Å; W75-K105 HydrophobicContact CZ3-CG 4.02Å; E79-K105 VanDerWaalsContact OE1-CE 3.24Å; E79-K105 WeakPolarHBondContact OE1-CE 3.34Å; E79-K105 IonicContact OE1-NZ 3.19Å; E79-K105 WeakPolarHBondContact OE2-CE 3.43Å; E79-K105 IonicContact OE2-NZ 3.74Å; M102-K105 HydrophobicContact CE-CG 4.41Å; K105-E109 WeakPolarHBondContact CA-OE2 3.45Å; K105-E109 HydrophobicContact CB-CB 4.3Å
106	T	93.3	Very high	89.8	Confident	64 Å²	64	65.2 Å²	65.2	39%	0.393	33%	0.327	S	S	.	.			trans	-80.5	164.9	176.6	74.2	0	0	0	0	112.1	E108 E109 C110	T106-E108 VanDerWaalsContact C-N 3.27Å; T106-E108 PolarHBondContact O-N 3.14Å; T106-E108 PolarHBondContact OG1-OE2 3.41Å; T106-E109 PolarHBondContact N-OE2 2.8Å; T106-E109 PolarHBondContact O-N 3.08Å; T106-E109 WeakPolarHBondContact OG1-CG 3.48Å; T106-E109 PolarHBondContact OG1-N 2.8Å; T106-C110 PolarHBondContact O-N 2.82Å; T106-C110 PolarHBondContact O-SG 3.36Å
107	K	93	Very high	89.4	Confident	78 Å²	78	62.2 Å²	62.2	34%	0.339	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-38.1	177.7	70.2	-178.8	176.6	-172.2	0	112.5	W95 Q96 A99 E109 E111	W95-K107 HydrophobicContact CB-CB 3.95Å; W95-K107 WeakPolarHBondContact O-CB 3.36Å; Q96-K107 VanDerWaalsContact OE1-CD 3.32Å; A99-K107 HydrophobicContact CB-CB 4.05Å; K107-E109 VanDerWaalsContact C-N 3.34Å; K107-E111 WeakPolarHBondContact O-CB 3.32Å; K107-E111 PolarHBondContact O-N 3.09Å
108	E	93.8	Very high	89	Confident	111 Å²	111	61.3 Å²	61.3	52%	0.519	31%	0.305	S	S	.	.	H	α-helix	trans	-68.9	-36.9	179.4	-61.9	78.3	-165.7	0	0	111	T106 K112	T106-E108 VanDerWaalsContact C-N 3.27Å; T106-E108 PolarHBondContact O-N 3.14Å; T106-E108 PolarHBondContact OG1-OE2 3.41Å; E108-K112 WeakPolarHBondContact O-CB 3.23Å; E108-K112 PolarHBondContact O-N 3.43Å
109	E	92.8	Very high	88.7	Confident	91 Å²	91	65.3 Å²	65.3	43%	0.425	33%	0.326	S	S	.	.	H	α-helix	trans	-67.4	-48	175.9	-70.9	171.6	164.3	0	0	111.1	W75 K105 T106 K107 K112 H113	W75-E109 HydrophobicContact CZ2-CB 4.41Å; K105-E109 WeakPolarHBondContact CA-OE2 3.45Å; K105-E109 HydrophobicContact CB-CB 4.3Å; T106-E109 PolarHBondContact N-OE2 2.8Å; T106-E109 PolarHBondContact O-N 3.08Å; T106-E109 WeakPolarHBondContact OG1-CG 3.48Å; T106-E109 PolarHBondContact OG1-N 2.8Å; K107-E109 VanDerWaalsContact C-N 3.34Å; E109-K112 PolarHBondContact O-N 3.01Å; E109-H113 WeakPolarHBondContact O-CB 3.17Å; E109-H113 PolarHBondContact O-N 3.01Å
110	C	91.7	Very high	88.2	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-48.6	176.9	-69.6	0	0	0	0	111.8	L83 W95 V98 T106 Y114	L83-C110 HydrophobicContact CD1-CB 3.77Å; W95-C110 HydrophobicContact CE3-CB 4.37Å; V98-C110 HydrophobicContact CG1-CB 4.39Å; T106-C110 PolarHBondContact O-N 2.82Å; T106-C110 PolarHBondContact O-SG 3.36Å; C110-Y114 VanDerWaalsContact O-CB 3.26Å; C110-Y114 WeakPolarHBondContact O-CB 3.42Å; C110-Y114 PolarHBondContact O-N 3.47Å
111	E	92.8	Very high	87.2	Confident	86 Å²	86	69 Å²	69	40%	0.402	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-51.7	178.4	178	169.6	-150.4	0	0	111.1	W95 K107 H113 Y114 M115	W95-E111 HydrophobicContact CB-CB 4.49Å; W95-E111 HydrophobicContact CD2-CB 3.7Å; W95-E111 HydrophobicContact CD2-CG 4.15Å; W95-E111 HydrophobicContact CE3-CB 4.26Å; W95-E111 HydrophobicContact CG-CB 3.76Å; W95-E111 HydrophobicContact CG-CG 4.24Å; W95-E111 HydrophobicContact CZ2-CB 4.5Å; W95-E111 HydrophobicContact CZ2-CG 4.27Å; W95-E111 VanDerWaalsContact NE1-CD 3.26Å; W95-E111 PolarHBondContact NE1-OE1 3.48Å; W95-E111 VanDerWaalsContact NE1-OE1 3.14Å; K107-E111 WeakPolarHBondContact O-CB 3.32Å; K107-E111 PolarHBondContact O-N 3.09Å; E111-H113 VanDerWaalsContact C-N 3.32Å; E111-H113 PolarHBondContact O-N 3.28Å; E111-Y114 PolarHBondContact O-N 2.96Å; E111-M115 HydrophobicContact CG-CG 4.34Å; E111-M115 WeakPolarHBondContact O-CB 3.49Å; E111-M115 WeakPolarHBondContact O-CG 3.24Å; E111-M115 PolarHBondContact O-N 2.87Å
112	K	92	Very high	85.8	Confident	155 Å²	155	70.5 Å²	70.5	67%	0.674	36%	0.361	S	S	*	.	H	α-helix	trans	-61.1	-43.1	-177.9	-176.8	-178.2	178.2	-174.5	0	111.5	E108 E109 K116	E108-K112 WeakPolarHBondContact O-CB 3.23Å; E108-K112 PolarHBondContact O-N 3.43Å; E109-K112 PolarHBondContact O-N 3.01Å; K112-K116 WeakPolarHBondContact O-CB 3.46Å; K112-K116 PolarHBondContact O-N 2.8Å
113	H	90.3	Very high	84.5	Confident	9 Å²	9	75 Å²	75	4%	0.042	38%	0.384	C	S	.	.	H	α-helix	trans	-65.4	-49.3	179.7	-171	71.4	0	0	0	111.3	W75 E80 E109 E111 M115 K116 H117	W75-H113 AromaticContact CD1-CE1 3.58Å; W75-H113 AromaticContact CD1-ND1 3.57Å; W75-H113 AromaticContact CD2-CD2 3.66Å; W75-H113 AromaticContact CD2-CE1 3.82Å; W75-H113 AromaticContact CD2-CG 3.81Å; W75-H113 AromaticContact CD2-ND1 3.96Å; W75-H113 AromaticContact CD2-NE2 3.67Å; W75-H113 AromaticContact CE2-CD2 3.77Å; W75-H113 AromaticContact CE2-CG 3.46Å; W75-H113 VanDerWaalsContact CE2-CG 3.46Å; W75-H113 AromaticContact CE2-ND1 3.72Å; W75-H113 AromaticContact CE3-CD2 3.78Å; W75-H113 AromaticContact CE3-NE2 3.93Å; W75-H113 AromaticContact CG-CE1 3.54Å; W75-H113 AromaticContact CG-ND1 3.9Å; W75-H113 AromaticContact CG-NE2 3.76Å; W75-H113 HydrophobicContact CH2-CB 4.06Å; W75-H113 HydrophobicContact CZ2-CB 3.49Å; W75-H113 VanDerWaalsContact CZ2-CB 3.49Å; W75-H113 AromaticContact CZ2-CG 3.7Å; W75-H113 AromaticContact CZ3-CD2 4Å; W75-H113 AromaticContact NE1-CE1 3.91Å; W75-H113 AromaticContact NE1-CG 3.69Å; W75-H113 AromaticContact NE1-ND1 3.46Å; W75-H113 PolarHBondContact NE1-ND1 3.19Å; E80-H113 IonicContact OE1-CE1 2.73Å; E80-H113 PolarHBondContact OE1-CE1 3.41Å; E80-H113 VanDerWaalsContact OE1-CE1 3.29Å; E80-H113 IonicContact OE1-NE2 3.74Å; E80-H113 PolarHBondContact OE1-NE2 3.28Å; E80-H113 IonicContact OE2-CD2 3.51Å; E80-H113 IonicContact OE2-CE1 3.39Å; E80-H113 IonicContact OE2-NE2 3.31Å; E80-H113 PolarHBondContact OE2-NE2 3.47Å; E109-H113 WeakPolarHBondContact O-CB 3.17Å; E109-H113 PolarHBondContact O-N 3.01Å; E111-H113 VanDerWaalsContact C-N 3.32Å; E111-H113 PolarHBondContact O-N 3.28Å; H113-M115 PolarHBondContact O-N 2.77Å; H113-K116 PolarHBondContact O-N 3.45Å; H113-H117 AromaticContact CE1-CD2 3.42Å; H113-H117 PolarHBondContact CE1-CD2 3.48Å; H113-H117 VanDerWaalsContact CE1-CD2 3.42Å; H113-H117 AromaticContact CE1-NE2 3.89Å; H113-H117 AromaticContact ND1-CD2 3.29Å; H113-H117 PolarHBondContact ND1-CD2 2.8Å; H113-H117 VanDerWaalsContact ND1-CD2 3.29Å; H113-H117 AromaticContact ND1-NE2 3.81Å; H113-H117 PolarHBondContact O-N 3.26Å
114	Y	89.2	Confident	83.1	Confident	38 Å²	38	75.6 Å²	75.6	15%	0.149	37%	0.374	C	S	.	.	H	α-helix	trans	-58.3	-48.5	178.5	-169	-90	0	0	0	111.7	L83 L84 V87 F92 W95 C110 E111 K116 F118 I119	L83-Y114 HydrophobicContact CD2-CD2 4.34Å; L83-Y114 HydrophobicContact CG-CD2 4.47Å; L84-Y114 HydrophobicContact CD2-CD2 4.39Å; L84-Y114 HydrophobicContact CD2-CE2 3.84Å; V87-Y114 HydrophobicContact CB-CE2 4.33Å; V87-Y114 HydrophobicContact CG1-CE2 4.02Å; V87-Y114 HydrophobicContact CG2-CD2 4.12Å; V87-Y114 HydrophobicContact CG2-CE2 4.13Å; F92-Y114 HydrophobicContact CD2-CD1 4.19Å; F92-Y114 AromaticContact CD2-CE1 3.62Å; F92-Y114 HydrophobicContact CD2-CE1 3.62Å; F92-Y114 AromaticContact CE2-CD1 3.88Å; F92-Y114 HydrophobicContact CE2-CD1 3.88Å; F92-Y114 AromaticContact CE2-CE1 3.54Å; F92-Y114 HydrophobicContact CE2-CE1 3.54Å; W95-Y114 AromaticContact CH2-CD1 3.63Å; W95-Y114 HydrophobicContact CH2-CD1 3.63Å; W95-Y114 HydrophobicContact CH2-CD2 4.5Å; W95-Y114 HydrophobicContact CH2-CE1 4.33Å; W95-Y114 AromaticContact CH2-CG 3.71Å; W95-Y114 HydrophobicContact CH2-CG 3.71Å; W95-Y114 HydrophobicContact CZ2-CD1 4.45Å; W95-Y114 HydrophobicContact CZ3-CD1 4.48Å; W95-Y114 HydrophobicContact CZ3-CG 4.13Å; C110-Y114 VanDerWaalsContact O-CB 3.26Å; C110-Y114 WeakPolarHBondContact O-CB 3.42Å; C110-Y114 PolarHBondContact O-N 3.47Å; E111-Y114 PolarHBondContact O-N 2.96Å; Y114-K116 PolarHBondContact O-N 2.86Å; Y114-F118 HydrophobicContact CD2-CB 4.42Å; Y114-F118 HydrophobicContact CD2-CD2 4.13Å; Y114-F118 HydrophobicContact CD2-CG 4.41Å; Y114-F118 HydrophobicContact CE2-CB 4.34Å; Y114-F118 HydrophobicContact CE2-CG 4.47Å; Y114-F118 WeakPolarHBondContact O-CB 3.26Å; Y114-F118 PolarHBondContact O-N 2.84Å; Y114-I119 HydrophobicContact CD1-CD1 4.49Å; Y114-I119 HydrophobicContact CD1-CG1 3.95Å; Y114-I119 HydrophobicContact CE1-CD1 3.8Å; Y114-I119 HydrophobicContact CE1-CG1 3.76Å; Y114-I119 PolarHBondContact O-N 3.15Å
115	M	89.2	Confident	81.6	Confident	43 Å²	43	74.9 Å²	74.9	21%	0.212	38%	0.377	C	S	.	.	I	π-helix	trans	-62.2	-44.6	178.7	-67.3	-63.2	154	0	0	112	F92 W95 E111 H113 I119 N120	F92-M115 HydrophobicContact CD2-CE 4.46Å; F92-M115 HydrophobicContact CE1-CE 4.36Å; F92-M115 HydrophobicContact CE2-CE 3.31Å; F92-M115 HydrophobicContact CE2-SD 4.34Å; F92-M115 HydrophobicContact CZ-CE 3.27Å; F92-M115 HydrophobicContact CZ-SD 4.2Å; W95-M115 HydrophobicContact CH2-CE 4.14Å; W95-M115 HydrophobicContact CZ2-CE 3.4Å; E111-M115 HydrophobicContact CG-CG 4.34Å; E111-M115 WeakPolarHBondContact O-CB 3.49Å; E111-M115 WeakPolarHBondContact O-CG 3.24Å; E111-M115 PolarHBondContact O-N 2.87Å; H113-M115 PolarHBondContact O-N 2.77Å; M115-I119 PolarHBondContact O-N 3.07Å; M115-I119 HydrophobicContact SD-CB 4.35Å; M115-I119 HydrophobicContact SD-CG1 4.1Å; M115-N120 WeakPolarHBondContact O-CB 3.38Å; M115-N120 PolarHBondContact O-N 3.24Å; M115-N120 PolarHBondContact O-ND2 3.36Å
116	K	87.4	Confident	80	Confident	99 Å²	99	75 Å²	75	43%	0.43	38%	0.383	S	S	.	.	I	π-helix	trans	-66.7	-46.9	-177	178.5	-175.8	167.1	-142.3	0	112.1	D72 K112 H113 Y114 N121	D72-K116 IonicContact OD2-NZ 3.16Å; D72-K116 PolarHBondContact OD2-NZ 2.84Å; D72-K116 VanDerWaalsContact OD2-NZ 3.16Å; K112-K116 WeakPolarHBondContact O-CB 3.46Å; K112-K116 PolarHBondContact O-N 2.8Å; H113-K116 PolarHBondContact O-N 3.45Å; Y114-K116 PolarHBondContact O-N 2.86Å; K116-N121 VanDerWaalsContact O-CB 3.29Å; K116-N121 WeakPolarHBondContact O-CB 3.29Å; K116-N121 PolarHBondContact O-N 2.82Å
117	H	82.8	Confident	78.2	Confident	28 Å²	28	73.3 Å²	73.3	13%	0.13	37%	0.373	C	S	.	.	I	π-helix	trans	-97	-28.2	-167.9	-71.6	-83.7	0	0	0	114.3	L71 D72 H113	L71-H117 HydrophobicContact CD1-CB 4.11Å; D72-H117 IonicContact OD2-NE2 3.81Å; H113-H117 AromaticContact CE1-CD2 3.42Å; H113-H117 PolarHBondContact CE1-CD2 3.48Å; H113-H117 VanDerWaalsContact CE1-CD2 3.42Å; H113-H117 AromaticContact CE1-NE2 3.89Å; H113-H117 AromaticContact ND1-CD2 3.29Å; H113-H117 PolarHBondContact ND1-CD2 2.8Å; H113-H117 VanDerWaalsContact ND1-CD2 3.29Å; H113-H117 AromaticContact ND1-NE2 3.81Å; H113-H117 PolarHBondContact O-N 3.26Å
118	F	80.9	Confident	76.3	Confident	53 Å²	53	73.9 Å²	73.9	23%	0.232	38%	0.379	C	S	.	.	I	π-helix	trans	-109.6	-27.5	-175.1	-62.1	-89.8	0	0	0	113.9	L71 L84 Y114	L71-F118 HydrophobicContact CD1-CE1 4.18Å; L71-F118 HydrophobicContact CD1-CE2 3.89Å; L71-F118 HydrophobicContact CD1-CZ 3.55Å; L84-F118 HydrophobicContact CD1-CE1 3.93Å; L84-F118 HydrophobicContact CD1-CZ 4.24Å; L84-F118 HydrophobicContact CD2-CD1 4Å; L84-F118 HydrophobicContact CD2-CE1 3.77Å; L84-F118 HydrophobicContact CD2-CE2 4.47Å; L84-F118 HydrophobicContact CD2-CG 4.44Å; L84-F118 HydrophobicContact CD2-CZ 4.01Å; L84-F118 HydrophobicContact CG-CE1 4.24Å; L84-F118 HydrophobicContact CG-CZ 4.27Å; Y114-F118 HydrophobicContact CD2-CB 4.42Å; Y114-F118 HydrophobicContact CD2-CD2 4.13Å; Y114-F118 HydrophobicContact CD2-CG 4.41Å; Y114-F118 HydrophobicContact CE2-CB 4.34Å; Y114-F118 HydrophobicContact CE2-CG 4.47Å; Y114-F118 WeakPolarHBondContact O-CB 3.26Å; Y114-F118 PolarHBondContact O-N 2.84Å
119	I	84.6	Confident	74.3	Confident	84 Å²	84	73.6 Å²	73.6	43%	0.431	38%	0.38	S	S	.	.	I	π-helix	trans	-102.1	-56.8	-179.9	-56.8	-58.4	0	0	0	112.3	F92 Y114 M115 N121	F92-I119 HydrophobicContact CE2-CG1 4.47Å; Y114-I119 HydrophobicContact CD1-CD1 4.49Å; Y114-I119 HydrophobicContact CD1-CG1 3.95Å; Y114-I119 HydrophobicContact CE1-CD1 3.8Å; Y114-I119 HydrophobicContact CE1-CG1 3.76Å; Y114-I119 PolarHBondContact O-N 3.15Å; M115-I119 PolarHBondContact O-N 3.07Å; M115-I119 HydrophobicContact SD-CB 4.35Å; M115-I119 HydrophobicContact SD-CG1 4.1Å; I119-N121 VanDerWaalsContact C-N 3.35Å; I119-N121 PolarHBondContact O-N 2.95Å
120	N	80.1	Confident	72.4	Confident	122 Å²	122	73.7 Å²	73.7	65%	0.652	38%	0.384	S	S	*	.	S	Bend	trans	-80.4	-16.9	-171.8	-66.1	-28.6	0	0	0	113.3	M115 P122	M115-N120 WeakPolarHBondContact O-CB 3.38Å; M115-N120 PolarHBondContact O-N 3.24Å; M115-N120 PolarHBondContact O-ND2 3.36Å; N120-P122 WeakPolarHBondContact O-CD 3.35Å
121	N	70.1	Confident	70.6	Confident	61 Å²	61	76.2 Å²	76.2	33%	0.326	40%	0.397	S	S	.	.			trans	-117	82.7	176.5	-170.7	6.5	0	0	0	110.6	K116 I119 L123	K116-N121 VanDerWaalsContact O-CB 3.29Å; K116-N121 WeakPolarHBondContact O-CB 3.29Å; K116-N121 PolarHBondContact O-N 2.82Å; I119-N121 VanDerWaalsContact C-N 3.35Å; I119-N121 PolarHBondContact O-N 2.95Å; N121-L123 PolarHBondContact O-N 3.46Å; N121-L123 VanDerWaalsContact O-N 3.09Å
122	P	57.1	Low	68.6	Low	109 Å²	109	78.3 Å²	78.3	71%	0.708	41%	0.405	S	S	*	.			trans	-71.8	0.3	-177.6	28.5	-34.1	0	0	0	113.9	N120 F124	N120-P122 WeakPolarHBondContact O-CD 3.35Å; P122-F124 PolarHBondContact O-N 3.04Å
123	L	55.5	Low	66.7	Low	106 Å²	106	76.3 Å²	76.3	56%	0.555	40%	0.398	S	S	*	.			trans	-86.1	53.6	-179.2	-61.8	173.9	0	0	0	112.2	N121 A125 S126 T127	N121-L123 PolarHBondContact O-N 3.46Å; N121-L123 VanDerWaalsContact O-N 3.09Å; L123-A125 PolarHBondContact O-N 2.95Å; L123-S126 VanDerWaalsContact CB-OG 3.25Å; L123-S126 WeakPolarHBondContact CB-OG 3.36Å; L123-S126 PolarHBondContact O-N 3.28Å; L123-S126 PolarHBondContact O-OG 2.87Å; L123-T127 PolarHBondContact O-N 3.37Å; L123-T127 PolarHBondContact O-OG1 2.88Å
124	F	55.5	Low	64.8	Low	126 Å²	126	78.1 Å²	78.1	55%	0.553	42%	0.415	S	S	*	.	H	α-helix	trans	-51.6	-32.5	171.7	-170.9	-103	0	0	0	112	P122 T127 L128	P122-F124 PolarHBondContact O-N 3.04Å; F124-T127 PolarHBondContact O-N 3.29Å; F124-L128 HydrophobicContact CD1-CD1 3.91Å; F124-L128 HydrophobicContact CD1-CG 4.44Å; F124-L128 HydrophobicContact CE1-CD1 3.57Å; F124-L128 HydrophobicContact CE1-CG 4.17Å; F124-L128 HydrophobicContact CZ-CD1 4.31Å; F124-L128 PolarHBondContact O-N 2.96Å
125	A	52.6	Low	63	Low	69 Å²	69	82.6 Å²	82.6	57%	0.57	44%	0.437	S	S	*	.	H	α-helix	trans	-65.7	-34.3	176.3	0	0	0	0	0	114.4	L123 L129	L123-A125 PolarHBondContact O-N 2.95Å; A125-L129 WeakPolarHBondContact O-CD1 3.15Å; A125-L129 WeakPolarHBondContact O-CG 3.47Å; A125-L129 PolarHBondContact O-N 2.9Å
126	S	54.9	Low	61.1	Low	43 Å²	43	86.2 Å²	86.2	30%	0.301	45%	0.453	S	S	.	.	H	α-helix	trans	-79.5	-30	178.5	64.7	0	0	0	0	112.1	L123 L129 N130	L123-S126 VanDerWaalsContact CB-OG 3.25Å; L123-S126 WeakPolarHBondContact CB-OG 3.36Å; L123-S126 PolarHBondContact O-N 3.28Å; L123-S126 PolarHBondContact O-OG 2.87Å; S126-L129 WeakPolarHBondContact O-CB 3.19Å; S126-L129 PolarHBondContact O-N 3.3Å; S126-N130 VanDerWaalsContact O-CG 3.31Å; S126-N130 PolarHBondContact O-N 3.45Å
127	T	55.5	Low	59.3	Low	29 Å²	29	84.9 Å²	84.9	18%	0.178	46%	0.461	C	S	.	.	H	α-helix	trans	-69	-37.8	175.5	-46.9	0	0	0	0	112	L71 L123 F124 N130 L131	L71-T127 HydrophobicContact CD2-CG2 3.5Å; L71-T127 VanDerWaalsContact CD2-CG2 3.5Å; L123-T127 PolarHBondContact O-N 3.37Å; L123-T127 PolarHBondContact O-OG1 2.88Å; F124-T127 PolarHBondContact O-N 3.29Å; T127-N130 PolarHBondContact O-N 3.46Å; T127-L131 PolarHBondContact O-N 3.25Å
128	L	54.4	Low	57.9	Low	90 Å²	90	92.4 Å²	92.4	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-67	-34.8	171	-70.1	177.3	0	0	0	112.8	F124 L131 K132	F124-L128 HydrophobicContact CD1-CD1 3.91Å; F124-L128 HydrophobicContact CD1-CG 4.44Å; F124-L128 HydrophobicContact CE1-CD1 3.57Å; F124-L128 HydrophobicContact CE1-CG 4.17Å; F124-L128 HydrophobicContact CZ-CD1 4.31Å; F124-L128 PolarHBondContact O-N 2.96Å; L128-L131 HydrophobicContact CD2-CD1 4.19Å; L128-L131 PolarHBondContact O-N 3.14Å; L128-K132 PolarHBondContact O-N 3.49Å; L128-K132 VanDerWaalsContact O-N 3.14Å
129	L	51.5	Low	56.3	Low	104 Å²	104	95 Å²	95	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-38.1	171.8	-76	164.6	0	0	0	111.7	A125 S126 K132 Q133	A125-L129 WeakPolarHBondContact O-CD1 3.15Å; A125-L129 WeakPolarHBondContact O-CG 3.47Å; A125-L129 PolarHBondContact O-N 2.9Å; S126-L129 WeakPolarHBondContact O-CB 3.19Å; S126-L129 PolarHBondContact O-N 3.3Å; L129-K132 PolarHBondContact O-N 2.79Å; L129-Q133 WeakPolarHBondContact O-CG 3.23Å; L129-Q133 PolarHBondContact O-N 3.44Å
130	N	52.1	Low	54.3	Low	93 Å²	93	93 Å²	93	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-67.7	-33.4	174.9	-73.5	-19.2	0	0	0	112.5	S126 T127 Q133 A134	S126-N130 VanDerWaalsContact O-CG 3.31Å; S126-N130 PolarHBondContact O-N 3.45Å; T127-N130 PolarHBondContact O-N 3.46Å; N130-Q133 PolarHBondContact O-N 3.18Å; N130-A134 VanDerWaalsContact O-CB 3.3Å; N130-A134 WeakPolarHBondContact O-CB 3.47Å; N130-A134 PolarHBondContact O-N 2.95Å
131	L	53.2	Low	52.9	Low	53 Å²	53	95.3 Å²	95.3	28%	0.277	52%	0.522	S	S	.	.	H	α-helix	trans	-65.7	-42.7	172.5	-77.7	164	0	0	0	111.5	V70 T127 L128 Q133 A134 E135	V70-L131 HydrophobicContact CG1-CD1 3.85Å; T127-L131 PolarHBondContact O-N 3.25Å; L128-L131 HydrophobicContact CD2-CD1 4.19Å; L128-L131 PolarHBondContact O-N 3.14Å; L131-Q133 VanDerWaalsContact C-N 3.35Å; L131-Q133 PolarHBondContact O-N 2.89Å; L131-A134 PolarHBondContact O-N 3.47Å; L131-E135 PolarHBondContact O-N 2.86Å
132	K	51.5	Low	51.8	Low	131 Å²	131	97.3 Å²	97.3	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-59.9	-43	170.8	-91.9	-170.2	172.4	-172.6	0	112.4	L128 L129 A134 E135 E136	L128-K132 PolarHBondContact O-N 3.49Å; L128-K132 VanDerWaalsContact O-N 3.14Å; L129-K132 PolarHBondContact O-N 2.79Å; K132-A134 VanDerWaalsContact C-N 3.33Å; K132-A134 PolarHBondContact O-N 3.12Å; K132-E135 PolarHBondContact O-N 3.16Å; K132-E136 VanDerWaalsContact O-CB 3.3Å; K132-E136 WeakPolarHBondContact O-CB 3.33Å; K132-E136 VanDerWaalsContact O-CG 3.25Å; K132-E136 WeakPolarHBondContact O-CG 3.02Å; K132-E136 PolarHBondContact O-N 3.09Å
133	Q	51.8	Low	51.5	Low	112 Å²	112	96.5 Å²	96.5	52%	0.523	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-33.1	176.9	-72.4	175	4.9	0	0	112.5	L129 N130 L131 A137	L129-Q133 WeakPolarHBondContact O-CG 3.23Å; L129-Q133 PolarHBondContact O-N 3.44Å; N130-Q133 PolarHBondContact O-N 3.18Å; L131-Q133 VanDerWaalsContact C-N 3.35Å; L131-Q133 PolarHBondContact O-N 2.89Å; Q133-A137 WeakPolarHBondContact O-CB 3.47Å; Q133-A137 PolarHBondContact O-N 2.97Å
134	A	52	Low	51.5	Low	48 Å²	48	98.1 Å²	98.1	40%	0.397	55%	0.546	S	S	.	.	H	α-helix	trans	-74.5	-34.6	175.4	0	0	0	0	0	112.4	N130 L131 K132 K138	N130-A134 VanDerWaalsContact O-CB 3.3Å; N130-A134 WeakPolarHBondContact O-CB 3.47Å; N130-A134 PolarHBondContact O-N 2.95Å; L131-A134 PolarHBondContact O-N 3.47Å; K132-A134 VanDerWaalsContact C-N 3.33Å; K132-A134 PolarHBondContact O-N 3.12Å; A134-K138 WeakPolarHBondContact O-CG 3.42Å; A134-K138 PolarHBondContact O-N 3.1Å; A134-K138 VanDerWaalsContact O-N 3.09Å
135	E	50.9	Low	51.4	Low	131 Å²	131	95.9 Å²	95.9	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-64.8	-47.2	167.2	-103.8	177.3	160.8	0	0	110.9	L131 K132 A137 K138 T139	L131-E135 PolarHBondContact O-N 2.86Å; K132-E135 PolarHBondContact O-N 3.16Å; E135-A137 VanDerWaalsContact C-N 3.29Å; E135-A137 PolarHBondContact O-N 3.44Å; E135-K138 CarbonylContact O-C 3.57Å; E135-K138 WeakPolarHBondContact O-CA 3.48Å; E135-K138 PolarHBondContact O-N 3.46Å; E135-T139 PolarHBondContact O-N 3.19Å; E135-T139 PolarHBondContact O-OG1 3.34Å; E135-T139 VanDerWaalsContact O-OG1 3.08Å
136	E	48.6	Very low	51.4	Low	119 Å²	119	98 Å²	98	56%	0.556	54%	0.541	S	S	*	.	H	α-helix	trans	-60.3	-37.9	175.8	-76.8	170.8	-175.4	0	0	111.7	K132 K138 T139 A140	K132-E136 VanDerWaalsContact O-CB 3.3Å; K132-E136 WeakPolarHBondContact O-CB 3.33Å; K132-E136 VanDerWaalsContact O-CG 3.25Å; K132-E136 WeakPolarHBondContact O-CG 3.02Å; K132-E136 PolarHBondContact O-N 3.09Å; E136-K138 VanDerWaalsContact C-N 3.33Å; E136-T139 VanDerWaalsContact CA-OG1 3.27Å; E136-T139 WeakPolarHBondContact CA-OG1 3.3Å; E136-T139 CarbonylContact O-C 3.58Å; E136-T139 PolarHBondContact O-N 3.38Å; E136-T139 PolarHBondContact O-OG1 3.5Å; E136-A140 VanDerWaalsContact O-CB 3.23Å; E136-A140 WeakPolarHBondContact O-CB 3.17Å; E136-A140 PolarHBondContact O-N 3.13Å
137	A	49.9	Very low	51.5	Low	71 Å²	71	101.9 Å²	101.9	59%	0.587	56%	0.555	S	S	*	*	H	α-helix	trans	-71.1	-24.1	174.3	0	0	0	0	0	113.6	Q133 E135	Q133-A137 WeakPolarHBondContact O-CB 3.47Å; Q133-A137 PolarHBondContact O-N 2.97Å; E135-A137 VanDerWaalsContact C-N 3.29Å; E135-A137 PolarHBondContact O-N 3.44Å
138	K	52.4	Low	51.6	Low	186 Å²	186	104.6 Å²	104.6	81%	0.809	58%	0.575	S	S	*	*	H	α-helix	trans	-84.8	-31.1	172.1	-74.8	175.3	-178.1	178.5	0	112.3	A134 E135 E136 A140	A134-K138 WeakPolarHBondContact O-CG 3.42Å; A134-K138 PolarHBondContact O-N 3.1Å; A134-K138 VanDerWaalsContact O-N 3.09Å; E135-K138 CarbonylContact O-C 3.57Å; E135-K138 WeakPolarHBondContact O-CA 3.48Å; E135-K138 PolarHBondContact O-N 3.46Å; E136-K138 VanDerWaalsContact C-N 3.33Å; K138-A140 VanDerWaalsContact C-N 3.35Å
139	T	47	Very low	51.7	Low	109 Å²	109	103.2 Å²	103.2	67%	0.669	57%	0.57	S	S	*	*	H	α-helix	trans	-85.6	-8.4	173.2	55.8	0	0	0	0	113.4	E135 E136 D141	E135-T139 PolarHBondContact O-N 3.19Å; E135-T139 PolarHBondContact O-OG1 3.34Å; E135-T139 VanDerWaalsContact O-OG1 3.08Å; E136-T139 VanDerWaalsContact CA-OG1 3.27Å; E136-T139 WeakPolarHBondContact CA-OG1 3.3Å; E136-T139 CarbonylContact O-C 3.58Å; E136-T139 PolarHBondContact O-N 3.38Å; E136-T139 PolarHBondContact O-OG1 3.5Å; T139-D141 PolarHBondContact O-N 3.11Å
140	A	43.7	Very low	52.1	Low	42 Å²	42	105.4 Å²	105.4	35%	0.347	58%	0.582	S	S	.	*			trans	-72.4	76	167	0	0	0	0	0	108.3	E136 K138 T142	E136-A140 VanDerWaalsContact O-CB 3.23Å; E136-A140 WeakPolarHBondContact O-CB 3.17Å; E136-A140 PolarHBondContact O-N 3.13Å; K138-A140 VanDerWaalsContact C-N 3.35Å; A140-T142 HydrophobicContact CB-CG2 3.99Å; A140-T142 WeakPolarHBondContact CB-OG1 3.32Å; A140-T142 PolarHBondContact O-N 3.34Å; A140-T142 PolarHBondContact O-OG1 2.92Å
141	D	49.8	Very low	52.5	Low	170 Å²	170	107.2 Å²	107.2	91%	0.909	59%	0.592	S	S	*	*			trans	-62.8	38.7	148.1	-137.4	10.1	0	0	0	109.5	T139 A143	T139-D141 PolarHBondContact O-N 3.11Å; D141-A143 PolarHBondContact O-N 3.3Å
142	T	47	Very low	52.9	Low	102 Å²	102	108.1 Å²	108.1	63%	0.626	60%	0.601	S	S	*	*			trans	-69.5	128	169.2	41.7	0	0	0	0	106.7	A140 I144	A140-T142 HydrophobicContact CB-CG2 3.99Å; A140-T142 WeakPolarHBondContact CB-OG1 3.32Å; A140-T142 PolarHBondContact O-N 3.34Å; A140-T142 PolarHBondContact O-OG1 2.92Å; T142-I144 PolarHBondContact O-N 3.19Å; T142-I144 VanDerWaalsContact O-N 3.07Å
143	A	52	Low	53.7	Low	92 Å²	92	102.6 Å²	102.6	76%	0.76	58%	0.579	S	S	*	*			trans	-34.7	119.1	169.7	0	0	0	0	0	110.2	D141 P145	D141-A143 PolarHBondContact O-N 3.3Å; A143-P145 WeakPolarHBondContact O-CD 3.29Å
144	I	54.8	Low	54.8	Low	140 Å²	140	100.2 Å²	100.2	72%	0.718	57%	0.565	S	S	*	*			trans	-49.3	113.7	177.7	-60	168.8	0	0	0	106.7	T142 F146	T142-I144 PolarHBondContact O-N 3.19Å; T142-I144 VanDerWaalsContact O-N 3.07Å; I144-F146 PolarHBondContact O-N 3.43Å
145	P	53.3	Low	55.9	Low	80 Å²	80	99 Å²	99	52%	0.519	55%	0.553	S	S	.	*			trans	-55.7	132.1	-176.7	-24.4	32.6	0	0	0	109.1	A143 H147	A143-P145 WeakPolarHBondContact O-CD 3.29Å; P145-H147 PolarHBondContact O-CD2 3.07Å; P145-H147 PolarHBondContact O-N 2.93Å
146	F	52.4	Low	57.2	Low	113 Å²	113	96.3 Å²	96.3	50%	0.496	55%	0.545	S	S	.	.			trans	-62.3	109	177.3	175.3	-88.4	0	0	0	108.5	I144 R154 T156	I144-F146 PolarHBondContact O-N 3.43Å; F146-R154 HydrophobicContact CD2-CG 4.11Å; F146-R154 HydrophobicContact CE2-CG 3.66Å; F146-R154 HydrophobicContact CZ-CG 4.48Å; F146-T156 HydrophobicContact CE1-CG2 4.28Å; F146-T156 HydrophobicContact CZ-CG2 4.2Å
147	H	58	Low	58.5	Low	125 Å²	125	100.2 Å²	100.2	58%	0.579	56%	0.561	S	S	*	*			trans	-116.5	128.6	167.4	-62.1	-55.8	0	0	0	107.5	P145 T149	P145-H147 PolarHBondContact O-CD2 3.07Å; P145-H147 PolarHBondContact O-N 2.93Å; H147-T149 PolarHBondContact O-N 3.45Å
148	S	57.4	Low	59.9	Low	86 Å²	86	102.2 Å²	102.2	60%	0.601	56%	0.562	S	S	*	*			trans	-63	104.6	170	-59.1	0	0	0	0	108
149	T	57.1	Low	61.4	Low	61 Å²	61	94.7 Å²	94.7	37%	0.374	53%	0.532	S	S	.	.			trans	-109.7	142.2	174	52	0	0	0	0	109.2	H147 P152 P153 R154	H147-T149 PolarHBondContact O-N 3.45Å; T149-P152 PolarHBondContact OG1-O 2.77Å; T149-P153 CarbonylContact O-C 3.55Å; T149-P153 VanDerWaalsContact O-CA 3.3Å; T149-P153 WeakPolarHBondContact O-CA 3.4Å; T149-R154 PolarHBondContact O-N 2.99Å
150	D	59.9	Low	63.1	Low	149 Å²	149	95.2 Å²	95.2	80%	0.797	53%	0.531	S	S	*	.	B	Isolated β-bridge	trans	-78.8	-21.8	178.3	-71.7	-37.9	0	0	0	112.8	P153	D150-P153 WeakPolarHBondContact O-CA 2.9Å; D150-P153 WeakPolarHBondContact O-CD 3.14Å
151	D	59.8	Low	64.8	Low	132 Å²	132	95.6 Å²	95.6	71%	0.706	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.1	114	179	-155.8	-1.2	0	0	0	112.7
152	P	60.6	Low	66.3	Low	72 Å²	72	89.1 Å²	89.1	47%	0.468	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	cis	-64.4	141.2	-12.3	27.8	-32.7	0	0	0	110.3	T149 R154	T149-P152 PolarHBondContact OG1-O 2.77Å; P152-R154 PolarHBondContact O-N 3.14Å; P152-R154 VanDerWaalsContact O-N 3.1Å
153	P	68.8	Low	68	Low	15 Å²	15	92.3 Å²	92.3	10%	0.097	50%	0.495	C	S	.	.	B	Isolated β-bridge	trans	-59.5	118.3	-175.4	22	-32	0	0	0	109.6	T149 D150 P155 L161 M165 P170	T149-P153 CarbonylContact O-C 3.55Å; T149-P153 VanDerWaalsContact O-CA 3.3Å; T149-P153 WeakPolarHBondContact O-CA 3.4Å; D150-P153 WeakPolarHBondContact O-CA 2.9Å; D150-P153 WeakPolarHBondContact O-CD 3.14Å; P153-P155 WeakPolarHBondContact O-CD 3.49Å; P153-L161 HydrophobicContact CB-CD2 4.38Å; P153-M165 HydrophobicContact CB-CE 4.5Å; P153-M165 HydrophobicContact CB-SD 4.23Å; P153-M165 HydrophobicContact CG-CE 3.97Å; P153-M165 HydrophobicContact CG-SD 4.16Å; P153-P170 VanDerWaalsContact O-CB 3.29Å; P153-P170 WeakPolarHBondContact O-CB 3.42Å; P153-P170 WeakPolarHBondContact O-CG 3.45Å
154	R	75.5	Confident	69.4	Low	61 Å²	61	91.4 Å²	91.4	23%	0.23	48%	0.478	C	S	.	.			trans	-113.6	71.5	177.2	-165.9	-177	-68.5	-114	-2.7	110	F146 T149 P152 P170 A171	F146-R154 HydrophobicContact CD2-CG 4.11Å; F146-R154 HydrophobicContact CE2-CG 3.66Å; F146-R154 HydrophobicContact CZ-CG 4.48Å; T149-R154 PolarHBondContact O-N 2.99Å; P152-R154 PolarHBondContact O-N 3.14Å; P152-R154 VanDerWaalsContact O-N 3.1Å; R154-P170 HydrophobicContact CB-CB 4.49Å; R154-P170 HydrophobicContact CG-CB 4.49Å; R154-A171 VanDerWaalsContact NH1-CB 3.28Å
155	P	76.1	Confident	70.8	Confident	23 Å²	23	85 Å²	85	15%	0.149	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-61.8	152.7	-179.4	22.4	-31.2	0	0	0	112.1	P153 S159 L161 M165	P153-P155 WeakPolarHBondContact O-CD 3.49Å; P155-S159 VanDerWaalsContact CB-OG 3.24Å; P155-S159 WeakPolarHBondContact CB-OG 3.34Å; P155-L161 HydrophobicContact CB-CB 4.1Å; P155-L161 HydrophobicContact CB-CD2 4.16Å; P155-L161 HydrophobicContact CB-CG 4.21Å; P155-L161 HydrophobicContact CG-CG 4.35Å; P155-M165 HydrophobicContact CG-SD 3.68Å
156	T	77.9	Confident	72.2	Confident	74 Å²	74	85 Å²	85	45%	0.454	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-60.8	146.7	165.6	55.9	0	0	0	0	109.8	F146 D158 S159	F146-T156 HydrophobicContact CE1-CG2 4.28Å; F146-T156 HydrophobicContact CZ-CG2 4.2Å; T156-D158 PolarHBondContact O-N 3.19Å; T156-S159 WeakPolarHBondContact O-CB 3.45Å; T156-S159 PolarHBondContact O-N 3.43Å; T156-S159 VanDerWaalsContact O-N 3.16Å; T156-S159 PolarHBondContact O-OG 3.25Å
157	F	75.6	Confident	73.8	Confident	201 Å²	201	80.8 Å²	80.8	88%	0.882	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	136.6	177.8	-173.5	-97.2	0	0	0	110.8	S159	F157-S159 PolarHBondContact O-N 3.31Å; F157-S159 VanDerWaalsContact O-N 3.12Å
158	D	79	Confident	75.2	Confident	113 Å²	113	76.2 Å²	76.2	60%	0.604	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	14.7	-179.5	-157.2	26.6	0	0	0	116.7	T156	T156-D158 PolarHBondContact O-N 3.19Å
159	S	84.5	Confident	76.5	Confident	28 Å²	28	75.6 Å²	75.6	20%	0.196	41%	0.406	C	S	.	.			trans	-68	159.8	169.4	65	0	0	0	0	112.1	P155 T156 F157 L161 S162 R163	P155-S159 VanDerWaalsContact CB-OG 3.24Å; P155-S159 WeakPolarHBondContact CB-OG 3.34Å; T156-S159 WeakPolarHBondContact O-CB 3.45Å; T156-S159 PolarHBondContact O-N 3.43Å; T156-S159 VanDerWaalsContact O-N 3.16Å; T156-S159 PolarHBondContact O-OG 3.25Å; F157-S159 PolarHBondContact O-N 3.31Å; F157-S159 VanDerWaalsContact O-N 3.12Å; S159-L161 PolarHBondContact O-N 3.1Å; S159-S162 WeakPolarHBondContact O-CB 3.24Å; S159-S162 PolarHBondContact O-N 3.23Å; S159-S162 PolarHBondContact OG-N 3.01Å; S159-R163 PolarHBondContact O-N 2.64Å
160	L	81.8	Confident	77.6	Confident	120 Å²	120	73.9 Å²	73.9	63%	0.628	40%	0.396	S	S	*	.	H	α-helix	trans	-53.4	-41.3	173.6	-68.7	173.9	0	0	0	112.1	R163 D164	L160-R163 PolarHBondContact O-N 3.34Å; L160-D164 VanDerWaalsContact O-CG 3.27Å; L160-D164 PolarHBondContact O-N 3.27Å
161	L	78.8	Confident	78.4	Confident	51 Å²	51	70 Å²	70	27%	0.267	39%	0.385	S	S	.	.	H	α-helix	trans	-65.7	-38.6	177.3	-175.4	64.1	0	0	0	111.8	P153 P155 S159 R163 D164 M165	P153-L161 HydrophobicContact CB-CD2 4.38Å; P155-L161 HydrophobicContact CB-CB 4.1Å; P155-L161 HydrophobicContact CB-CD2 4.16Å; P155-L161 HydrophobicContact CB-CG 4.21Å; P155-L161 HydrophobicContact CG-CG 4.35Å; S159-L161 PolarHBondContact O-N 3.1Å; L161-R163 VanDerWaalsContact C-N 3.29Å; L161-R163 PolarHBondContact O-N 3.2Å; L161-D164 PolarHBondContact O-N 2.98Å; L161-M165 HydrophobicContact CG-SD 4.24Å; L161-M165 WeakPolarHBondContact O-CG 3.48Å; L161-M165 PolarHBondContact O-N 2.86Å; L161-M165 VanDerWaalsContact O-N 3.15Å
162	S	81.5	Confident	79.4	Confident	34 Å²	34	71.6 Å²	71.6	24%	0.238	38%	0.381	C	S	.	.	H	α-helix	trans	-61.7	-37.4	174.2	-172.9	0	0	0	0	112.2	S159 M165	S159-S162 WeakPolarHBondContact O-CB 3.24Å; S159-S162 PolarHBondContact O-N 3.23Å; S159-S162 PolarHBondContact OG-N 3.01Å; S162-M165 PolarHBondContact O-N 3.24Å
163	R	82.6	Confident	80.4	Confident	168 Å²	168	71.2 Å²	71.2	63%	0.634	38%	0.384	S	S	*	.	H	α-helix	trans	-71.4	-40.1	177.5	-68.3	168.4	55.1	164.6	-0.6	111.8	S159 L160 L161 M165 A166	S159-R163 PolarHBondContact O-N 2.64Å; L160-R163 PolarHBondContact O-N 3.34Å; L161-R163 VanDerWaalsContact C-N 3.29Å; L161-R163 PolarHBondContact O-N 3.2Å; R163-M165 PolarHBondContact O-N 3.37Å; R163-A166 PolarHBondContact O-N 2.68Å
164	D	82.8	Confident	81.3	Confident	73 Å²	73	71.7 Å²	71.7	39%	0.39	39%	0.386	S	S	.	.	H	α-helix	trans	-65.6	-21.3	176.7	-70.7	-13.3	0	0	0	112.9	L160 L161 A166	L160-D164 VanDerWaalsContact O-CG 3.27Å; L160-D164 PolarHBondContact O-N 3.27Å; L161-D164 PolarHBondContact O-N 2.98Å; D164-A166 PolarHBondContact O-N 2.94Å
165	M	82.4	Confident	81.9	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.025	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	7.5	177	-71.9	174	65.3	0	0	113.7	P153 P155 L161 S162 R163 G167 Y168 P170 I231	P153-M165 HydrophobicContact CB-CE 4.5Å; P153-M165 HydrophobicContact CB-SD 4.23Å; P153-M165 HydrophobicContact CG-CE 3.97Å; P153-M165 HydrophobicContact CG-SD 4.16Å; P155-M165 HydrophobicContact CG-SD 3.68Å; L161-M165 HydrophobicContact CG-SD 4.24Å; L161-M165 WeakPolarHBondContact O-CG 3.48Å; L161-M165 PolarHBondContact O-N 2.86Å; L161-M165 VanDerWaalsContact O-N 3.15Å; S162-M165 PolarHBondContact O-N 3.24Å; R163-M165 PolarHBondContact O-N 3.37Å; M165-G167 PolarHBondContact O-N 3.44Å; M165-G167 VanDerWaalsContact O-N 3.14Å; M165-Y168 HydrophobicContact CE-CD1 3.54Å; M165-Y168 HydrophobicContact CE-CE1 4.34Å; M165-Y168 HydrophobicContact CE-CG 4.43Å; M165-Y168 VanDerWaalsContact O-CB 3.28Å; M165-Y168 WeakPolarHBondContact O-CB 3.26Å; M165-Y168 PolarHBondContact O-N 3.41Å; M165-P170 HydrophobicContact CE-CG 3.68Å; M165-I231 HydrophobicContact CE-CG2 3.9Å
166	A	84.1	Confident	82.5	Confident	82 Å²	82	75.1 Å²	75.1	68%	0.678	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	40.8	172.4	0	0	0	0	0	113.9	R163 D164 Y168	R163-A166 PolarHBondContact O-N 2.68Å; D164-A166 PolarHBondContact O-N 2.94Å; A166-Y168 VanDerWaalsContact C-N 3.34Å; A166-Y168 PolarHBondContact O-N 3.23Å
167	G	86.6	Confident	83.1	Confident	23 Å²	23	78.5 Å²	78.5	24%	0.237	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	9.1	179.4	0	0	0	0	0	115	M165 M169 F175 I176	M165-G167 PolarHBondContact O-N 3.44Å; M165-G167 VanDerWaalsContact O-N 3.14Å; G167-M169 PolarHBondContact O-N 3.48Å; G167-F175 CarbonylContact O-C 3.57Å; G167-F175 WeakPolarHBondContact O-CA 3.31Å; G167-I176 WeakPolarHBondContact O-CG1 3.2Å; G167-I176 PolarHBondContact O-N 3.15Å
168	Y	86.4	Confident	83.7	Confident	30 Å²	30	70.9 Å²	70.9	12%	0.118	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.1	169	-174.2	-101.8	0	0	0	111	M165 A166 P170 A173 D174 F175 I231	M165-Y168 HydrophobicContact CE-CD1 3.54Å; M165-Y168 HydrophobicContact CE-CE1 4.34Å; M165-Y168 HydrophobicContact CE-CG 4.43Å; M165-Y168 VanDerWaalsContact O-CB 3.28Å; M165-Y168 WeakPolarHBondContact O-CB 3.26Å; M165-Y168 PolarHBondContact O-N 3.41Å; A166-Y168 VanDerWaalsContact C-N 3.34Å; A166-Y168 PolarHBondContact O-N 3.23Å; Y168-P170 HydrophobicContact CD1-CG 4.23Å; Y168-P170 HydrophobicContact CE1-CB 4.36Å; Y168-P170 HydrophobicContact CE1-CG 4.36Å; Y168-P170 WeakPolarHBondContact O-CD 3.37Å; Y168-A173 WeakPolarHBondContact OH-CA 3.36Å; Y168-D174 CarbonylContact C-O 3.53Å; Y168-F175 HydrophobicContact CD2-CD1 4.23Å; Y168-F175 HydrophobicContact CD2-CD2 4.04Å; Y168-F175 AromaticContact CD2-CE1 3.89Å; Y168-F175 HydrophobicContact CD2-CE1 3.89Å; Y168-F175 AromaticContact CD2-CE2 3.68Å; Y168-F175 HydrophobicContact CD2-CE2 3.68Å; Y168-F175 HydrophobicContact CD2-CG 4.3Å; Y168-F175 AromaticContact CD2-CZ 3.58Å; Y168-F175 HydrophobicContact CD2-CZ 3.58Å; Y168-F175 HydrophobicContact CE2-CE2 4.24Å; Y168-F175 HydrophobicContact CE2-CZ 4.42Å; Y168-F175 HydrophobicContact CG-CE1 4.23Å; Y168-F175 HydrophobicContact CG-CZ 4.29Å; Y168-I231 HydrophobicContact CD1-CG2 3.46Å; Y168-I231 VanDerWaalsContact CD1-CG2 3.46Å; Y168-I231 HydrophobicContact CE1-CD1 4.09Å; Y168-I231 HydrophobicContact CE1-CG2 3.72Å; Y168-I231 HydrophobicContact CE2-CD1 4Å; Y168-I231 HydrophobicContact CG-CG2 3.87Å
169	M	83.7	Confident	84.3	Confident	72 Å²	72	69.2 Å²	69.2	36%	0.355	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	102.9	176.7	-61.2	-171.1	77.1	0	0	109.9	G167 A171 R172 A173 D174 I176	G167-M169 PolarHBondContact O-N 3.48Å; M169-A171 VanDerWaalsContact C-N 3.3Å; M169-A171 PolarHBondContact O-N 3.34Å; M169-R172 HydrophobicContact CB-CB 4.36Å; M169-R172 PolarHBondContact O-N 3.2Å; M169-A173 PolarHBondContact O-N 3.24Å; M169-D174 WeakPolarHBondContact CA-O 3.46Å; M169-D174 WeakPolarHBondContact CB-O 3.28Å; M169-D174 PolarHBondContact N-O 3.5Å; M169-D174 PolarHBondContact O-N 3.42Å; M169-I176 HydrophobicContact CG-CD1 4.29Å; M169-I176 HydrophobicContact CG-CG1 3.73Å; M169-I176 HydrophobicContact SD-CG1 3.73Å
170	P	80.7	Confident	84.7	Confident	25 Å²	25	70.3 Å²	70.3	16%	0.162	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-35.3	-174.1	-24.5	34.9	0	0	0	114	P153 R154 M165 Y168 R172 A173	P153-P170 VanDerWaalsContact O-CB 3.29Å; P153-P170 WeakPolarHBondContact O-CB 3.42Å; P153-P170 WeakPolarHBondContact O-CG 3.45Å; R154-P170 HydrophobicContact CB-CB 4.49Å; R154-P170 HydrophobicContact CG-CB 4.49Å; M165-P170 HydrophobicContact CE-CG 3.68Å; Y168-P170 HydrophobicContact CD1-CG 4.23Å; Y168-P170 HydrophobicContact CE1-CB 4.36Å; Y168-P170 HydrophobicContact CE1-CG 4.36Å; Y168-P170 WeakPolarHBondContact O-CD 3.37Å; P170-R172 VanDerWaalsContact C-N 3.31Å; P170-R172 PolarHBondContact O-N 3.27Å; P170-A173 PolarHBondContact O-N 2.96Å
171	A	76.8	Confident	85.2	Confident	69 Å²	69	67.2 Å²	67.2	57%	0.57	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-33	-179.2	0	0	0	0	0	113.1	R154 M169	R154-A171 VanDerWaalsContact NH1-CB 3.28Å; M169-A171 VanDerWaalsContact C-N 3.3Å; M169-A171 PolarHBondContact O-N 3.34Å
172	R	81.5	Confident	85.9	Confident	164 Å²	164	71.5 Å²	71.5	62%	0.619	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-10	178.1	-71.2	179.9	56.9	-166.3	-8.2	112.8	M169 P170 D174	M169-R172 HydrophobicContact CB-CB 4.36Å; M169-R172 PolarHBondContact O-N 3.2Å; P170-R172 VanDerWaalsContact C-N 3.31Å; P170-R172 PolarHBondContact O-N 3.27Å; R172-D174 HydrophobicContact CB-CB 3.99Å; R172-D174 IonicContact NH2-OD2 3.29Å; R172-D174 PolarHBondContact O-N 3.07Å
173	A	81.4	Confident	86.5	Confident	65 Å²	65	69.9 Å²	69.9	54%	0.537	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	40.9	-167.1	0	0	0	0	0	112.7	Y168 M169 P170	Y168-A173 WeakPolarHBondContact OH-CA 3.36Å; M169-A173 PolarHBondContact O-N 3.24Å; P170-A173 PolarHBondContact O-N 2.96Å
174	D	86.7	Confident	86.9	Confident	25 Å²	25	65.1 Å²	65.1	13%	0.134	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	165.3	-168.9	-153.3	-0.2	0	0	0	113.4	Y168 M169 R172 K222	Y168-D174 CarbonylContact C-O 3.53Å; M169-D174 WeakPolarHBondContact CA-O 3.46Å; M169-D174 WeakPolarHBondContact CB-O 3.28Å; M169-D174 PolarHBondContact N-O 3.5Å; M169-D174 PolarHBondContact O-N 3.42Å; R172-D174 HydrophobicContact CB-CB 3.99Å; R172-D174 IonicContact NH2-OD2 3.29Å; R172-D174 PolarHBondContact O-N 3.07Å; D174-K222 VanDerWaalsContact OD1-CE 3.26Å; D174-K222 WeakPolarHBondContact OD1-CE 3.44Å; D174-K222 IonicContact OD1-NZ 2.75Å; D174-K222 PolarHBondContact OD1-NZ 3.01Å; D174-K222 IonicContact OD2-NZ 3.14Å
175	F	88.8	Confident	87.4	Confident	36 Å²	36	69.7 Å²	69.7	16%	0.158	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	148.2	177	-65.7	-93.5	0	0	0	111.5	G167 Y168 E177 K222 I225	G167-F175 CarbonylContact O-C 3.57Å; G167-F175 WeakPolarHBondContact O-CA 3.31Å; Y168-F175 HydrophobicContact CD2-CD1 4.23Å; Y168-F175 HydrophobicContact CD2-CD2 4.04Å; Y168-F175 AromaticContact CD2-CE1 3.89Å; Y168-F175 HydrophobicContact CD2-CE1 3.89Å; Y168-F175 AromaticContact CD2-CE2 3.68Å; Y168-F175 HydrophobicContact CD2-CE2 3.68Å; Y168-F175 HydrophobicContact CD2-CG 4.3Å; Y168-F175 AromaticContact CD2-CZ 3.58Å; Y168-F175 HydrophobicContact CD2-CZ 3.58Å; Y168-F175 HydrophobicContact CE2-CE2 4.24Å; Y168-F175 HydrophobicContact CE2-CZ 4.42Å; Y168-F175 HydrophobicContact CG-CE1 4.23Å; Y168-F175 HydrophobicContact CG-CZ 4.29Å; F175-E177 WeakPolarHBondContact CB-O 3.34Å; F175-K222 HydrophobicContact CE2-CG 4.5Å; F175-I225 HydrophobicContact CE2-CD1 4.36Å; F175-I225 HydrophobicContact CZ-CD1 4.19Å; F175-I225 HydrophobicContact CZ-CG2 4.11Å
176	I	89.2	Confident	87.7	Confident	120 Å²	120	73.8 Å²	73.8	62%	0.615	38%	0.379	S	S	*	.	S	Bend	trans	-64.5	-44.4	172.5	-67.6	166.4	0	0	0	110.4	G167 M169	G167-I176 WeakPolarHBondContact O-CG1 3.2Å; G167-I176 PolarHBondContact O-N 3.15Å; M169-I176 HydrophobicContact CG-CD1 4.29Å; M169-I176 HydrophobicContact CG-CG1 3.73Å; M169-I176 HydrophobicContact SD-CG1 3.73Å
177	E	89.9	Confident	88.1	Confident	144 Å²	144	72.1 Å²	72.1	67%	0.673	36%	0.358	S	S	*	.	S	Bend	trans	-113.9	117.6	174.9	-171.1	178.6	-179.8	0	0	108.3	F175 N181	F175-E177 WeakPolarHBondContact CB-O 3.34Å; E177-N181 HydrophobicContact CG-CB 4.29Å
178	E	88.8	Confident	88.4	Confident	42 Å²	42	80.1 Å²	80.1	20%	0.196	38%	0.381	C	S	.	.			trans	-87.6	162.3	-176.9	-59.4	-169	126.2	0	0	112	D180 N181 R218 K222	E178-D180 PolarHBondContact O-N 2.94Å; E178-D180 VanDerWaalsContact O-N 3.09Å; E178-N181 PolarHBondContact N-OD1 3.34Å; E178-N181 PolarHBondContact O-N 2.79Å; E178-R218 HydrophobicContact CB-CG 4.38Å; E178-R218 WeakPolarHBondContact OE2-CD 3.44Å; E178-R218 IonicContact OE2-CZ 3.63Å; E178-R218 VanDerWaalsContact OE2-CZ 3.22Å; E178-R218 IonicContact OE2-NE 2.68Å; E178-R218 PolarHBondContact OE2-NE 3.36Å; E178-R218 IonicContact OE2-NH1 2.93Å; E178-R218 PolarHBondContact OE2-NH1 3.39Å; E178-K222 WeakPolarHBondContact OE1-CE 3.34Å; E178-K222 IonicContact OE1-NZ 2.58Å; E178-K222 PolarHBondContact OE1-NZ 3Å
179	F	90.5	Very high	88.5	Confident	78 Å²	78	85.3 Å²	85.3	34%	0.342	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	121.7	163.8	173.7	-105.9	0	0	0	108.6	E217 R218 R221	F179-E217 HydrophobicContact CD1-CG 4.25Å; F179-E217 HydrophobicContact CE1-CB 4.35Å; F179-E217 HydrophobicContact CE1-CG 3.64Å; F179-E217 HydrophobicContact CZ-CG 4.36Å; F179-R218 HydrophobicContact CB-CG 4.31Å; F179-R218 HydrophobicContact CD1-CB 4.33Å; F179-R218 PolarHBondContact O-NE 2.73Å; F179-R221 VanDerWaalsContact CZ-CZ 3.49Å
180	D	92.8	Very high	89	Confident	51 Å²	51	84 Å²	84	27%	0.273	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	54.8	179	-155.5	-0.2	0	0	0	113	E178 Y182 A183 R214 R218	E178-D180 PolarHBondContact O-N 2.94Å; E178-D180 VanDerWaalsContact O-N 3.09Å; D180-Y182 PolarHBondContact O-N 2.83Å; D180-Y182 VanDerWaalsContact O-N 3.07Å; D180-A183 WeakPolarHBondContact O-CB 3.47Å; D180-A183 PolarHBondContact O-N 3.44Å; D180-R214 IonicContact OD1-CZ 2.79Å; D180-R214 IonicContact OD1-NE 3.11Å; D180-R214 IonicContact OD1-NH2 2.63Å; D180-R214 PolarHBondContact OD1-NH2 3.31Å; D180-R214 IonicContact OD2-CZ 3.22Å; D180-R214 IonicContact OD2-NE 3.49Å; D180-R214 PolarHBondContact OD2-NE 3.13Å; D180-R214 IonicContact OD2-NH2 3.34Å; D180-R214 PolarHBondContact OD2-NH2 3.37Å; D180-R218 PolarHBondContact O-NH2 3.1Å
181	N	93.2	Very high	89.6	Confident	55 Å²	55	87.4 Å²	87.4	29%	0.294	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.2	-171.8	-165.4	78.9	0	0	0	115.3	E177 E178	E177-N181 HydrophobicContact CG-CB 4.29Å; E178-N181 PolarHBondContact N-OD1 3.34Å; E178-N181 PolarHBondContact O-N 2.79Å
182	Y	94.4	Very high	90.4	Very high	140 Å²	140	89.1 Å²	89.1	55%	0.549	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	10.6	-177.7	-56.6	-76.1	0	0	0	112.7	D180 E184 W185	D180-Y182 PolarHBondContact O-N 2.83Å; D180-Y182 VanDerWaalsContact O-N 3.07Å; Y182-E184 PolarHBondContact O-N 2.63Å; Y182-E184 VanDerWaalsContact O-N 3.11Å; Y182-W185 HydrophobicContact CD1-CD2 4.41Å; Y182-W185 AromaticContact CD1-CE2 3.86Å; Y182-W185 HydrophobicContact CD1-CZ2 4.21Å; Y182-W185 AromaticContact CD1-NE1 3.71Å; Y182-W185 HydrophobicContact CE1-CZ2 4.44Å; Y182-W185 VanDerWaalsContact O-CB 3.28Å; Y182-W185 WeakPolarHBondContact O-CB 3.25Å; Y182-W185 PolarHBondContact O-N 2.89Å
183	A	92.8	Very high	91.1	Very high	0 Å²	0	84.6 Å²	84.6	0%	0	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-57.7	-29.7	-177.2	0	0	0	0	0	113.2	D180 W185 D186 Y211 R214	D180-A183 WeakPolarHBondContact O-CB 3.47Å; D180-A183 PolarHBondContact O-N 3.44Å; A183-W185 PolarHBondContact O-N 3.25Å; A183-D186 PolarHBondContact O-N 3.32Å; A183-Y211 HydrophobicContact CB-CD2 4.07Å; A183-Y211 HydrophobicContact CB-CE2 4.11Å; A183-R214 HydrophobicContact CB-CB 4.41Å
184	E	92.1	Very high	91.5	Very high	68 Å²	68	91 Å²	91	32%	0.318	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-68.6	-21	177.7	-66.1	70.5	-159.8	0	0	112.7	Y182 D186 L187 R188 Y211 R218	Y182-E184 PolarHBondContact O-N 2.63Å; Y182-E184 VanDerWaalsContact O-N 3.11Å; E184-D186 VanDerWaalsContact C-N 3.26Å; E184-D186 PolarHBondContact O-N 2.63Å; E184-L187 PolarHBondContact O-N 2.94Å; E184-R188 PolarHBondContact O-N 3.25Å; E184-Y211 HydrophobicContact CG-CE2 3.89Å; E184-Y211 PolarHBondContact OE1-OH 3.46Å; E184-Y211 VanDerWaalsContact OE1-OH 3.14Å; E184-R218 IonicContact OE1-CZ 2.63Å; E184-R218 IonicContact OE1-NH1 3.38Å; E184-R218 PolarHBondContact OE1-NH1 3.32Å; E184-R218 IonicContact OE1-NH2 3.88Å; E184-R218 PolarHBondContact OE1-NH2 2.99Å; E184-R218 VanDerWaalsContact OE1-NH2 3.11Å; E184-R218 IonicContact OE2-NH2 3.56Å; E184-R218 PolarHBondContact OE2-NH2 3.38Å
185	W	93.2	Very high	91.8	Very high	169 Å²	169	97.4 Å²	97.4	64%	0.64	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-66	-31.5	179.1	-75.4	40.5	0	0	0	112	Y182 A183 L187 R188	Y182-W185 HydrophobicContact CD1-CD2 4.41Å; Y182-W185 AromaticContact CD1-CE2 3.86Å; Y182-W185 HydrophobicContact CD1-CZ2 4.21Å; Y182-W185 AromaticContact CD1-NE1 3.71Å; Y182-W185 HydrophobicContact CE1-CZ2 4.44Å; Y182-W185 VanDerWaalsContact O-CB 3.28Å; Y182-W185 WeakPolarHBondContact O-CB 3.25Å; Y182-W185 PolarHBondContact O-N 2.89Å; A183-W185 PolarHBondContact O-N 3.25Å; W185-L187 PolarHBondContact O-N 3.32Å; W185-R188 WeakPolarHBondContact O-CB 3.19Å; W185-R188 PolarHBondContact O-N 3.14Å; W185-R188 VanDerWaalsContact O-N 3.12Å
186	D	88.5	Confident	92.1	Very high	92 Å²	92	97.1 Å²	97.1	49%	0.492	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-69	-18.6	178.7	-63.4	-17.2	0	0	0	112.2	A183 E184 I190 R214	A183-D186 PolarHBondContact O-N 3.32Å; E184-D186 VanDerWaalsContact C-N 3.26Å; E184-D186 PolarHBondContact O-N 2.63Å; D186-I190 WeakPolarHBondContact O-CD1 3.44Å; D186-R214 IonicContact OD2-CZ 3.67Å; D186-R214 IonicContact OD2-NH1 2.63Å; D186-R214 PolarHBondContact OD2-NH1 3.45Å
187	L	92.3	Very high	92.5	Very high	46 Å²	46	94.8 Å²	94.8	24%	0.241	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-93.1	-10.4	175.6	-61.4	-174.4	0	0	0	113.4	E184 W185 D189 I190 V207 V208 Y211	E184-L187 PolarHBondContact O-N 2.94Å; W185-L187 PolarHBondContact O-N 3.32Å; L187-D189 PolarHBondContact O-N 3.28Å; L187-I190 HydrophobicContact CD2-CD1 3.76Å; L187-I190 PolarHBondContact O-N 3.22Å; L187-I190 VanDerWaalsContact O-N 3.13Å; L187-V207 HydrophobicContact CD2-CG1 4.2Å; L187-V208 HydrophobicContact CD2-CG2 4.28Å; L187-Y211 HydrophobicContact CD1-CD1 3.4Å; L187-Y211 HydrophobicContact CD1-CD2 3.84Å; L187-Y211 HydrophobicContact CD1-CE1 3.64Å; L187-Y211 HydrophobicContact CD1-CE2 4.11Å; L187-Y211 HydrophobicContact CD1-CG 3.48Å; L187-Y211 VanDerWaalsContact CD1-CG 3.48Å; L187-Y211 HydrophobicContact CD2-CG 4.35Å; L187-Y211 HydrophobicContact CG-CD1 4.39Å; L187-Y211 HydrophobicContact CG-CD2 4.22Å; L187-Y211 HydrophobicContact CG-CG 4.01Å
188	R	92.5	Very high	92.8	Very high	191 Å²	191	94.8 Å²	94.8	72%	0.721	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-42.2	-169.9	-178.8	-174.4	175.6	178.4	-1.3	112.7	E184 W185	E184-R188 PolarHBondContact O-N 3.25Å; W185-R188 WeakPolarHBondContact O-CB 3.19Å; W185-R188 PolarHBondContact O-N 3.14Å; W185-R188 VanDerWaalsContact O-N 3.12Å
189	D	89.8	Confident	93.2	Very high	139 Å²	139	99.6 Å²	99.6	74%	0.743	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	17.7	-173.5	-56.2	-38.9	0	0	0	111.9	L187	L187-D189 PolarHBondContact O-N 3.28Å
190	I	92.8	Very high	93.4	Very high	46 Å²	46	99.2 Å²	99.2	24%	0.236	49%	0.486	C	S	.	.			trans	-96.5	116.6	176.1	-56.2	-175.8	0	0	0	109.6	D186 L187 F192 K204 V207	D186-I190 WeakPolarHBondContact O-CD1 3.44Å; L187-I190 HydrophobicContact CD2-CD1 3.76Å; L187-I190 PolarHBondContact O-N 3.22Å; L187-I190 VanDerWaalsContact O-N 3.13Å; I190-F192 HydrophobicContact CG2-CE2 4.24Å; I190-K204 HydrophobicContact CG2-CB 4.21Å; I190-K204 HydrophobicContact CG2-CG 4.2Å; I190-V207 HydrophobicContact CD1-CB 3.66Å; I190-V207 HydrophobicContact CD1-CG1 3.38Å; I190-V207 HydrophobicContact CD1-CG2 4.34Å
191	D	94.1	Very high	93.5	Very high	96 Å²	96	100.8 Å²	100.8	51%	0.513	49%	0.492	S	S	.	.			trans	-118.8	159.9	169.6	61.4	-9.8	0	0	0	110.3	K204	D191-K204 VanDerWaalsContact O-CD 3.23Å; D191-K204 WeakPolarHBondContact O-CD 3.26Å; D191-K204 WeakPolarHBondContact O-CE 3.43Å; D191-K204 PolarHBondContact O-NZ 3.22Å; D191-K204 IonicContact OD1-NZ 2.84Å; D191-K204 PolarHBondContact OD1-NZ 3.05Å
192	F	93.6	Very high	93.7	Very high	104 Å²	104	101 Å²	101	46%	0.456	50%	0.501	S	S	.	.			trans	-116.1	124.1	173.6	-70.5	-88.1	0	0	0	108.5	I190 H201 K204 M205 V208	I190-F192 HydrophobicContact CG2-CE2 4.24Å; F192-H201 AromaticContact CD1-CE1 3.87Å; F192-H201 AromaticContact CD1-ND1 3.86Å; F192-K204 HydrophobicContact CD1-CB 4.47Å; F192-K204 HydrophobicContact CD1-CD 4.38Å; F192-K204 HydrophobicContact CE1-CB 3.76Å; F192-K204 HydrophobicContact CE1-CD 4.48Å; F192-K204 HydrophobicContact CZ-CB 4.09Å; F192-M205 HydrophobicContact CE1-CG 4.31Å; F192-M205 HydrophobicContact CE1-SD 3.82Å; F192-M205 HydrophobicContact CZ-SD 3.87Å; F192-V208 HydrophobicContact CZ-CG2 4.21Å
193	V	94.9	Very high	93.8	Very high	70 Å²	70	99.6 Å²	99.6	42%	0.424	50%	0.502	S	S	.	.			trans	-121.9	143.4	-178.4	-173.3	0	0	0	0	108.9	D195 D196	V193-D195 PolarHBondContact O-N 3.36Å; V193-D196 PolarHBondContact N-OD2 3.07Å; V193-D196 VanDerWaalsContact N-OD2 3.1Å; V193-D196 VanDerWaalsContact O-CB 3.31Å; V193-D196 WeakPolarHBondContact O-CB 3.36Å; V193-D196 VanDerWaalsContact O-CG 3.29Å; V193-D196 PolarHBondContact O-N 2.87Å; V193-D196 VanDerWaalsContact O-N 3.1Å
194	E	89.9	Confident	94	Very high	200 Å²	200	100.7 Å²	100.7	94%	0.935	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.4	-176.9	-64.6	-174.7	174.2	0	0	113.3	D196	E194-D196 VanDerWaalsContact C-N 3.32Å
195	D	94.5	Very high	94.1	Very high	158 Å²	158	101 Å²	101	85%	0.845	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	5.1	178.6	-64.3	-33.3	0	0	0	113.7	V193 S197	V193-D195 PolarHBondContact O-N 3.36Å; D195-S197 PolarHBondContact O-N 3.34Å
196	D	95.1	Very high	94.3	Very high	30 Å²	30	95 Å²	95	16%	0.16	50%	0.495	C	S	.	.			trans	-60.4	128.5	176.8	-78.4	-28	0	0	0	110.4	V193 E194 L200 K204	V193-D196 PolarHBondContact N-OD2 3.07Å; V193-D196 VanDerWaalsContact N-OD2 3.1Å; V193-D196 VanDerWaalsContact O-CB 3.31Å; V193-D196 WeakPolarHBondContact O-CB 3.36Å; V193-D196 VanDerWaalsContact O-CG 3.29Å; V193-D196 PolarHBondContact O-N 2.87Å; V193-D196 VanDerWaalsContact O-N 3.1Å; E194-D196 VanDerWaalsContact C-N 3.32Å; D196-L200 HydrophobicContact CB-CD2 4.42Å; D196-L200 WeakPolarHBondContact OD1-CD2 3.28Å; D196-K204 VanDerWaalsContact CG-NZ 3.29Å; D196-K204 IonicContact OD1-NZ 2.9Å; D196-K204 PolarHBondContact OD1-NZ 3.48Å; D196-K204 VanDerWaalsContact OD1-NZ 3.09Å; D196-K204 IonicContact OD2-NZ 3.09Å; D196-K204 PolarHBondContact OD2-NZ 3.06Å
197	S	96.6	Very high	94.7	Very high	72 Å²	72	92.6 Å²	92.6	50%	0.503	48%	0.484	S	S	.	.			trans	-58.8	146.9	170.3	67.8	0	0	0	0	110.7	D195 I199 L200 H201	D195-S197 PolarHBondContact O-N 3.34Å; S197-I199 PolarHBondContact O-N 3.03Å; S197-L200 WeakPolarHBondContact O-CA 3.09Å; S197-L200 WeakPolarHBondContact O-CB 3.42Å; S197-L200 PolarHBondContact O-N 3.34Å; S197-L200 WeakPolarHBondContact OG-CB 3.26Å; S197-L200 PolarHBondContact OG-N 3.05Å; S197-H201 PolarHBondContact O-N 3.42Å
198	D	96.4	Very high	94.8	Very high	144 Å²	144	92.7 Å²	92.7	77%	0.77	49%	0.487	S	S	*	.	H	α-helix	trans	-50.3	-37	179.7	-63.7	-28.7	0	0	0	113.2	A202	D198-A202 VanDerWaalsContact O-CB 3.31Å; D198-A202 WeakPolarHBondContact O-CB 3.48Å; D198-A202 PolarHBondContact O-N 3.06Å
199	I	96.6	Very high	95	Very high	143 Å²	143	88.3 Å²	88.3	73%	0.733	48%	0.478	S	S	*	.	H	α-helix	trans	-67.8	-43.3	178.3	-61.4	171.1	0	0	0	111.1	S197 A202 L203	S197-I199 PolarHBondContact O-N 3.03Å; I199-A202 PolarHBondContact O-N 3.14Å; I199-L203 WeakPolarHBondContact O-CB 3.14Å; I199-L203 PolarHBondContact O-N 2.89Å
200	L	95.4	Very high	95.3	Very high	69 Å²	69	86.6 Å²	86.6	36%	0.361	47%	0.467	S	S	.	.	H	α-helix	trans	-66.6	-42.7	177.3	-179.8	59.3	0	0	0	110.8	D196 S197 A202 L203 K204	D196-L200 HydrophobicContact CB-CD2 4.42Å; D196-L200 WeakPolarHBondContact OD1-CD2 3.28Å; S197-L200 WeakPolarHBondContact O-CA 3.09Å; S197-L200 WeakPolarHBondContact O-CB 3.42Å; S197-L200 PolarHBondContact O-N 3.34Å; S197-L200 WeakPolarHBondContact OG-CB 3.26Å; S197-L200 PolarHBondContact OG-N 3.05Å; L200-A202 PolarHBondContact O-N 3.11Å; L200-L203 PolarHBondContact O-N 3.47Å; L200-K204 HydrophobicContact CD1-CG 4.46Å; L200-K204 HydrophobicContact CG-CD 4.3Å; L200-K204 WeakPolarHBondContact O-CG 3.44Å; L200-K204 PolarHBondContact O-N 2.9Å
201	H	95.9	Very high	95.4	Very high	85 Å²	85	86.6 Å²	86.6	39%	0.394	47%	0.465	S	S	.	.	H	α-helix	trans	-59.1	-47.2	174.4	-172.9	86.4	0	0	0	111.3	F192 S197 L203 K204 M205	F192-H201 AromaticContact CD1-CE1 3.87Å; F192-H201 AromaticContact CD1-ND1 3.86Å; S197-H201 PolarHBondContact O-N 3.42Å; H201-L203 VanDerWaalsContact C-N 3.32Å; H201-L203 PolarHBondContact O-N 2.94Å; H201-K204 PolarHBondContact O-N 3.16Å; H201-M205 WeakPolarHBondContact O-CG 3.44Å; H201-M205 PolarHBondContact O-N 3.3Å
202	A	96.6	Very high	95.5	Very high	58 Å²	58	86.2 Å²	86.2	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-61.2	-38.1	176.4	0	0	0	0	0	112.7	D198 I199 L200 M205 A206	D198-A202 VanDerWaalsContact O-CB 3.31Å; D198-A202 WeakPolarHBondContact O-CB 3.48Å; D198-A202 PolarHBondContact O-N 3.06Å; I199-A202 PolarHBondContact O-N 3.14Å; L200-A202 PolarHBondContact O-N 3.11Å; A202-M205 PolarHBondContact O-N 3.41Å; A202-A206 WeakPolarHBondContact O-CB 3.36Å; A202-A206 PolarHBondContact O-N 3.31Å
203	L	96	Very high	95.6	Very high	111 Å²	111	84.9 Å²	84.9	58%	0.581	46%	0.463	S	S	*	.	H	α-helix	trans	-65.8	-45.7	175.5	-176.2	65.3	0	0	0	111.6	I199 L200 H201 M205 A206 V207	I199-L203 WeakPolarHBondContact O-CB 3.14Å; I199-L203 PolarHBondContact O-N 2.89Å; L200-L203 PolarHBondContact O-N 3.47Å; H201-L203 VanDerWaalsContact C-N 3.32Å; H201-L203 PolarHBondContact O-N 2.94Å; L203-M205 VanDerWaalsContact C-N 3.33Å; L203-M205 PolarHBondContact O-N 3.11Å; L203-A206 WeakPolarHBondContact O-CB 3.47Å; L203-A206 PolarHBondContact O-N 3.48Å; L203-V207 WeakPolarHBondContact O-CG2 3.47Å; L203-V207 PolarHBondContact O-N 2.95Å; L203-V207 VanDerWaalsContact O-N 3.11Å
204	K	96.3	Very high	95.7	Very high	24 Å²	24	84.1 Å²	84.1	10%	0.104	45%	0.453	C	S	.	.	H	α-helix	trans	-58.9	-45	175.8	-71.2	174.2	173.1	-173.2	0	111	I190 D191 F192 D196 L200 H201 A206 V207 V208	I190-K204 HydrophobicContact CG2-CB 4.21Å; I190-K204 HydrophobicContact CG2-CG 4.2Å; D191-K204 VanDerWaalsContact O-CD 3.23Å; D191-K204 WeakPolarHBondContact O-CD 3.26Å; D191-K204 WeakPolarHBondContact O-CE 3.43Å; D191-K204 PolarHBondContact O-NZ 3.22Å; D191-K204 IonicContact OD1-NZ 2.84Å; D191-K204 PolarHBondContact OD1-NZ 3.05Å; F192-K204 HydrophobicContact CD1-CB 4.47Å; F192-K204 HydrophobicContact CD1-CD 4.38Å; F192-K204 HydrophobicContact CE1-CB 3.76Å; F192-K204 HydrophobicContact CE1-CD 4.48Å; F192-K204 HydrophobicContact CZ-CB 4.09Å; D196-K204 VanDerWaalsContact CG-NZ 3.29Å; D196-K204 IonicContact OD1-NZ 2.9Å; D196-K204 PolarHBondContact OD1-NZ 3.48Å; D196-K204 VanDerWaalsContact OD1-NZ 3.09Å; D196-K204 IonicContact OD2-NZ 3.09Å; D196-K204 PolarHBondContact OD2-NZ 3.06Å; L200-K204 HydrophobicContact CD1-CG 4.46Å; L200-K204 HydrophobicContact CG-CD 4.3Å; L200-K204 WeakPolarHBondContact O-CG 3.44Å; L200-K204 PolarHBondContact O-N 2.9Å; H201-K204 PolarHBondContact O-N 3.16Å; K204-A206 PolarHBondContact O-N 3.37Å; K204-V207 PolarHBondContact O-N 3.4Å; K204-V208 PolarHBondContact O-N 2.97Å; K204-V208 VanDerWaalsContact O-N 3.15Å
205	M	95.9	Very high	95.9	Very high	74 Å²	74	77.1 Å²	77.1	37%	0.365	42%	0.421	S	S	.	.	H	α-helix	trans	-60.5	-42.1	174.6	-71.9	-56	-58.9	0	0	112.6	F192 H201 A202 L203 V207 V208 D209	F192-M205 HydrophobicContact CE1-CG 4.31Å; F192-M205 HydrophobicContact CE1-SD 3.82Å; F192-M205 HydrophobicContact CZ-SD 3.87Å; H201-M205 WeakPolarHBondContact O-CG 3.44Å; H201-M205 PolarHBondContact O-N 3.3Å; A202-M205 PolarHBondContact O-N 3.41Å; L203-M205 VanDerWaalsContact C-N 3.33Å; L203-M205 PolarHBondContact O-N 3.11Å; M205-V207 VanDerWaalsContact C-N 3.29Å; M205-V207 PolarHBondContact O-N 3.43Å; M205-V208 WeakPolarHBondContact O-CB 3.44Å; M205-V208 PolarHBondContact O-N 3Å; M205-V208 VanDerWaalsContact O-N 3.15Å; M205-D209 PolarHBondContact O-N 3.32Å
206	A	96.5	Very high	95.9	Very high	42 Å²	42	75.8 Å²	75.8	35%	0.347	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-35.9	176.5	0	0	0	0	0	112.5	A202 L203 K204 D209 I210	A202-A206 WeakPolarHBondContact O-CB 3.36Å; A202-A206 PolarHBondContact O-N 3.31Å; L203-A206 WeakPolarHBondContact O-CB 3.47Å; L203-A206 PolarHBondContact O-N 3.48Å; K204-A206 PolarHBondContact O-N 3.37Å; A206-D209 PolarHBondContact O-N 3.36Å; A206-I210 VanDerWaalsContact O-CG1 3.26Å; A206-I210 WeakPolarHBondContact O-CG1 3.49Å; A206-I210 PolarHBondContact O-N 3.44Å
207	V	96.1	Very high	95.9	Very high	43 Å²	43	76.7 Å²	76.7	26%	0.261	41%	0.411	S	S	.	.	H	α-helix	trans	-67.2	-41.2	174.9	-176.6	0	0	0	0	111.3	L187 I190 L203 K204 M205 D209 I210 Y211	L187-V207 HydrophobicContact CD2-CG1 4.2Å; I190-V207 HydrophobicContact CD1-CB 3.66Å; I190-V207 HydrophobicContact CD1-CG1 3.38Å; I190-V207 HydrophobicContact CD1-CG2 4.34Å; L203-V207 WeakPolarHBondContact O-CG2 3.47Å; L203-V207 PolarHBondContact O-N 2.95Å; L203-V207 VanDerWaalsContact O-N 3.11Å; K204-V207 PolarHBondContact O-N 3.4Å; M205-V207 VanDerWaalsContact C-N 3.29Å; M205-V207 PolarHBondContact O-N 3.43Å; V207-D209 VanDerWaalsContact C-N 3.31Å; V207-D209 PolarHBondContact O-N 3.22Å; V207-I210 WeakPolarHBondContact O-CB 3.39Å; V207-I210 PolarHBondContact O-N 3.29Å; V207-Y211 PolarHBondContact O-N 3.4Å
208	V	95.6	Very high	95.8	Very high	47 Å²	47	74 Å²	74	29%	0.285	39%	0.39	S	S	.	.	H	α-helix	trans	-61.2	-41.1	174	176	0	0	0	0	111.2	L187 F192 K204 M205 I210 Y211 H212	L187-V208 HydrophobicContact CD2-CG2 4.28Å; F192-V208 HydrophobicContact CZ-CG2 4.21Å; K204-V208 PolarHBondContact O-N 2.97Å; K204-V208 VanDerWaalsContact O-N 3.15Å; M205-V208 WeakPolarHBondContact O-CB 3.44Å; M205-V208 PolarHBondContact O-N 3Å; M205-V208 VanDerWaalsContact O-N 3.15Å; V208-I210 PolarHBondContact O-N 3.28Å; V208-Y211 WeakPolarHBondContact O-CB 3.15Å; V208-Y211 PolarHBondContact O-N 2.87Å; V208-H212 WeakPolarHBondContact O-CB 3.28Å; V208-H212 PolarHBondContact O-N 2.93Å
209	D	96.4	Very high	95.6	Very high	100 Å²	100	72.8 Å²	72.8	54%	0.535	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-40.7	176.2	-75.8	-25.8	0	0	0	112.1	M205 A206 V207 H212 S213	M205-D209 PolarHBondContact O-N 3.32Å; A206-D209 PolarHBondContact O-N 3.36Å; V207-D209 VanDerWaalsContact C-N 3.31Å; V207-D209 PolarHBondContact O-N 3.22Å; D209-H212 PolarHBondContact O-N 2.96Å; D209-S213 PolarHBondContact O-N 3.11Å
210	I	95.5	Very high	95.5	Very high	102 Å²	102	70.7 Å²	70.7	52%	0.523	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-47.1	173.9	-69.4	163.6	0	0	0	110.2	A206 V207 V208 H212 S213 R214	A206-I210 VanDerWaalsContact O-CG1 3.26Å; A206-I210 WeakPolarHBondContact O-CG1 3.49Å; A206-I210 PolarHBondContact O-N 3.44Å; V207-I210 WeakPolarHBondContact O-CB 3.39Å; V207-I210 PolarHBondContact O-N 3.29Å; V208-I210 PolarHBondContact O-N 3.28Å; I210-H212 VanDerWaalsContact C-N 3.34Å; I210-H212 PolarHBondContact O-N 3.39Å; I210-S213 WeakPolarHBondContact O-CB 3.22Å; I210-S213 PolarHBondContact O-N 2.84Å; I210-R214 WeakPolarHBondContact O-CG 3.21Å; I210-R214 PolarHBondContact O-N 3.18Å
211	Y	95.8	Very high	95.3	Very high	46 Å²	46	71.4 Å²	71.4	18%	0.18	36%	0.36	C	S	.	.	H	α-helix	trans	-58.2	-46.4	175.7	171.6	-106.2	0	0	0	111.7	A183 E184 L187 V207 V208 S213 R214 L215	A183-Y211 HydrophobicContact CB-CD2 4.07Å; A183-Y211 HydrophobicContact CB-CE2 4.11Å; E184-Y211 HydrophobicContact CG-CE2 3.89Å; E184-Y211 PolarHBondContact OE1-OH 3.46Å; E184-Y211 VanDerWaalsContact OE1-OH 3.14Å; L187-Y211 HydrophobicContact CD1-CD1 3.4Å; L187-Y211 HydrophobicContact CD1-CD2 3.84Å; L187-Y211 HydrophobicContact CD1-CE1 3.64Å; L187-Y211 HydrophobicContact CD1-CE2 4.11Å; L187-Y211 HydrophobicContact CD1-CG 3.48Å; L187-Y211 VanDerWaalsContact CD1-CG 3.48Å; L187-Y211 HydrophobicContact CD2-CG 4.35Å; L187-Y211 HydrophobicContact CG-CD1 4.39Å; L187-Y211 HydrophobicContact CG-CD2 4.22Å; L187-Y211 HydrophobicContact CG-CG 4.01Å; V207-Y211 PolarHBondContact O-N 3.4Å; V208-Y211 WeakPolarHBondContact O-CB 3.15Å; V208-Y211 PolarHBondContact O-N 2.87Å; Y211-S213 VanDerWaalsContact C-N 3.29Å; Y211-S213 PolarHBondContact O-N 2.9Å; Y211-R214 WeakPolarHBondContact O-CB 3.34Å; Y211-R214 PolarHBondContact O-N 3.07Å; Y211-L215 HydrophobicContact CD1-CD1 4.1Å; Y211-L215 HydrophobicContact CD1-CG 4.37Å; Y211-L215 HydrophobicContact CE1-CD1 3.37Å; Y211-L215 HydrophobicContact CE1-CG 3.88Å; Y211-L215 HydrophobicContact CE2-CD1 4.4Å; Y211-L215 HydrophobicContact CE2-CD2 4.11Å; Y211-L215 HydrophobicContact CE2-CG 4.07Å; Y211-L215 PolarHBondContact O-N 2.85Å
212	H	95.4	Very high	94.9	Very high	88 Å²	88	69.4 Å²	69.4	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-37.5	178.5	-175.1	71.8	0	0	0	112.5	V208 D209 I210 L215 K216	V208-H212 WeakPolarHBondContact O-CB 3.28Å; V208-H212 PolarHBondContact O-N 2.93Å; D209-H212 PolarHBondContact O-N 2.96Å; I210-H212 VanDerWaalsContact C-N 3.34Å; I210-H212 PolarHBondContact O-N 3.39Å; H212-L215 PolarHBondContact O-N 2.94Å; H212-K216 PolarHBondContact CD2-NZ 3.09Å; H212-K216 WeakPolarHBondContact NE2-CE 3.45Å; H212-K216 PolarHBondContact NE2-NZ 3.33Å; H212-K216 PolarHBondContact O-N 3.39Å
213	S	96.6	Very high	94.6	Very high	76 Å²	76	72 Å²	72	53%	0.531	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-41.6	172.7	-173.3	0	0	0	0	112.2	D209 I210 Y211 K216 E217	D209-S213 PolarHBondContact O-N 3.11Å; I210-S213 WeakPolarHBondContact O-CB 3.22Å; I210-S213 PolarHBondContact O-N 2.84Å; Y211-S213 VanDerWaalsContact C-N 3.29Å; Y211-S213 PolarHBondContact O-N 2.9Å; S213-K216 WeakPolarHBondContact O-CB 3.46Å; S213-K216 PolarHBondContact O-N 3.38Å; S213-E217 PolarHBondContact O-N 2.55Å
214	R	95.9	Very high	94.2	Very high	55 Å²	55	68.1 Å²	68.1	21%	0.208	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-41.8	176.6	-65.8	166.6	77.9	176.6	8.6	111.7	D180 A183 D186 I210 Y211 K216 E217 R218	D180-R214 IonicContact OD1-CZ 2.79Å; D180-R214 IonicContact OD1-NE 3.11Å; D180-R214 IonicContact OD1-NH2 2.63Å; D180-R214 PolarHBondContact OD1-NH2 3.31Å; D180-R214 IonicContact OD2-CZ 3.22Å; D180-R214 IonicContact OD2-NE 3.49Å; D180-R214 PolarHBondContact OD2-NE 3.13Å; D180-R214 IonicContact OD2-NH2 3.34Å; D180-R214 PolarHBondContact OD2-NH2 3.37Å; A183-R214 HydrophobicContact CB-CB 4.41Å; D186-R214 IonicContact OD2-CZ 3.67Å; D186-R214 IonicContact OD2-NH1 2.63Å; D186-R214 PolarHBondContact OD2-NH1 3.45Å; I210-R214 WeakPolarHBondContact O-CG 3.21Å; I210-R214 PolarHBondContact O-N 3.18Å; Y211-R214 WeakPolarHBondContact O-CB 3.34Å; Y211-R214 PolarHBondContact O-N 3.07Å; R214-K216 PolarHBondContact O-N 2.97Å; R214-E217 PolarHBondContact O-N 3.23Å; R214-R218 WeakPolarHBondContact O-CB 3.3Å; R214-R218 PolarHBondContact O-N 3.06Å
215	L	94.5	Very high	93.7	Very high	52 Å²	52	69.4 Å²	69.4	27%	0.272	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-42	173.6	-72.2	-172.3	0	0	0	112.5	Y211 H212 E217 R218 Q219	Y211-L215 HydrophobicContact CD1-CD1 4.1Å; Y211-L215 HydrophobicContact CD1-CG 4.37Å; Y211-L215 HydrophobicContact CE1-CD1 3.37Å; Y211-L215 HydrophobicContact CE1-CG 3.88Å; Y211-L215 HydrophobicContact CE2-CD1 4.4Å; Y211-L215 HydrophobicContact CE2-CD2 4.11Å; Y211-L215 HydrophobicContact CE2-CG 4.07Å; Y211-L215 PolarHBondContact O-N 2.85Å; H212-L215 PolarHBondContact O-N 2.94Å; L215-E217 VanDerWaalsContact C-N 3.35Å; L215-E217 PolarHBondContact O-N 3.33Å; L215-R218 VanDerWaalsContact CD2-NH1 3.32Å; L215-R218 WeakPolarHBondContact O-CB 3.35Å; L215-R218 PolarHBondContact O-N 3.37Å; L215-Q219 WeakPolarHBondContact O-CB 2.99Å; L215-Q219 PolarHBondContact O-N 3.24Å
216	K	95.8	Very high	93.1	Very high	131 Å²	131	72.9 Å²	72.9	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-59.9	-44.3	174.7	-82.6	171.5	162.9	158.5	0	111.7	H212 S213 R214 Q219 R220	H212-K216 PolarHBondContact CD2-NZ 3.09Å; H212-K216 WeakPolarHBondContact NE2-CE 3.45Å; H212-K216 PolarHBondContact NE2-NZ 3.33Å; H212-K216 PolarHBondContact O-N 3.39Å; S213-K216 WeakPolarHBondContact O-CB 3.46Å; S213-K216 PolarHBondContact O-N 3.38Å; R214-K216 PolarHBondContact O-N 2.97Å; K216-Q219 PolarHBondContact O-N 3.1Å; K216-R220 WeakPolarHBondContact O-CB 3.34Å; K216-R220 PolarHBondContact O-N 3.31Å
217	E	94.9	Very high	92.6	Very high	49 Å²	49	73.2 Å²	73.2	23%	0.229	34%	0.343	C	S	.	.	H	α-helix	trans	-66.1	-41	176.9	178.6	59.4	-168	0	0	111.9	F179 S213 R214 L215 Q219 R220 R221	F179-E217 HydrophobicContact CD1-CG 4.25Å; F179-E217 HydrophobicContact CE1-CB 4.35Å; F179-E217 HydrophobicContact CE1-CG 3.64Å; F179-E217 HydrophobicContact CZ-CG 4.36Å; S213-E217 PolarHBondContact O-N 2.55Å; R214-E217 PolarHBondContact O-N 3.23Å; L215-E217 VanDerWaalsContact C-N 3.35Å; L215-E217 PolarHBondContact O-N 3.33Å; E217-Q219 PolarHBondContact O-N 2.89Å; E217-R220 PolarHBondContact O-N 2.7Å; E217-R220 IonicContact OE1-CZ 3.47Å; E217-R220 IonicContact OE1-NE 3.57Å; E217-R220 IonicContact OE1-NH2 2.74Å; E217-R220 PolarHBondContact OE1-NH2 3.47Å; E217-R220 IonicContact OE2-CZ 3.82Å; E217-R220 IonicContact OE2-NE 3.72Å; E217-R220 PolarHBondContact OE2-NE 3.35Å; E217-R220 IonicContact OE2-NH2 2.86Å; E217-R220 PolarHBondContact OE2-NH2 2.84Å; E217-R221 WeakPolarHBondContact O-CG 3.43Å; E217-R221 PolarHBondContact O-N 3.45Å; E217-R221 IonicContact OE1-CZ 3.33Å; E217-R221 IonicContact OE1-NE 2.84Å; E217-R221 PolarHBondContact OE1-NE 2.94Å; E217-R221 IonicContact OE1-NH2 2.89Å; E217-R221 PolarHBondContact OE1-NH2 3.24Å
218	R	93.7	Very high	91.9	Very high	15 Å²	15	72.4 Å²	72.4	6%	0.057	34%	0.337	C	S	.	.	H	α-helix	trans	-56.8	-49.4	173.7	-171.9	-171.2	-68.2	163.5	6.3	110.7	E178 F179 D180 E184 R214 L215 R221 K222	E178-R218 HydrophobicContact CB-CG 4.38Å; E178-R218 WeakPolarHBondContact OE2-CD 3.44Å; E178-R218 IonicContact OE2-CZ 3.63Å; E178-R218 VanDerWaalsContact OE2-CZ 3.22Å; E178-R218 IonicContact OE2-NE 2.68Å; E178-R218 PolarHBondContact OE2-NE 3.36Å; E178-R218 IonicContact OE2-NH1 2.93Å; E178-R218 PolarHBondContact OE2-NH1 3.39Å; F179-R218 HydrophobicContact CB-CG 4.31Å; F179-R218 HydrophobicContact CD1-CB 4.33Å; F179-R218 PolarHBondContact O-NE 2.73Å; D180-R218 PolarHBondContact O-NH2 3.1Å; E184-R218 IonicContact OE1-CZ 2.63Å; E184-R218 IonicContact OE1-NH1 3.38Å; E184-R218 PolarHBondContact OE1-NH1 3.32Å; E184-R218 IonicContact OE1-NH2 3.88Å; E184-R218 PolarHBondContact OE1-NH2 2.99Å; E184-R218 VanDerWaalsContact OE1-NH2 3.11Å; E184-R218 IonicContact OE2-NH2 3.56Å; E184-R218 PolarHBondContact OE2-NH2 3.38Å; R214-R218 WeakPolarHBondContact O-CB 3.3Å; R214-R218 PolarHBondContact O-N 3.06Å; L215-R218 VanDerWaalsContact CD2-NH1 3.32Å; L215-R218 WeakPolarHBondContact O-CB 3.35Å; L215-R218 PolarHBondContact O-N 3.37Å; R218-R221 PolarHBondContact O-N 2.9Å; R218-K222 PolarHBondContact O-N 3.05Å; R218-K222 VanDerWaalsContact O-N 3.11Å
219	Q	92.4	Very high	91.2	Very high	118 Å²	118	71.8 Å²	71.8	55%	0.551	34%	0.34	S	S	*	.	H	α-helix	trans	-65.5	-39.7	178	-173.6	63.3	0.2	0	0	112.5	L215 K216 E217 R221 K222 K223	L215-Q219 WeakPolarHBondContact O-CB 2.99Å; L215-Q219 PolarHBondContact O-N 3.24Å; K216-Q219 PolarHBondContact O-N 3.1Å; E217-Q219 PolarHBondContact O-N 2.89Å; Q219-R221 VanDerWaalsContact C-N 3.32Å; Q219-R221 PolarHBondContact O-N 3.48Å; Q219-K222 PolarHBondContact O-N 3.35Å; Q219-K223 WeakPolarHBondContact O-CB 3.29Å; Q219-K223 PolarHBondContact O-N 3.13Å
220	R	93.2	Very high	90.5	Very high	100 Å²	100	69.2 Å²	69.2	38%	0.377	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-43.7	175.7	-169.7	-174.4	74.9	98.1	0.4	111.3	K216 E217 K223 I224 R259	K216-R220 WeakPolarHBondContact O-CB 3.34Å; K216-R220 PolarHBondContact O-N 3.31Å; E217-R220 PolarHBondContact O-N 2.7Å; E217-R220 IonicContact OE1-CZ 3.47Å; E217-R220 IonicContact OE1-NE 3.57Å; E217-R220 IonicContact OE1-NH2 2.74Å; E217-R220 PolarHBondContact OE1-NH2 3.47Å; E217-R220 IonicContact OE2-CZ 3.82Å; E217-R220 IonicContact OE2-NE 3.72Å; E217-R220 PolarHBondContact OE2-NE 3.35Å; E217-R220 IonicContact OE2-NH2 2.86Å; E217-R220 PolarHBondContact OE2-NH2 2.84Å; R220-K223 WeakPolarHBondContact O-CB 3.03Å; R220-K223 PolarHBondContact O-N 3.19Å; R220-I224 HydrophobicContact CG-CD1 4.19Å; R220-I224 WeakPolarHBondContact O-CG1 3.32Å; R220-I224 PolarHBondContact O-N 2.86Å; R220-R259 PolarHBondContact NH1-O 3.06Å
221	R	91.3	Very high	89.8	Confident	83 Å²	83	65.9 Å²	65.9	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-45.1	177.9	-71.8	178.7	-178.9	-145.1	8.5	112.4	F179 E217 R218 Q219 K223 I224 I225	F179-R221 VanDerWaalsContact CZ-CZ 3.49Å; E217-R221 WeakPolarHBondContact O-CG 3.43Å; E217-R221 PolarHBondContact O-N 3.45Å; E217-R221 IonicContact OE1-CZ 3.33Å; E217-R221 IonicContact OE1-NE 2.84Å; E217-R221 PolarHBondContact OE1-NE 2.94Å; E217-R221 IonicContact OE1-NH2 2.89Å; E217-R221 PolarHBondContact OE1-NH2 3.24Å; R218-R221 PolarHBondContact O-N 2.9Å; Q219-R221 VanDerWaalsContact C-N 3.32Å; Q219-R221 PolarHBondContact O-N 3.48Å; R221-K223 VanDerWaalsContact C-N 3.28Å; R221-K223 PolarHBondContact O-N 3.12Å; R221-I224 PolarHBondContact O-N 3.18Å; R221-I225 WeakPolarHBondContact O-CG1 3.23Å; R221-I225 PolarHBondContact O-N 3.26Å
222	K	89.5	Confident	88.9	Confident	43 Å²	43	65.4 Å²	65.4	19%	0.187	31%	0.309	C	S	.	.	H	α-helix	trans	-57.1	-44.3	174.4	-69.9	-176.7	-172.7	-177.9	0	111.3	D174 F175 E178 R218 Q219 I225 R226	D174-K222 VanDerWaalsContact OD1-CE 3.26Å; D174-K222 WeakPolarHBondContact OD1-CE 3.44Å; D174-K222 IonicContact OD1-NZ 2.75Å; D174-K222 PolarHBondContact OD1-NZ 3.01Å; D174-K222 IonicContact OD2-NZ 3.14Å; F175-K222 HydrophobicContact CE2-CG 4.5Å; E178-K222 WeakPolarHBondContact OE1-CE 3.34Å; E178-K222 IonicContact OE1-NZ 2.58Å; E178-K222 PolarHBondContact OE1-NZ 3Å; R218-K222 PolarHBondContact O-N 3.05Å; R218-K222 VanDerWaalsContact O-N 3.11Å; Q219-K222 PolarHBondContact O-N 3.35Å; K222-I225 PolarHBondContact O-N 3.34Å; K222-R226 WeakPolarHBondContact O-CB 3.06Å; K222-R226 PolarHBondContact O-N 3.41Å
223	K	88.7	Confident	87.9	Confident	112 Å²	112	64.6 Å²	64.6	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-58.8	-48.9	175.9	-178.9	174.8	-179.9	-175.3	0	111.8	Q219 R220 R221 I225 R226 D227	Q219-K223 WeakPolarHBondContact O-CB 3.29Å; Q219-K223 PolarHBondContact O-N 3.13Å; R220-K223 WeakPolarHBondContact O-CB 3.03Å; R220-K223 PolarHBondContact O-N 3.19Å; R221-K223 VanDerWaalsContact C-N 3.28Å; R221-K223 PolarHBondContact O-N 3.12Å; K223-I225 PolarHBondContact O-N 3.48Å; K223-R226 PolarHBondContact O-N 3.26Å; K223-D227 WeakPolarHBondContact CE-OD2 3.35Å; K223-D227 WeakPolarHBondContact CG-OD2 3.49Å; K223-D227 VanDerWaalsContact O-CB 3.28Å; K223-D227 WeakPolarHBondContact O-CB 3.44Å; K223-D227 PolarHBondContact O-N 3.07Å
224	I	88	Confident	86.9	Confident	31 Å²	31	67.4 Å²	67.4	16%	0.159	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-46.9	177.3	-68.7	159.8	0	0	0	111.1	R220 R221 R226 D227 H228 A258 R259	R220-I224 HydrophobicContact CG-CD1 4.19Å; R220-I224 WeakPolarHBondContact O-CG1 3.32Å; R220-I224 PolarHBondContact O-N 2.86Å; R221-I224 PolarHBondContact O-N 3.18Å; I224-R226 VanDerWaalsContact C-N 3.31Å; I224-R226 PolarHBondContact O-N 3.48Å; I224-D227 PolarHBondContact O-N 3.01Å; I224-H228 WeakPolarHBondContact O-CB 3.42Å; I224-H228 PolarHBondContact O-CD2 2.97Å; I224-H228 VanDerWaalsContact O-CD2 3.23Å; I224-H228 PolarHBondContact O-N 2.93Å; I224-A258 WeakPolarHBondContact CG2-O 3.31Å; I224-R259 HydrophobicContact CD1-CB 4.44Å
225	I	86.2	Confident	85.8	Confident	51 Å²	51	70.7 Å²	70.7	26%	0.262	32%	0.322	S	S	.	.	H	α-helix	trans	-58.5	-45.6	179.6	-69.1	164.5	0	0	0	111	F175 R221 K222 K223 G229 L230 I231	F175-I225 HydrophobicContact CE2-CD1 4.36Å; F175-I225 HydrophobicContact CZ-CD1 4.19Å; F175-I225 HydrophobicContact CZ-CG2 4.11Å; R221-I225 WeakPolarHBondContact O-CG1 3.23Å; R221-I225 PolarHBondContact O-N 3.26Å; K222-I225 PolarHBondContact O-N 3.34Å; K223-I225 PolarHBondContact O-N 3.48Å; I225-G229 PolarHBondContact O-N 2.88Å; I225-L230 HydrophobicContact CG2-CB 4.18Å; I225-L230 PolarHBondContact O-N 3.25Å; I225-I231 HydrophobicContact CG2-CG1 3.79Å
226	R	83.9	Confident	84.9	Confident	146 Å²	146	69.4 Å²	69.4	55%	0.551	32%	0.315	S	S	*	.	H	α-helix	trans	-66.7	-51.7	179.1	-177.9	-168.9	65	-170.3	0.1	112	K222 K223 I224 H228 G229	K222-R226 WeakPolarHBondContact O-CB 3.06Å; K222-R226 PolarHBondContact O-N 3.41Å; K223-R226 PolarHBondContact O-N 3.26Å; I224-R226 VanDerWaalsContact C-N 3.31Å; I224-R226 PolarHBondContact O-N 3.48Å; R226-H228 VanDerWaalsContact C-N 3.27Å; R226-H228 PolarHBondContact O-N 3.07Å; R226-G229 PolarHBondContact O-N 2.73Å
227	D	84.5	Confident	84	Confident	50 Å²	50	67.2 Å²	67.2	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-33.9	-172.5	-64.9	-0.1	0	0	0	110.9	K223 I224 P263	K223-D227 WeakPolarHBondContact CE-OD2 3.35Å; K223-D227 WeakPolarHBondContact CG-OD2 3.49Å; K223-D227 VanDerWaalsContact O-CB 3.28Å; K223-D227 WeakPolarHBondContact O-CB 3.44Å; K223-D227 PolarHBondContact O-N 3.07Å; I224-D227 PolarHBondContact O-N 3.01Å; D227-P263 HydrophobicContact CB-CG 4.26Å; D227-P263 VanDerWaalsContact O-CB 3.25Å; D227-P263 WeakPolarHBondContact O-CB 3.23Å; D227-P263 WeakPolarHBondContact O-CG 3.17Å
228	H	81.5	Confident	83.3	Confident	25 Å²	25	69.6 Å²	69.6	12%	0.116	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	1.7	173.2	-70.4	-93.8	0	0	0	114.4	I224 R226 L230 A258 V261 P263	I224-H228 WeakPolarHBondContact O-CB 3.42Å; I224-H228 PolarHBondContact O-CD2 2.97Å; I224-H228 VanDerWaalsContact O-CD2 3.23Å; I224-H228 PolarHBondContact O-N 2.93Å; R226-H228 VanDerWaalsContact C-N 3.27Å; R226-H228 PolarHBondContact O-N 3.07Å; H228-L230 VanDerWaalsContact C-N 3.28Å; H228-L230 HydrophobicContact CB-CD1 3.99Å; H228-L230 HydrophobicContact CB-CD2 4.43Å; H228-L230 HydrophobicContact CB-CG 3.78Å; H228-L230 PolarHBondContact O-N 3.19Å; H228-A258 PolarHBondContact NE2-O 3.29Å; H228-A258 VanDerWaalsContact NE2-O 3.13Å; H228-V261 PolarHBondContact CE1-O 3.17Å; H228-V261 VanDerWaalsContact CE1-O 3.27Å; H228-V261 PolarHBondContact NE2-O 2.93Å; H228-P263 VanDerWaalsContact CE1-CA 3.45Å; H228-P263 WeakPolarHBondContact CE1-CA 3.44Å
229	G	80.5	Confident	82.3	Confident	34 Å²	34	72.7 Å²	72.7	35%	0.351	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	27.1	177.9	0	0	0	0	0	114.6	I225 R226 I231	I225-G229 PolarHBondContact O-N 2.88Å; R226-G229 PolarHBondContact O-N 2.73Å; G229-I231 PolarHBondContact O-N 3.38Å
230	L	81.8	Confident	81.7	Confident	47 Å²	47	68.3 Å²	68.3	25%	0.246	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	1.7	-173.6	-60.6	176.6	0	0	0	114	I225 H228 F236	I225-L230 HydrophobicContact CG2-CB 4.18Å; I225-L230 PolarHBondContact O-N 3.25Å; H228-L230 VanDerWaalsContact C-N 3.28Å; H228-L230 HydrophobicContact CB-CD1 3.99Å; H228-L230 HydrophobicContact CB-CD2 4.43Å; H228-L230 HydrophobicContact CB-CG 3.78Å; H228-L230 PolarHBondContact O-N 3.19Å; L230-F236 HydrophobicContact CD2-CD2 3.8Å; L230-F236 HydrophobicContact CD2-CE1 4.42Å; L230-F236 HydrophobicContact CD2-CE2 3.41Å; L230-F236 VanDerWaalsContact CD2-CE2 3.41Å; L230-F236 HydrophobicContact CD2-CG 4.37Å; L230-F236 HydrophobicContact CD2-CZ 3.69Å
231	I	81.8	Confident	81.1	Confident	31 Å²	31	72 Å²	72	16%	0.159	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-38.8	178.1	-62.4	167.9	0	0	0	111	M165 Y168 I225 G229 L233	M165-I231 HydrophobicContact CE-CG2 3.9Å; Y168-I231 HydrophobicContact CD1-CG2 3.46Å; Y168-I231 VanDerWaalsContact CD1-CG2 3.46Å; Y168-I231 HydrophobicContact CE1-CD1 4.09Å; Y168-I231 HydrophobicContact CE1-CG2 3.72Å; Y168-I231 HydrophobicContact CE2-CD1 4Å; Y168-I231 HydrophobicContact CG-CG2 3.87Å; I225-I231 HydrophobicContact CG2-CG1 3.79Å; G229-I231 PolarHBondContact O-N 3.38Å; I231-L233 PolarHBondContact O-N 3.27Å
232	N	77.4	Confident	80.6	Confident	37 Å²	37	73.7 Å²	73.7	20%	0.198	34%	0.336	C	S	.	.			trans	-98.8	79.5	178.1	-169.6	-25.6	0	0	0	109.9	R234 K235 F236	N232-R234 PolarHBondContact O-N 3.27Å; N232-K235 HydrophobicContact CB-CB 4Å; N232-K235 VanDerWaalsContact CG-CB 3.41Å; N232-K235 PolarHBondContact O-N 2.91Å; N232-K235 WeakPolarHBondContact OD1-CB 3.43Å; N232-K235 PolarHBondContact OD1-N 2.58Å; N232-F236 PolarHBondContact O-N 3.38Å
233	L	74.3	Confident	80.2	Confident	71 Å²	71	73 Å²	73	37%	0.372	33%	0.333	S	S	.	.	H	α-helix	trans	-57.5	-35.5	-176.6	-170.6	66.3	0	0	0	112.3	I231 F236 Q237	I231-L233 PolarHBondContact O-N 3.27Å; L233-F236 WeakPolarHBondContact O-CB 3.46Å; L233-F236 PolarHBondContact O-N 2.96Å; L233-Q237 HydrophobicContact CG-CG 4.48Å; L233-Q237 WeakPolarHBondContact O-CB 3.47Å; L233-Q237 VanDerWaalsContact O-CG 3.26Å; L233-Q237 WeakPolarHBondContact O-CG 3.39Å; L233-Q237 PolarHBondContact O-N 3.5Å
234	R	74.4	Confident	80	Confident	135 Å²	135	68.7 Å²	68.7	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-68.2	-45.7	179.4	-172.2	172.7	180	176.5	-1.2	112.4	N232 F236 Q237 L238	N232-R234 PolarHBondContact O-N 3.27Å; R234-F236 PolarHBondContact O-N 3.48Å; R234-Q237 PolarHBondContact O-N 2.93Å; R234-L238 HydrophobicContact CG-CD1 4.47Å; R234-L238 WeakPolarHBondContact O-CG 3.43Å; R234-L238 PolarHBondContact O-N 2.68Å
235	K	74.4	Confident	80	Confident	124 Å²	124	74 Å²	74	54%	0.539	34%	0.338	S	S	.	.	H	α-helix	trans	-57.8	-42.6	173.3	-176.5	176.4	-178.2	176.8	0	110	N232 L238 M239	N232-K235 HydrophobicContact CB-CB 4Å; N232-K235 VanDerWaalsContact CG-CB 3.41Å; N232-K235 PolarHBondContact O-N 2.91Å; N232-K235 WeakPolarHBondContact OD1-CB 3.43Å; N232-K235 PolarHBondContact OD1-N 2.58Å; K235-L238 PolarHBondContact O-N 2.86Å; K235-M239 WeakPolarHBondContact O-CG 3.22Å; K235-M239 PolarHBondContact O-N 3.26Å
236	F	74.6	Confident	79.9	Confident	25 Å²	25	76.4 Å²	76.4	11%	0.11	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-50.5	177.6	-166.4	-87.6	0	0	0	113.2	L230 N232 L233 R234 L238 M239 E240 Y251 R255	L230-F236 HydrophobicContact CD2-CD2 3.8Å; L230-F236 HydrophobicContact CD2-CE1 4.42Å; L230-F236 HydrophobicContact CD2-CE2 3.41Å; L230-F236 VanDerWaalsContact CD2-CE2 3.41Å; L230-F236 HydrophobicContact CD2-CG 4.37Å; L230-F236 HydrophobicContact CD2-CZ 3.69Å; N232-F236 PolarHBondContact O-N 3.38Å; L233-F236 WeakPolarHBondContact O-CB 3.46Å; L233-F236 PolarHBondContact O-N 2.96Å; R234-F236 PolarHBondContact O-N 3.48Å; F236-L238 VanDerWaalsContact C-N 3.29Å; F236-L238 PolarHBondContact O-N 2.98Å; F236-M239 WeakPolarHBondContact O-CB 3.38Å; F236-M239 PolarHBondContact O-N 3.15Å; F236-E240 PolarHBondContact O-N 2.63Å; F236-Y251 HydrophobicContact CE1-CD1 4.34Å; F236-Y251 AromaticContact CE1-CE1 3.53Å; F236-Y251 HydrophobicContact CE1-CE1 3.53Å; F236-Y251 HydrophobicContact CE2-CE1 4.33Å; F236-Y251 VanDerWaalsContact CE2-OH 3.29Å; F236-Y251 WeakPolarHBondContact CE2-OH 3.37Å; F236-Y251 HydrophobicContact CZ-CD1 4.4Å; F236-Y251 AromaticContact CZ-CE1 3.24Å; F236-Y251 HydrophobicContact CZ-CE1 3.24Å; F236-Y251 AromaticContact CZ-CZ 3.41Å; F236-Y251 VanDerWaalsContact CZ-CZ 3.41Å; F236-Y251 WeakPolarHBondContact CZ-OH 3.46Å; F236-R255 VanDerWaalsContact CE1-CZ 3.46Å; F236-R255 VanDerWaalsContact CE1-NH1 3.32Å; F236-R255 VanDerWaalsContact CE1-NH2 3.35Å
237	Q	77.9	Confident	80	Confident	85 Å²	85	69.7 Å²	69.7	40%	0.397	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-38.6	177.5	-74.1	171.7	-6.4	0	0	112.3	L233 R234 M239 E240 R241	L233-Q237 HydrophobicContact CG-CG 4.48Å; L233-Q237 WeakPolarHBondContact O-CB 3.47Å; L233-Q237 VanDerWaalsContact O-CG 3.26Å; L233-Q237 WeakPolarHBondContact O-CG 3.39Å; L233-Q237 PolarHBondContact O-N 3.5Å; R234-Q237 PolarHBondContact O-N 2.93Å; Q237-M239 VanDerWaalsContact C-N 3.34Å; Q237-E240 PolarHBondContact O-N 3.38Å; Q237-R241 VanDerWaalsContact O-CG 3.28Å; Q237-R241 WeakPolarHBondContact O-CG 3.42Å; Q237-R241 PolarHBondContact O-N 2.84Å
238	L	79.1	Confident	80.1	Confident	99 Å²	99	70.1 Å²	70.1	52%	0.518	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-38.3	174.8	-72.6	171.7	0	0	0	112.1	R234 K235 F236	R234-L238 HydrophobicContact CG-CD1 4.47Å; R234-L238 WeakPolarHBondContact O-CG 3.43Å; R234-L238 PolarHBondContact O-N 2.68Å; K235-L238 PolarHBondContact O-N 2.86Å; F236-L238 VanDerWaalsContact C-N 3.29Å; F236-L238 PolarHBondContact O-N 2.98Å
239	M	72.8	Confident	80.5	Confident	79 Å²	79	72.7 Å²	72.7	39%	0.389	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-43.9	177.1	-65.4	-82.6	-70	0	0	111.1	K235 F236 Q237 R242	K235-M239 WeakPolarHBondContact O-CG 3.22Å; K235-M239 PolarHBondContact O-N 3.26Å; F236-M239 WeakPolarHBondContact O-CB 3.38Å; F236-M239 PolarHBondContact O-N 3.15Å; Q237-M239 VanDerWaalsContact C-N 3.34Å; M239-R242 WeakPolarHBondContact O-CB 3.34Å; M239-R242 PolarHBondContact O-N 3.16Å; M239-R242 PolarHBondContact O-NE 3.17Å; M239-R242 VanDerWaalsContact O-NE 3.16Å; M239-R242 PolarHBondContact SD-NH1 3.38Å; M239-R242 PolarHBondContact SD-NH2 3.13Å
240	E	78.9	Confident	80.7	Confident	27 Å²	27	73.3 Å²	73.3	13%	0.126	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-41.4	178.9	-171.7	169.7	-153.1	0	0	111.9	F236 Q237 R242 Y243 Q248 Y251 R255	F236-E240 PolarHBondContact O-N 2.63Å; Q237-E240 PolarHBondContact O-N 3.38Å; E240-R242 PolarHBondContact O-N 3.45Å; E240-Y243 WeakPolarHBondContact O-CD2 3.28Å; E240-Y243 PolarHBondContact O-N 3.03Å; E240-Q248 HydrophobicContact CG-CG 4.39Å; E240-Q248 WeakPolarHBondContact O-CG 3.47Å; E240-Y251 HydrophobicContact CG-CD1 4.49Å; E240-Y251 HydrophobicContact CG-CG 4.46Å; E240-Y251 WeakPolarHBondContact OE1-CD1 3.36Å; E240-R255 IonicContact OE1-NH2 3.74Å; E240-R255 PolarHBondContact OE1-NH2 3Å; E240-R255 IonicContact OE2-NH2 3.63Å; E240-R255 PolarHBondContact OE2-NH2 3.49Å
241	R	82.4	Confident	80.9	Confident	178 Å²	178	71.8 Å²	71.8	67%	0.672	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-14.5	177.6	-77.9	176.9	-176.2	-174.3	2.8	115.3	Q237 Y243	Q237-R241 VanDerWaalsContact O-CG 3.28Å; Q237-R241 WeakPolarHBondContact O-CG 3.42Å; Q237-R241 PolarHBondContact O-N 2.84Å; R241-Y243 VanDerWaalsContact C-N 3.26Å
242	R	80.2	Confident	81.1	Confident	117 Å²	117	76.4 Å²	76.4	44%	0.442	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.5	176.1	-62.8	177	-57.3	178	13.7	112.3	M239 E240	M239-R242 WeakPolarHBondContact O-CB 3.34Å; M239-R242 PolarHBondContact O-N 3.16Å; M239-R242 PolarHBondContact O-NE 3.17Å; M239-R242 VanDerWaalsContact O-NE 3.16Å; M239-R242 PolarHBondContact SD-NH1 3.38Å; M239-R242 PolarHBondContact SD-NH2 3.13Å; E240-R242 PolarHBondContact O-N 3.45Å
243	Y	81.1	Confident	81.6	Confident	29 Å²	29	78.5 Å²	78.5	11%	0.114	36%	0.359	C	S	.	.	S	Bend	trans	-83.3	155.1	178.6	-60.4	-65.5	0	0	0	111.8	E240 R241 V247 Q248 I270 E271 A274	E240-Y243 WeakPolarHBondContact O-CD2 3.28Å; E240-Y243 PolarHBondContact O-N 3.03Å; R241-Y243 VanDerWaalsContact C-N 3.26Å; Y243-V247 HydrophobicContact CD1-CG1 3.87Å; Y243-V247 HydrophobicContact CD2-CG1 4.43Å; Y243-V247 HydrophobicContact CG-CB 4.48Å; Y243-V247 HydrophobicContact CG-CG1 3.75Å; Y243-Q248 PolarHBondContact O-NE2 3.18Å; Y243-I270 HydrophobicContact CE2-CG2 4.33Å; Y243-E271 PolarHBondContact OH-OE1 2.87Å; Y243-A274 HydrophobicContact CD1-CB 3.74Å; Y243-A274 HydrophobicContact CE1-CB 3.83Å
244	P	84.4	Confident	82.2	Confident	21 Å²	21	76.6 Å²	76.6	14%	0.136	35%	0.349	C	S	.	.			trans	-58.7	158.5	166.1	-20.8	31.9	0	0	0	112.2	E246 V247 Q248 W277 F278	P244-E246 VanDerWaalsContact C-N 3.28Å; P244-E246 PolarHBondContact O-N 2.87Å; P244-V247 HydrophobicContact CB-CG2 4.47Å; P244-V247 HydrophobicContact CG-CG2 4.38Å; P244-V247 PolarHBondContact O-N 3.4Å; P244-Q248 WeakPolarHBondContact O-CG 3.28Å; P244-Q248 PolarHBondContact O-N 3.42Å; P244-W277 HydrophobicContact CB-CD2 4.06Å; P244-W277 HydrophobicContact CB-CE3 3.69Å; P244-W277 HydrophobicContact CB-CH2 3.56Å; P244-W277 HydrophobicContact CB-CZ2 3.98Å; P244-W277 HydrophobicContact CB-CZ3 3.38Å; P244-W277 HydrophobicContact CG-CD2 4.01Å; P244-W277 HydrophobicContact CG-CE3 3.28Å; P244-W277 HydrophobicContact CG-CH2 3.96Å; P244-W277 HydrophobicContact CG-CZ3 3.21Å; P244-F278 HydrophobicContact CG-CE1 4.13Å; P244-F278 HydrophobicContact CG-CZ 3.92Å
245	K	86.9	Confident	82.6	Confident	144 Å²	144	74 Å²	74	63%	0.626	34%	0.339	S	S	*	.	H	α-helix	trans	-57.7	-40.8	-174.7	-173.2	176.4	177.9	-177.6	0	112.5	V247 Q248 D249	K245-V247 VanDerWaalsContact C-N 3.27Å; K245-V247 PolarHBondContact O-N 3.25Å; K245-Q248 WeakPolarHBondContact O-CB 3.28Å; K245-Q248 PolarHBondContact O-N 3.39Å; K245-Q248 VanDerWaalsContact O-N 3.17Å; K245-D249 VanDerWaalsContact O-CG 3.23Å; K245-D249 PolarHBondContact O-N 3.46Å
246	E	85.9	Confident	83.2	Confident	101 Å²	101	77.5 Å²	77.5	47%	0.472	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-37.4	179.2	-62.7	75.5	-172.6	0	0	111.9	P244 L250 W277	P244-E246 VanDerWaalsContact C-N 3.28Å; P244-E246 PolarHBondContact O-N 2.87Å; E246-L250 WeakPolarHBondContact O-CB 3.42Å; E246-L250 PolarHBondContact O-N 2.85Å; E246-L250 VanDerWaalsContact O-N 3.12Å; E246-W277 HydrophobicContact CG-CZ2 4.35Å; E246-W277 WeakPolarHBondContact OE2-CZ2 3.39Å
247	V	85.3	Confident	83.8	Confident	4 Å²	4	81 Å²	81	2%	0.024	37%	0.365	C	S	.	.	H	α-helix	trans	-78.6	-34	178.5	178.1	0	0	0	0	110.3	Y243 P244 K245 L250 Y251 I270 A274 W277	Y243-V247 HydrophobicContact CD1-CG1 3.87Å; Y243-V247 HydrophobicContact CD2-CG1 4.43Å; Y243-V247 HydrophobicContact CG-CB 4.48Å; Y243-V247 HydrophobicContact CG-CG1 3.75Å; P244-V247 HydrophobicContact CB-CG2 4.47Å; P244-V247 HydrophobicContact CG-CG2 4.38Å; P244-V247 PolarHBondContact O-N 3.4Å; K245-V247 VanDerWaalsContact C-N 3.27Å; K245-V247 PolarHBondContact O-N 3.25Å; V247-L250 PolarHBondContact O-N 2.79Å; V247-Y251 WeakPolarHBondContact O-CB 3.19Å; V247-Y251 PolarHBondContact O-N 3.39Å; V247-I270 HydrophobicContact CG1-CG2 4.48Å; V247-A274 HydrophobicContact CG1-CB 3.89Å; V247-A274 HydrophobicContact CG2-CB 4.37Å; V247-W277 HydrophobicContact CG2-CB 4.1Å; V247-W277 HydrophobicContact CG2-CG 4.27Å
248	Q	87.2	Confident	84	Confident	59 Å²	59	77.4 Å²	77.4	28%	0.276	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-46.2	170.8	-66.8	178.1	22.1	0	0	111.3	E240 Y243 P244 K245 L250 Y251 E252	E240-Q248 HydrophobicContact CG-CG 4.39Å; E240-Q248 WeakPolarHBondContact O-CG 3.47Å; Y243-Q248 PolarHBondContact O-NE2 3.18Å; P244-Q248 WeakPolarHBondContact O-CG 3.28Å; P244-Q248 PolarHBondContact O-N 3.42Å; K245-Q248 WeakPolarHBondContact O-CB 3.28Å; K245-Q248 PolarHBondContact O-N 3.39Å; K245-Q248 VanDerWaalsContact O-N 3.17Å; Q248-L250 VanDerWaalsContact C-N 3.3Å; Q248-L250 PolarHBondContact O-N 2.88Å; Q248-Y251 WeakPolarHBondContact O-CA 3.35Å; Q248-Y251 VanDerWaalsContact O-CB 3.29Å; Q248-Y251 WeakPolarHBondContact O-CB 3.31Å; Q248-Y251 PolarHBondContact O-N 3.13Å; Q248-E252 PolarHBondContact O-N 2.8Å
249	D	88.4	Confident	84.3	Confident	80 Å²	80	80.2 Å²	80.2	43%	0.428	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-39.4	178.1	-66	-16.5	0	0	0	111.3	K245 T253	K245-D249 VanDerWaalsContact O-CG 3.23Å; K245-D249 PolarHBondContact O-N 3.46Å; D249-T253 WeakPolarHBondContact O-CB 3.42Å; D249-T253 PolarHBondContact O-N 3.47Å; D249-T253 PolarHBondContact O-OG1 3.42Å
250	L	86.6	Confident	84.9	Confident	46 Å²	46	83.2 Å²	83.2	24%	0.241	37%	0.369	C	S	.	.	H	α-helix	trans	-63	-46.1	171.2	176.9	67.6	0	0	0	111.1	E246 V247 Q248 E252 T253 M254 F269 I270 H273	E246-L250 WeakPolarHBondContact O-CB 3.42Å; E246-L250 PolarHBondContact O-N 2.85Å; E246-L250 VanDerWaalsContact O-N 3.12Å; V247-L250 PolarHBondContact O-N 2.79Å; Q248-L250 VanDerWaalsContact C-N 3.3Å; Q248-L250 PolarHBondContact O-N 2.88Å; L250-E252 VanDerWaalsContact C-N 3.33Å; L250-E252 PolarHBondContact O-N 2.93Å; L250-T253 PolarHBondContact O-N 3.37Å; L250-M254 HydrophobicContact CD1-CG 3.85Å; L250-M254 HydrophobicContact CG-CG 4.14Å; L250-M254 VanDerWaalsContact O-CB 3.3Å; L250-M254 WeakPolarHBondContact O-CB 3.24Å; L250-M254 WeakPolarHBondContact O-CG 3.15Å; L250-M254 PolarHBondContact O-N 3.31Å; L250-F269 HydrophobicContact CD1-CE1 4.34Å; L250-F269 HydrophobicContact CD2-CE1 4.33Å; L250-I270 HydrophobicContact CG-CD1 4.43Å; L250-H273 HydrophobicContact CD2-CB 3.49Å; L250-H273 VanDerWaalsContact CD2-CB 3.49Å; L250-H273 VanDerWaalsContact CD2-CD2 3.41Å; L250-H273 WeakPolarHBondContact CD2-CD2 3.42Å
251	Y	85.1	Confident	85.3	Confident	16 Å²	16	84.3 Å²	84.3	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-56.6	-48	178.6	-162.8	-69.3	0	0	0	111.1	F236 E240 V247 Q248 T253 M254 R255 H266 I270	F236-Y251 HydrophobicContact CE1-CD1 4.34Å; F236-Y251 AromaticContact CE1-CE1 3.53Å; F236-Y251 HydrophobicContact CE1-CE1 3.53Å; F236-Y251 HydrophobicContact CE2-CE1 4.33Å; F236-Y251 VanDerWaalsContact CE2-OH 3.29Å; F236-Y251 WeakPolarHBondContact CE2-OH 3.37Å; F236-Y251 HydrophobicContact CZ-CD1 4.4Å; F236-Y251 AromaticContact CZ-CE1 3.24Å; F236-Y251 HydrophobicContact CZ-CE1 3.24Å; F236-Y251 AromaticContact CZ-CZ 3.41Å; F236-Y251 VanDerWaalsContact CZ-CZ 3.41Å; F236-Y251 WeakPolarHBondContact CZ-OH 3.46Å; E240-Y251 HydrophobicContact CG-CD1 4.49Å; E240-Y251 HydrophobicContact CG-CG 4.46Å; E240-Y251 WeakPolarHBondContact OE1-CD1 3.36Å; V247-Y251 WeakPolarHBondContact O-CB 3.19Å; V247-Y251 PolarHBondContact O-N 3.39Å; Q248-Y251 WeakPolarHBondContact O-CA 3.35Å; Q248-Y251 VanDerWaalsContact O-CB 3.29Å; Q248-Y251 WeakPolarHBondContact O-CB 3.31Å; Q248-Y251 PolarHBondContact O-N 3.13Å; Y251-T253 PolarHBondContact O-N 3.11Å; Y251-M254 CarbonylContact O-C 3.32Å; Y251-M254 PolarHBondContact O-N 3.26Å; Y251-R255 PolarHBondContact O-N 3.39Å; Y251-H266 AromaticContact CZ-CE1 3.96Å; Y251-I270 HydrophobicContact CD2-CB 4.14Å; Y251-I270 HydrophobicContact CD2-CD1 3.88Å; Y251-I270 HydrophobicContact CD2-CG1 3.69Å; Y251-I270 HydrophobicContact CD2-CG2 3.43Å; Y251-I270 VanDerWaalsContact CD2-CG2 3.43Å; Y251-I270 HydrophobicContact CE2-CB 4.26Å; Y251-I270 HydrophobicContact CE2-CD1 4.43Å; Y251-I270 HydrophobicContact CE2-CG1 3.8Å; Y251-I270 HydrophobicContact CE2-CG2 3.81Å; Y251-I270 HydrophobicContact CG-CD1 4.28Å
252	E	86	Confident	85.4	Confident	128 Å²	128	77.1 Å²	77.1	60%	0.598	36%	0.358	S	S	*	.	H	α-helix	trans	-60.9	-43.9	178.1	-174.1	170.6	-169.2	0	0	111.9	Q248 L250 M254 R255	Q248-E252 PolarHBondContact O-N 2.8Å; L250-E252 VanDerWaalsContact C-N 3.33Å; L250-E252 PolarHBondContact O-N 2.93Å; E252-M254 VanDerWaalsContact C-N 3.33Å; E252-M254 PolarHBondContact O-N 2.74Å; E252-R255 WeakPolarHBondContact O-CB 3.24Å; E252-R255 PolarHBondContact O-N 3.22Å
253	T	88.4	Confident	85.4	Confident	81 Å²	81	72.8 Å²	72.8	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-44	174.7	-57.2	0	0	0	0	111.1	D249 L250 Y251 R255	D249-T253 WeakPolarHBondContact O-CB 3.42Å; D249-T253 PolarHBondContact O-N 3.47Å; D249-T253 PolarHBondContact O-OG1 3.42Å; L250-T253 PolarHBondContact O-N 3.37Å; Y251-T253 PolarHBondContact O-N 3.11Å; T253-R255 VanDerWaalsContact C-N 3.31Å; T253-R255 PolarHBondContact O-N 3.33Å
254	M	86.4	Confident	85.4	Confident	31 Å²	31	74.6 Å²	74.6	15%	0.153	36%	0.359	C	S	.	.	H	α-helix	trans	-74.6	-19.1	-176.5	-71.1	-57.9	-63.1	0	0	113.8	L250 Y251 E252 R256 F257 H266 F269 I270	L250-M254 HydrophobicContact CD1-CG 3.85Å; L250-M254 HydrophobicContact CG-CG 4.14Å; L250-M254 VanDerWaalsContact O-CB 3.3Å; L250-M254 WeakPolarHBondContact O-CB 3.24Å; L250-M254 WeakPolarHBondContact O-CG 3.15Å; L250-M254 PolarHBondContact O-N 3.31Å; Y251-M254 CarbonylContact O-C 3.32Å; Y251-M254 PolarHBondContact O-N 3.26Å; E252-M254 VanDerWaalsContact C-N 3.33Å; E252-M254 PolarHBondContact O-N 2.74Å; M254-R256 PolarHBondContact O-N 2.9Å; M254-R256 VanDerWaalsContact O-N 3.13Å; M254-F257 HydrophobicContact CE-CB 4.31Å; M254-F257 HydrophobicContact CE-CD2 4.01Å; M254-F257 HydrophobicContact CE-CG 4.39Å; M254-F257 WeakPolarHBondContact O-CB 3.41Å; M254-F257 PolarHBondContact O-N 2.87Å; M254-F257 HydrophobicContact SD-CD2 3.84Å; M254-F257 HydrophobicContact SD-CE2 4.18Å; M254-H266 PolarHBondContact O-NE2 3.14Å; M254-H266 VanDerWaalsContact O-NE2 3.15Å; M254-F269 HydrophobicContact CE-CD1 3.81Å; M254-F269 HydrophobicContact CE-CE1 3.59Å; M254-F269 HydrophobicContact CE-CZ 4.14Å; M254-F269 HydrophobicContact CG-CD1 4.22Å; M254-F269 HydrophobicContact CG-CE1 3.69Å; M254-F269 HydrophobicContact SD-CD1 4.5Å; M254-F269 HydrophobicContact SD-CE1 3.78Å; M254-F269 HydrophobicContact SD-CZ 4.3Å; M254-I270 HydrophobicContact CB-CD1 4.02Å; M254-I270 HydrophobicContact CG-CD1 4.2Å
255	R	83.4	Confident	85.3	Confident	81 Å²	81	78.8 Å²	78.8	31%	0.306	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-55.6	-31.3	178.3	-165	-177.7	-63.9	-127.3	7.3	112.5	F236 E240 Y251 E252 T253 F257 A258	F236-R255 VanDerWaalsContact CE1-CZ 3.46Å; F236-R255 VanDerWaalsContact CE1-NH1 3.32Å; F236-R255 VanDerWaalsContact CE1-NH2 3.35Å; E240-R255 IonicContact OE1-NH2 3.74Å; E240-R255 PolarHBondContact OE1-NH2 3Å; E240-R255 IonicContact OE2-NH2 3.63Å; E240-R255 PolarHBondContact OE2-NH2 3.49Å; Y251-R255 PolarHBondContact O-N 3.39Å; E252-R255 WeakPolarHBondContact O-CB 3.24Å; E252-R255 PolarHBondContact O-N 3.22Å; T253-R255 VanDerWaalsContact C-N 3.31Å; T253-R255 PolarHBondContact O-N 3.33Å; R255-F257 PolarHBondContact O-N 3.08Å; R255-A258 VanDerWaalsContact O-CB 3.28Å; R255-A258 WeakPolarHBondContact O-CB 3.31Å; R255-A258 PolarHBondContact O-N 2.88Å
256	R	85.6	Confident	85.1	Confident	197 Å²	197	72 Å²	72	74%	0.743	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-64.7	-30.2	177.2	-59.2	178.8	-171	176	3.8	112.5	M254 A258	M254-R256 PolarHBondContact O-N 2.9Å; M254-R256 VanDerWaalsContact O-N 3.13Å; R256-A258 VanDerWaalsContact C-N 3.34Å
257	F	87.2	Confident	84.9	Confident	99 Å²	99	70.4 Å²	70.4	43%	0.434	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-83.9	-7.4	-179.6	-61.7	-79.2	0	0	0	113.5	M254 R255 R259 I260 V261	M254-F257 HydrophobicContact CE-CB 4.31Å; M254-F257 HydrophobicContact CE-CD2 4.01Å; M254-F257 HydrophobicContact CE-CG 4.39Å; M254-F257 WeakPolarHBondContact O-CB 3.41Å; M254-F257 PolarHBondContact O-N 2.87Å; M254-F257 HydrophobicContact SD-CD2 3.84Å; M254-F257 HydrophobicContact SD-CE2 4.18Å; R255-F257 PolarHBondContact O-N 3.08Å; F257-R259 PolarHBondContact O-N 3.39Å; F257-I260 PolarHBondContact O-N 2.83Å; F257-V261 HydrophobicContact CB-CG2 4.3Å; F257-V261 PolarHBondContact O-N 2.86Å
258	A	81.9	Confident	84.7	Confident	9 Å²	9	75.4 Å²	75.4	7%	0.074	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-59.3	-12.2	171	0	0	0	0	0	113.1	I224 H228 R255 R256 I260	I224-A258 WeakPolarHBondContact CG2-O 3.31Å; H228-A258 PolarHBondContact NE2-O 3.29Å; H228-A258 VanDerWaalsContact NE2-O 3.13Å; R255-A258 VanDerWaalsContact O-CB 3.28Å; R255-A258 WeakPolarHBondContact O-CB 3.31Å; R255-A258 PolarHBondContact O-N 2.88Å; R256-A258 VanDerWaalsContact C-N 3.34Å; A258-I260 VanDerWaalsContact C-N 3.27Å
259	R	85.5	Confident	84.5	Confident	157 Å²	157	76.3 Å²	76.3	59%	0.592	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-76.4	-13.3	172.6	-61.5	-179.2	-176.3	-178.5	2.2	114.1	R220 I224 F257	R220-R259 PolarHBondContact NH1-O 3.06Å; I224-R259 HydrophobicContact CD1-CB 4.44Å; F257-R259 PolarHBondContact O-N 3.39Å
260	I	87.1	Confident	84.3	Confident	143 Å²	143	72.6 Å²	72.6	73%	0.733	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	-41.5	-169.7	-53.3	175.5	0	0	0	110.1	F257 A258	F257-I260 PolarHBondContact O-N 2.83Å; A258-I260 VanDerWaalsContact C-N 3.27Å
261	V	85.6	Confident	84	Confident	50 Å²	50	73.1 Å²	73.1	30%	0.303	35%	0.348	S	S	.	.	S	Bend	trans	-90.2	134.1	-178.3	-175.7	0	0	0	0	109.3	H228 F257 E265 H266	H228-V261 PolarHBondContact CE1-O 3.17Å; H228-V261 VanDerWaalsContact CE1-O 3.27Å; H228-V261 PolarHBondContact NE2-O 2.93Å; F257-V261 HydrophobicContact CB-CG2 4.3Å; F257-V261 PolarHBondContact O-N 2.86Å; V261-E265 HydrophobicContact CG1-CB 3.68Å; V261-H266 HydrophobicContact CG1-CB 4.02Å
262	G	84.4	Confident	83.7	Confident	26 Å²	26	76 Å²	76	27%	0.268	37%	0.371	S	S	.	.			trans	-63.6	159.3	175.5	0	0	0	0	0	112.6	V264 E265 H266	G262-V264 PolarHBondContact O-N 3.34Å; G262-E265 VanDerWaalsContact C-OE2 3.28Å; G262-E265 WeakPolarHBondContact CA-OE2 3.29Å; G262-E265 PolarHBondContact O-N 2.71Å; G262-H266 VanDerWaalsContact O-CB 3.28Å; G262-H266 WeakPolarHBondContact O-CB 3.32Å; G262-H266 PolarHBondContact O-N 3.16Å
263	P	81.7	Confident	83.4	Confident	27 Å²	27	72.8 Å²	72.8	18%	0.175	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-40.4	-173.5	25.1	-35.1	0	0	0	112.6	D227 H228 H266 D267	D227-P263 HydrophobicContact CB-CG 4.26Å; D227-P263 VanDerWaalsContact O-CB 3.25Å; D227-P263 WeakPolarHBondContact O-CB 3.23Å; D227-P263 WeakPolarHBondContact O-CG 3.17Å; H228-P263 VanDerWaalsContact CE1-CA 3.45Å; H228-P263 WeakPolarHBondContact CE1-CA 3.44Å; P263-H266 PolarHBondContact O-N 3.46Å; P263-D267 WeakPolarHBondContact O-CB 3.46Å; P263-D267 VanDerWaalsContact O-CG 3.24Å; P263-D267 PolarHBondContact O-N 3.05Å
264	V	79.9	Confident	82.9	Confident	67 Å²	67	69 Å²	69	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-69	-41.7	-179	177	0	0	0	0	110.9	G262 K268	G262-V264 PolarHBondContact O-N 3.34Å; V264-K268 HydrophobicContact CG1-CD 4.08Å; V264-K268 WeakPolarHBondContact O-CB 3.4Å; V264-K268 VanDerWaalsContact O-CG 3.22Å; V264-K268 WeakPolarHBondContact O-CG 3.47Å; V264-K268 PolarHBondContact O-N 3.25Å
265	E	82.6	Confident	82.2	Confident	108 Å²	108	69.5 Å²	69.5	51%	0.505	34%	0.338	S	S	.	.	H	α-helix	trans	-67.2	-40.6	178.1	-64	74.3	-159	0	0	111.2	V261 G262 K268 F269	V261-E265 HydrophobicContact CG1-CB 3.68Å; G262-E265 VanDerWaalsContact C-OE2 3.28Å; G262-E265 WeakPolarHBondContact CA-OE2 3.29Å; G262-E265 PolarHBondContact O-N 2.71Å; E265-K268 PolarHBondContact O-N 3.04Å; E265-F269 WeakPolarHBondContact O-CB 3.09Å; E265-F269 PolarHBondContact O-N 2.77Å
266	H	83.8	Confident	81.6	Confident	3 Å²	3	73.9 Å²	73.9	1%	0.014	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-48.8	176.5	-173.7	-88	0	0	0	111.2	Y251 M254 V261 G262 P263 K268 F269 I270	Y251-H266 AromaticContact CZ-CE1 3.96Å; M254-H266 PolarHBondContact O-NE2 3.14Å; M254-H266 VanDerWaalsContact O-NE2 3.15Å; V261-H266 HydrophobicContact CG1-CB 4.02Å; G262-H266 VanDerWaalsContact O-CB 3.28Å; G262-H266 WeakPolarHBondContact O-CB 3.32Å; G262-H266 PolarHBondContact O-N 3.16Å; P263-H266 PolarHBondContact O-N 3.46Å; H266-K268 PolarHBondContact O-N 3.39Å; H266-F269 WeakPolarHBondContact O-CB 3.49Å; H266-F269 PolarHBondContact O-N 3.26Å; H266-F269 VanDerWaalsContact O-N 3.17Å; H266-I270 WeakPolarHBondContact O-CG1 3.35Å; H266-I270 PolarHBondContact O-N 2.92Å
267	D	81.7	Confident	80.9	Confident	66 Å²	66	68.1 Å²	68.1	35%	0.353	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-44.6	177.4	-72.4	-17.4	0	0	0	111.4	P263 F269 I270 E271	P263-D267 WeakPolarHBondContact O-CB 3.46Å; P263-D267 VanDerWaalsContact O-CG 3.24Å; P263-D267 PolarHBondContact O-N 3.05Å; D267-F269 VanDerWaalsContact C-N 3.3Å; D267-F269 PolarHBondContact O-N 3.32Å; D267-I270 PolarHBondContact O-N 3.32Å; D267-E271 WeakPolarHBondContact O-CB 3.36Å; D267-E271 VanDerWaalsContact O-CG 3.3Å; D267-E271 WeakPolarHBondContact O-CG 3.34Å; D267-E271 PolarHBondContact O-N 2.74Å
268	K	80.1	Confident	80	Confident	109 Å²	109	67.7 Å²	67.7	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-59.2	-40.2	175.2	-78.5	173.1	-179.3	174.3	0	112.3	V264 E265 H266 S272 I291	V264-K268 HydrophobicContact CG1-CD 4.08Å; V264-K268 WeakPolarHBondContact O-CB 3.4Å; V264-K268 VanDerWaalsContact O-CG 3.22Å; V264-K268 WeakPolarHBondContact O-CG 3.47Å; V264-K268 PolarHBondContact O-N 3.25Å; E265-K268 PolarHBondContact O-N 3.04Å; H266-K268 PolarHBondContact O-N 3.39Å; K268-S272 WeakPolarHBondContact O-CB 3.49Å; K268-S272 PolarHBondContact O-N 3.15Å; K268-I291 HydrophobicContact CG-CD1 4.43Å
269	F	84.2	Confident	79.1	Confident	79 Å²	79	71.1 Å²	71.1	35%	0.346	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-47.5	178.4	176.3	-92.9	0	0	0	111.4	L250 M254 E265 H266 D267 S272 H273	L250-F269 HydrophobicContact CD1-CE1 4.34Å; L250-F269 HydrophobicContact CD2-CE1 4.33Å; M254-F269 HydrophobicContact CE-CD1 3.81Å; M254-F269 HydrophobicContact CE-CE1 3.59Å; M254-F269 HydrophobicContact CE-CZ 4.14Å; M254-F269 HydrophobicContact CG-CD1 4.22Å; M254-F269 HydrophobicContact CG-CE1 3.69Å; M254-F269 HydrophobicContact SD-CD1 4.5Å; M254-F269 HydrophobicContact SD-CE1 3.78Å; M254-F269 HydrophobicContact SD-CZ 4.3Å; E265-F269 WeakPolarHBondContact O-CB 3.09Å; E265-F269 PolarHBondContact O-N 2.77Å; H266-F269 WeakPolarHBondContact O-CB 3.49Å; H266-F269 PolarHBondContact O-N 3.26Å; H266-F269 VanDerWaalsContact O-N 3.17Å; D267-F269 VanDerWaalsContact C-N 3.3Å; D267-F269 PolarHBondContact O-N 3.32Å; F269-S272 PolarHBondContact O-N 2.92Å; F269-H273 AromaticContact CE1-CD2 3.57Å; F269-H273 AromaticContact CE2-CD2 3.83Å; F269-H273 AromaticContact CE2-NE2 3.66Å; F269-H273 AromaticContact CZ-CD2 3.38Å; F269-H273 WeakPolarHBondContact CZ-CD2 3.26Å; F269-H273 AromaticContact CZ-NE2 3.35Å; F269-H273 WeakPolarHBondContact CZ-NE2 3.5Å; F269-H273 PolarHBondContact O-N 3.09Å; F269-H273 VanDerWaalsContact O-N 3.16Å
270	I	82.8	Confident	77.9	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-50.1	176.9	-66	-57.2	0	0	0	110.9	Y243 V247 L250 Y251 M254 H266 D267 S272 H273 A274	Y243-I270 HydrophobicContact CE2-CG2 4.33Å; V247-I270 HydrophobicContact CG1-CG2 4.48Å; L250-I270 HydrophobicContact CG-CD1 4.43Å; Y251-I270 HydrophobicContact CD2-CB 4.14Å; Y251-I270 HydrophobicContact CD2-CD1 3.88Å; Y251-I270 HydrophobicContact CD2-CG1 3.69Å; Y251-I270 HydrophobicContact CD2-CG2 3.43Å; Y251-I270 VanDerWaalsContact CD2-CG2 3.43Å; Y251-I270 HydrophobicContact CE2-CB 4.26Å; Y251-I270 HydrophobicContact CE2-CD1 4.43Å; Y251-I270 HydrophobicContact CE2-CG1 3.8Å; Y251-I270 HydrophobicContact CE2-CG2 3.81Å; Y251-I270 HydrophobicContact CG-CD1 4.28Å; M254-I270 HydrophobicContact CB-CD1 4.02Å; M254-I270 HydrophobicContact CG-CD1 4.2Å; H266-I270 WeakPolarHBondContact O-CG1 3.35Å; H266-I270 PolarHBondContact O-N 2.92Å; D267-I270 PolarHBondContact O-N 3.32Å; I270-S272 VanDerWaalsContact C-N 3.3Å; I270-S272 PolarHBondContact O-N 3.34Å; I270-H273 PolarHBondContact O-N 3.11Å; I270-H273 VanDerWaalsContact O-N 3.13Å; I270-A274 PolarHBondContact O-N 2.91Å
271	E	81.4	Confident	76.5	Confident	58 Å²	58	64.5 Å²	64.5	27%	0.271	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-38.7	-179.7	-73	-66.6	173.5	0	0	111.5	Y243 D267 H273 A274 C275 I291	Y243-E271 PolarHBondContact OH-OE1 2.87Å; D267-E271 WeakPolarHBondContact O-CB 3.36Å; D267-E271 VanDerWaalsContact O-CG 3.3Å; D267-E271 WeakPolarHBondContact O-CG 3.34Å; D267-E271 PolarHBondContact O-N 2.74Å; E271-H273 VanDerWaalsContact C-N 3.3Å; E271-H273 PolarHBondContact O-N 3.46Å; E271-A274 PolarHBondContact O-N 3.24Å; E271-C275 VanDerWaalsContact O-CB 3.31Å; E271-C275 WeakPolarHBondContact O-CB 3.39Å; E271-C275 PolarHBondContact O-N 3.15Å; E271-C275 PolarHBondContact O-SG 3.25Å; E271-C275 VanDerWaalsContact O-SG 3.33Å; E271-I291 HydrophobicContact CB-CD1 4.17Å; E271-I291 HydrophobicContact CB-CG1 4.43Å
272	S	78.6	Confident	74.6	Confident	77 Å²	77	66 Å²	66	54%	0.538	33%	0.334	S	S	.	.	H	α-helix	trans	-59.9	-41.5	174.6	-178.5	0	0	0	0	111.9	K268 F269 I270 R276	K268-S272 WeakPolarHBondContact O-CB 3.49Å; K268-S272 PolarHBondContact O-N 3.15Å; F269-S272 PolarHBondContact O-N 2.92Å; I270-S272 VanDerWaalsContact C-N 3.3Å; I270-S272 PolarHBondContact O-N 3.34Å; S272-R276 WeakPolarHBondContact O-CB 3.35Å; S272-R276 PolarHBondContact O-N 3.21Å
273	H	78.8	Confident	72.7	Confident	60 Å²	60	73.1 Å²	73.1	28%	0.278	36%	0.36	S	S	.	.	H	α-helix	trans	-71.5	-37.7	175.7	-86.6	-49.4	0	0	0	113.2	L250 F269 I270 E271 R276 W277	L250-H273 HydrophobicContact CD2-CB 3.49Å; L250-H273 VanDerWaalsContact CD2-CB 3.49Å; L250-H273 VanDerWaalsContact CD2-CD2 3.41Å; L250-H273 WeakPolarHBondContact CD2-CD2 3.42Å; F269-H273 AromaticContact CE1-CD2 3.57Å; F269-H273 AromaticContact CE2-CD2 3.83Å; F269-H273 AromaticContact CE2-NE2 3.66Å; F269-H273 AromaticContact CZ-CD2 3.38Å; F269-H273 WeakPolarHBondContact CZ-CD2 3.26Å; F269-H273 AromaticContact CZ-NE2 3.35Å; F269-H273 WeakPolarHBondContact CZ-NE2 3.5Å; F269-H273 PolarHBondContact O-N 3.09Å; F269-H273 VanDerWaalsContact O-N 3.16Å; I270-H273 PolarHBondContact O-N 3.11Å; I270-H273 VanDerWaalsContact O-N 3.13Å; E271-H273 VanDerWaalsContact C-N 3.3Å; E271-H273 PolarHBondContact O-N 3.46Å; H273-R276 PolarHBondContact O-N 3.19Å; H273-W277 WeakPolarHBondContact O-CB 3.38Å; H273-W277 PolarHBondContact O-N 2.96Å
274	A	78.7	Confident	70.8	Confident	1 Å²	1	81.9 Å²	81.9	1%	0.008	39%	0.391	C	S	.	.	H	α-helix	trans	-59.4	-52.3	172.2	0	0	0	0	0	110.8	Y243 V247 I270 E271 R276 W277 F278	Y243-A274 HydrophobicContact CD1-CB 3.74Å; Y243-A274 HydrophobicContact CE1-CB 3.83Å; V247-A274 HydrophobicContact CG1-CB 3.89Å; V247-A274 HydrophobicContact CG2-CB 4.37Å; I270-A274 PolarHBondContact O-N 2.91Å; E271-A274 PolarHBondContact O-N 3.24Å; A274-R276 PolarHBondContact O-N 3.38Å; A274-W277 WeakPolarHBondContact O-CB 3.22Å; A274-W277 PolarHBondContact O-N 3.36Å; A274-W277 VanDerWaalsContact O-N 3.11Å; A274-F278 HydrophobicContact CB-CE2 4.35Å; A274-F278 WeakPolarHBondContact O-CD2 3.34Å; A274-F278 PolarHBondContact O-N 3.46Å
275	C	70.9	Confident	68.7	Low	41 Å²	41	85.1 Å²	85.1	28%	0.277	41%	0.406	S	S	.	.	H	α-helix	trans	-57.9	-44.4	175.3	-73.6	0	0	0	0	111.7	E271 W277 F278 L279	E271-C275 VanDerWaalsContact O-CB 3.31Å; E271-C275 WeakPolarHBondContact O-CB 3.39Å; E271-C275 PolarHBondContact O-N 3.15Å; E271-C275 PolarHBondContact O-SG 3.25Å; E271-C275 VanDerWaalsContact O-SG 3.33Å; C275-W277 VanDerWaalsContact C-N 3.28Å; C275-W277 PolarHBondContact O-N 2.93Å; C275-F278 PolarHBondContact O-N 3.5Å; C275-L279 VanDerWaalsContact O-CB 3.24Å; C275-L279 WeakPolarHBondContact O-CB 3.3Å; C275-L279 WeakPolarHBondContact O-CG 3.41Å; C275-L279 PolarHBondContact O-N 3Å
276	R	72.1	Confident	66.3	Low	173 Å²	173	85 Å²	85	65%	0.653	42%	0.415	S	S	*	.	H	α-helix	trans	-60.8	-39.9	176.3	-176.6	-179.8	178.9	-160.4	-1.1	111.6	S272 H273 A274 L279 S280	S272-R276 WeakPolarHBondContact O-CB 3.35Å; S272-R276 PolarHBondContact O-N 3.21Å; H273-R276 PolarHBondContact O-N 3.19Å; A274-R276 PolarHBondContact O-N 3.38Å; R276-L279 PolarHBondContact O-N 3.45Å; R276-S280 VanDerWaalsContact O-CB 3.24Å; R276-S280 WeakPolarHBondContact O-CB 3.49Å; R276-S280 PolarHBondContact O-N 2.9Å; R276-S280 PolarHBondContact O-OG 2.91Å
277	W	69.6	Low	64.3	Low	77 Å²	77	90.1 Å²	90.1	29%	0.292	45%	0.447	S	S	.	.	H	α-helix	trans	-64.9	-47.7	177.4	-160.6	91.4	0	0	0	110.8	P244 E246 V247 H273 A274 C275 L279 S280 L281	P244-W277 HydrophobicContact CB-CD2 4.06Å; P244-W277 HydrophobicContact CB-CE3 3.69Å; P244-W277 HydrophobicContact CB-CH2 3.56Å; P244-W277 HydrophobicContact CB-CZ2 3.98Å; P244-W277 HydrophobicContact CB-CZ3 3.38Å; P244-W277 HydrophobicContact CG-CD2 4.01Å; P244-W277 HydrophobicContact CG-CE3 3.28Å; P244-W277 HydrophobicContact CG-CH2 3.96Å; P244-W277 HydrophobicContact CG-CZ3 3.21Å; E246-W277 HydrophobicContact CG-CZ2 4.35Å; E246-W277 WeakPolarHBondContact OE2-CZ2 3.39Å; V247-W277 HydrophobicContact CG2-CB 4.1Å; V247-W277 HydrophobicContact CG2-CG 4.27Å; H273-W277 WeakPolarHBondContact O-CB 3.38Å; H273-W277 PolarHBondContact O-N 2.96Å; A274-W277 WeakPolarHBondContact O-CB 3.22Å; A274-W277 PolarHBondContact O-N 3.36Å; A274-W277 VanDerWaalsContact O-N 3.11Å; C275-W277 VanDerWaalsContact C-N 3.28Å; C275-W277 PolarHBondContact O-N 2.93Å; W277-L279 PolarHBondContact O-N 3.25Å; W277-S280 WeakPolarHBondContact CA-OG 3.47Å; W277-S280 PolarHBondContact O-N 3.07Å; W277-S280 PolarHBondContact O-OG 2.81Å; W277-L281 HydrophobicContact CD2-CD1 4.3Å; W277-L281 HydrophobicContact CE3-CD1 3.45Å; W277-L281 VanDerWaalsContact CE3-CD1 3.45Å; W277-L281 HydrophobicContact CE3-CG 4.31Å; W277-L281 HydrophobicContact CH2-CD1 3.63Å; W277-L281 HydrophobicContact CZ2-CD1 4.4Å; W277-L281 HydrophobicContact CZ3-CD1 3.09Å; W277-L281 HydrophobicContact CZ3-CG 4.24Å; W277-L281 PolarHBondContact O-N 3.47Å
278	F	68.4	Low	62.2	Low	89 Å²	89	95.7 Å²	95.7	39%	0.39	46%	0.464	S	S	.	.	H	α-helix	trans	-59.1	-46	172.7	-70.7	-61.7	0	0	0	112.4	P244 A274 C275 S280 L281 E282	P244-F278 HydrophobicContact CG-CE1 4.13Å; P244-F278 HydrophobicContact CG-CZ 3.92Å; A274-F278 HydrophobicContact CB-CE2 4.35Å; A274-F278 WeakPolarHBondContact O-CD2 3.34Å; A274-F278 PolarHBondContact O-N 3.46Å; C275-F278 PolarHBondContact O-N 3.5Å; F278-S280 VanDerWaalsContact C-N 3.31Å; F278-S280 PolarHBondContact O-N 3.12Å; F278-L281 CarbonylContact O-C 3.56Å; F278-L281 WeakPolarHBondContact O-CB 3.44Å; F278-L281 PolarHBondContact O-N 3.32Å; F278-L281 VanDerWaalsContact O-N 3.16Å; F278-E282 VanDerWaalsContact O-CB 3.31Å; F278-E282 WeakPolarHBondContact O-CB 3.45Å; F278-E282 WeakPolarHBondContact O-CG 3.31Å; F278-E282 PolarHBondContact O-N 2.91Å
279	L	63.7	Low	60.3	Low	82 Å²	82	97.4 Å²	97.4	43%	0.429	48%	0.477	S	S	.	.	H	α-helix	trans	-65.4	-31	176.8	-70.8	170.5	0	0	0	112.9	C275 R276 W277 E282 Q283	C275-L279 VanDerWaalsContact O-CB 3.24Å; C275-L279 WeakPolarHBondContact O-CB 3.3Å; C275-L279 WeakPolarHBondContact O-CG 3.41Å; C275-L279 PolarHBondContact O-N 3Å; R276-L279 PolarHBondContact O-N 3.45Å; W277-L279 PolarHBondContact O-N 3.25Å; L279-E282 CarbonylContact O-C 3.56Å; L279-E282 VanDerWaalsContact O-C 3.32Å; L279-E282 PolarHBondContact O-N 3.43Å; L279-Q283 PolarHBondContact O-N 2.86Å
280	S	60.6	Low	58.2	Low	65 Å²	65	102.7 Å²	102.7	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-73.8	-29	174.6	71.4	0	0	0	0	112.6	R276 W277 F278	R276-S280 VanDerWaalsContact O-CB 3.24Å; R276-S280 WeakPolarHBondContact O-CB 3.49Å; R276-S280 PolarHBondContact O-N 2.9Å; R276-S280 PolarHBondContact O-OG 2.91Å; W277-S280 WeakPolarHBondContact CA-OG 3.47Å; W277-S280 PolarHBondContact O-N 3.07Å; W277-S280 PolarHBondContact O-OG 2.81Å; F278-S280 VanDerWaalsContact C-N 3.31Å; F278-S280 PolarHBondContact O-N 3.12Å
281	L	56.3	Low	56.1	Low	95 Å²	95	105.8 Å²	105.8	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-74.1	-37.9	165.5	-73.3	171.1	0	0	0	111.3	W277 F278 Q283 Y284	W277-L281 HydrophobicContact CD2-CD1 4.3Å; W277-L281 HydrophobicContact CE3-CD1 3.45Å; W277-L281 VanDerWaalsContact CE3-CD1 3.45Å; W277-L281 HydrophobicContact CE3-CG 4.31Å; W277-L281 HydrophobicContact CH2-CD1 3.63Å; W277-L281 HydrophobicContact CZ2-CD1 4.4Å; W277-L281 HydrophobicContact CZ3-CD1 3.09Å; W277-L281 HydrophobicContact CZ3-CG 4.24Å; W277-L281 PolarHBondContact O-N 3.47Å; F278-L281 CarbonylContact O-C 3.56Å; F278-L281 WeakPolarHBondContact O-CB 3.44Å; F278-L281 PolarHBondContact O-N 3.32Å; F278-L281 VanDerWaalsContact O-N 3.16Å; L281-Q283 VanDerWaalsContact C-N 3.25Å; L281-Q283 PolarHBondContact O-N 2.91Å; L281-Y284 PolarHBondContact O-N 3.44Å; L281-Y284 VanDerWaalsContact O-N 3.14Å
282	E	45.6	Very low	53.9	Low	82 Å²	82	110.5 Å²	110.5	38%	0.383	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-81.9	12.2	179.3	-75.9	-178.4	166.4	0	0	114.4	F278 L279 Y284 L285 C286	F278-E282 VanDerWaalsContact O-CB 3.31Å; F278-E282 WeakPolarHBondContact O-CB 3.45Å; F278-E282 WeakPolarHBondContact O-CG 3.31Å; F278-E282 PolarHBondContact O-N 2.91Å; L279-E282 CarbonylContact O-C 3.56Å; L279-E282 VanDerWaalsContact O-C 3.32Å; L279-E282 PolarHBondContact O-N 3.43Å; E282-Y284 PolarHBondContact O-N 2.87Å; E282-Y284 VanDerWaalsContact O-N 3.08Å; E282-L285 VanDerWaalsContact CB-O 3.32Å; E282-L285 WeakPolarHBondContact CB-O 3.47Å; E282-L285 VanDerWaalsContact CG-O 3.23Å; E282-L285 WeakPolarHBondContact CG-O 3.48Å; E282-L285 CarbonylContact O-C 3.58Å; E282-L285 PolarHBondContact O-N 3.02Å; E282-C286 PolarHBondContact O-N 3.5Å
283	Q	46	Very low	52.3	Low	175 Å²	175	116.6 Å²	116.6	82%	0.818	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-57.6	-9.5	147.5	-93.8	-178.4	-16	0	0	111.8	L279 L281	L279-Q283 PolarHBondContact O-N 2.86Å; L281-Q283 VanDerWaalsContact C-N 3.25Å; L281-Q283 PolarHBondContact O-N 2.91Å
284	Y	41.7	Very low	50.3	Low	211 Å²	211	121.7 Å²	121.7	83%	0.827	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-95.3	-14.3	162.8	-79.9	-83.2	0	0	0	116.5	L281 E282	L281-Y284 PolarHBondContact O-N 3.44Å; L281-Y284 VanDerWaalsContact O-N 3.14Å; E282-Y284 PolarHBondContact O-N 2.87Å; E282-Y284 VanDerWaalsContact O-N 3.08Å
285	L	35	Very low	48.3	Very low	136 Å²	136	128.3 Å²	128.3	71%	0.712	60%	0.602	S	S	*	*	S	Bend	trans	-167.4	92.8	177.4	-107.4	127.7	0	0	0	113.4	E282	E282-L285 VanDerWaalsContact CB-O 3.32Å; E282-L285 WeakPolarHBondContact CB-O 3.47Å; E282-L285 VanDerWaalsContact CG-O 3.23Å; E282-L285 WeakPolarHBondContact CG-O 3.48Å; E282-L285 CarbonylContact O-C 3.58Å; E282-L285 PolarHBondContact O-N 3.02Å
286	C	32	Very low	46.5	Very low	104 Å²	104	134.1 Å²	134.1	70%	0.703	63%	0.631	S	S	*	*			trans	51.5	105.3	154	-74.7	0	0	0	0	120	E282 Y288	E282-C286 PolarHBondContact O-N 3.5Å; C286-Y288 PolarHBondContact O-N 2.96Å
287	V	41.5	Very low	44.8	Very low	111 Å²	111	128.6 Å²	128.6	67%	0.673	63%	0.628	S	S	*	*			trans	-4.6	112.7	135.3	-173.6	0	0	0	0	114.5
288	Y	37.6	Very low	43.5	Very low	183 Å²	183	130.7 Å²	130.7	72%	0.718	65%	0.648	S	S	*	*			trans	163.7	134.3	133.2	-109.3	-93.1	0	0	0	110.8	C286	C286-Y288 PolarHBondContact O-N 2.96Å
289	I	40	Very low	41.5	Very low	145 Å²	145	136 Å²	136	74%	0.744	67%	0.672	S	S	*	*			trans	157.1	131.5	133	-77.7	154.9	0	0	0	111.3
290	Y	40.5	Very low	39.9	Very low	190 Å²	190	142.5 Å²	142.5	75%	0.745	69%	0.692	S	S	*	*			trans	-107.7	160.4	179.8	-167.4	-93.8	0	0	0	112
291	I	38.9	Very low	38.4	Very low	67 Å²	67	144.4 Å²	144.4	34%	0.344	70%	0.701	S	S	.	*			trans	-60.3	136.9	-172.4	-63.1	161.4	0	0	0	114.5	K268 E271	K268-I291 HydrophobicContact CG-CD1 4.43Å; E271-I291 HydrophobicContact CB-CD1 4.17Å; E271-I291 HydrophobicContact CB-CG1 4.43Å
292	N	36	Very low	37.1	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	71%	0.711	S	S	*	*			trans	-167.1	104.3	148.8	-107	-45.2	0	0	0	111.5
293	R	43.5	Very low	36.6	Very low	204 Å²	204	151.6 Å²	151.6	77%	0.77	73%	0.727	S	S	*	*			trans	-151.4	75.4	171.4	-75.4	-165.7	177.5	157.6	-0.8	113.4
294	R	37.2	Very low	35.7	Very low	167 Å²	167	152.5 Å²	152.5	63%	0.63	73%	0.725	S	S	*	*	S	Bend	trans	-139.6	-28.1	152.3	-118.4	176.7	-172	166.7	4	115.4
295	D	36.4	Very low	35.4	Very low	140 Å²	140	156 Å²	156	75%	0.749	74%	0.744	S	S	*	*	S	Bend	trans	-118.4	76	-169.2	-60.3	-29.2	0	0	0	114.3
296	N	33.6	Very low	35.4	Very low	164 Å²	164	157.1 Å²	157.1	88%	0.877	75%	0.746	S	S	*	*			trans	94.2	144.3	162.8	-45.7	-61.5	0	0	0	117.6
297	G	36.8	Very low	35.6	Very low	57 Å²	57	159.8 Å²	159.8	59%	0.588	75%	0.748	S	S	*	*	S	Bend	trans	-59.3	159.2	-164.4	0	0	0	0	0	117.4
298	V	41.3	Very low	35.3	Very low	120 Å²	120	162.6 Å²	162.6	73%	0.727	75%	0.752	S	S	*	*			trans	20.9	103.5	159.3	-169.4	0	0	0	0	116.2	Y300	V298-Y300 HydrophobicContact CG1-CD2 4.05Å; V298-Y300 HydrophobicContact CG1-CE2 4.19Å
299	F	27.5	Very low	35.1	Very low	202 Å²	202	161.4 Å²	161.4	89%	0.886	75%	0.754	S	S	*	*			trans	-128.1	113.3	148.9	-80.4	-86.9	0	0	0	109.1
300	Y	29.7	Very low	34.8	Very low	217 Å²	217	162.4 Å²	162.4	85%	0.851	76%	0.755	S	S	*	*			trans	-63.1	133.4	164.2	-83.3	-94.4	0	0	0	108.9	V298	V298-Y300 HydrophobicContact CG1-CD2 4.05Å; V298-Y300 HydrophobicContact CG1-CE2 4.19Å
301	V	29.7	Very low	34.4	Very low	105 Å²	105	160.5 Å²	160.5	64%	0.636	76%	0.756	S	S	*	*			trans	-95.3	114.1	163.9	-175.5	0	0	0	0	107.9	F303	V301-F303 HydrophobicContact CB-CE2 4.31Å; V301-F303 HydrophobicContact CB-CZ 4.46Å; V301-F303 HydrophobicContact CG1-CE1 4.41Å; V301-F303 HydrophobicContact CG1-CE2 4.23Å; V301-F303 HydrophobicContact CG1-CZ 4.08Å
302	K	29.1	Very low	34.1	Very low	163 Å²	163	167.2 Å²	167.2	71%	0.709	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.3	164.9	-100.7	178.2	173.1	176.3	0	108.7	Y304	K302-Y304 HydrophobicContact CB-CE2 4.48Å; K302-Y304 HydrophobicContact CD-CE2 4.32Å
303	F	33.6	Very low	34	Very low	166 Å²	166	168 Å²	168	73%	0.728	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-102.2	122.1	163.3	-65.6	-83.6	0	0	0	108.6	V301	V301-F303 HydrophobicContact CB-CE2 4.31Å; V301-F303 HydrophobicContact CB-CZ 4.46Å; V301-F303 HydrophobicContact CG1-CE1 4.41Å; V301-F303 HydrophobicContact CG1-CE2 4.23Å; V301-F303 HydrophobicContact CG1-CZ 4.08Å
304	Y	28.6	Very low	33.2	Very low	194 Å²	194	165 Å²	165	76%	0.761	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-82.8	148.9	165.6	-74.9	-91.4	0	0	0	108.7	K302	K302-Y304 HydrophobicContact CB-CE2 4.48Å; K302-Y304 HydrophobicContact CD-CE2 4.32Å
305	K	34.6	Very low	32.8	Very low	285 Å²	285	164.8 Å²	164.8	100%	1.239	80%	0.796	S	S	*	*			trans	-42.3	0	-173.3	-75.9	-178.1	175.5	-179.7	0	115.1

Retrieved 305 of 305 residues in 239.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).