A0A077Z0U5_TRITR Loading...

CAP domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0U5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 386 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	45.9	Very low	240 Å²	240	165.5 Å²	165.5	100%	1.182	86%	0.862	S	S	*	*				0	65.7	0	-60.4	171.4	85.2	0	0	106.2
2	D	40.4	Very low	46.2	Very low	165 Å²	165	163.6 Å²	163.6	88%	0.882	85%	0.852	S	S	*	*				51.3	125.6	73.9	-144.5	2.4	0	0	0	116.3
3	S	45.4	Very low	46.7	Very low	105 Å²	105	158.8 Å²	158.8	73%	0.734	84%	0.84	S	S	*	*			trans	62.3	75.2	168.5	-173.7	0	0	0	0	119.8
4	G	43	Very low	46.7	Very low	82 Å²	82	155.5 Å²	155.5	85%	0.845	83%	0.828	S	S	*	*			trans	-113.5	-5.6	162.8	0	0	0	0	0	115.9
5	K	45.4	Very low	46.7	Very low	208 Å²	208	152.7 Å²	152.7	90%	0.904	82%	0.824	S	S	*	*	S	Bend	trans	-116.2	56.8	-170.8	-69.4	-172.3	176.8	179.8	0	113.3
6	M	48.7	Very low	46.8	Very low	171 Å²	171	150.1 Å²	150.1	84%	0.842	82%	0.819	S	S	*	*			trans	-160.3	53	169.5	-147	163.4	78.5	0	0	116.1
7	K	44.5	Very low	46.7	Very low	204 Å²	204	148.1 Å²	148.1	89%	0.887	81%	0.813	S	S	*	*	S	Bend	trans	-143.9	19.6	172.8	-76.6	-161.8	178.7	179.1	0	118.3
8	I	51.7	Low	46.6	Very low	149 Å²	149	148.2 Å²	148.2	76%	0.764	81%	0.811	S	S	*	*	S	Bend	trans	-122.2	7.5	177.6	-64.9	175.1	0	0	0	114.1	L10	I8-L10 PolarHBondContact O-N 2.77Å
9	F	48.8	Very low	46.8	Very low	192 Å²	192	148.9 Å²	148.9	84%	0.842	81%	0.813	S	S	*	*	G	3₁₀ helix	trans	-78.9	-1.5	167.5	-89.8	-77.6	0	0	0	114.4
10	L	50.5	Low	46.8	Very low	152 Å²	152	145.2 Å²	145.2	80%	0.796	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-83.6	-10	177.6	-133.5	87.1	0	0	0	114.1	I8	I8-L10 PolarHBondContact O-N 2.77Å
11	L	49.3	Very low	46.7	Very low	153 Å²	153	147.6 Å²	147.6	80%	0.801	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-86.3	-10.5	-177.8	-118.7	93.8	0	0	0	114.6
12	L	48.8	Very low	47.3	Very low	142 Å²	142	142.1 Å²	142.1	74%	0.743	79%	0.785	S	S	*	*	S	Bend	trans	-93.3	-4.6	-178.1	-98.8	145.4	0	0	0	114.3
13	C	52.7	Low	47.8	Very low	102 Å²	102	143.2 Å²	143.2	69%	0.689	78%	0.783	S	S	*	*	S	Bend	trans	-101.9	-8.2	-174.7	-145.7	0	0	0	0	114.8
14	V	46.4	Very low	48.5	Very low	112 Å²	112	140.3 Å²	140.3	68%	0.679	77%	0.765	S	S	*	*	S	Bend	trans	-92	-10.8	-177.8	-175.7	0	0	0	0	113.2
15	C	46.8	Very low	50	Low	113 Å²	113	144.2 Å²	144.2	76%	0.764	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-10.8	174.9	-100.3	0	0	0	0	114.6
16	C	48.4	Very low	52	Low	111 Å²	111	137.5 Å²	137.5	75%	0.75	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-2.7	-175.8	-75	0	0	0	0	115.5
17	T	46.2	Very low	54	Low	117 Å²	117	137.8 Å²	137.8	72%	0.718	73%	0.727	S	S	*	*			trans	-112.1	11.1	178.3	56.2	0	0	0	0	114.6	L19	T17-L19 PolarHBondContact O-N 2.77Å
18	L	44.7	Very low	56.4	Low	149 Å²	149	131.1 Å²	131.1	78%	0.78	70%	0.704	S	S	*	*			trans	-77.5	72.8	150.6	-74.2	162.1	0	0	0	107.1	A20	L18-A20 PolarHBondContact O-N 2.72Å
19	L	49.5	Very low	58.4	Low	162 Å²	162	125.8 Å²	125.8	85%	0.848	68%	0.677	S	S	*	*			trans	-58.5	77.9	144.1	-73.1	167.2	0	0	0	105.1	T17 K21	T17-L19 PolarHBondContact O-N 2.77Å; L19-K21 PolarHBondContact O-N 3.37Å
20	A	47	Very low	60.6	Low	75 Å²	75	120 Å²	120	62%	0.62	66%	0.659	S	S	*	*			trans	-53.9	103.2	159.9	0	0	0	0	0	103	L18 V22	L18-A20 PolarHBondContact O-N 2.72Å; A20-V22 PolarHBondContact O-N 3.08Å
21	K	45.2	Very low	62.5	Low	195 Å²	195	113.3 Å²	113.3	85%	0.848	62%	0.624	S	S	*	*			trans	-47.7	98.4	151	-76.5	179.6	176.5	-179.6	0	102.6	L19 K23	L19-K21 PolarHBondContact O-N 3.37Å; K21-K23 PolarHBondContact O-N 2.62Å
22	V	49.6	Very low	64	Low	125 Å²	125	109 Å²	109	76%	0.758	60%	0.604	S	S	*	*			trans	-55.6	100.8	167.4	175	0	0	0	0	101.5	A20 A24	A20-V22 PolarHBondContact O-N 3.08Å; V22-A24 PolarHBondContact O-N 3.41Å
23	K	50.7	Low	65.4	Low	189 Å²	189	105 Å²	105	82%	0.822	60%	0.597	S	S	*	*			trans	-52.1	117.4	171.8	-78	-176.5	176.5	-178.1	0	102.9	K21 Q25	K21-K23 PolarHBondContact O-N 2.62Å; K23-Q25 VanDerWaalsContact C-N 3.34Å; K23-Q25 WeakPolarHBondContact O-CA 3.32Å; K23-Q25 PolarHBondContact O-N 2.86Å
24	A	60.2	Low	66.2	Low	43 Å²	43	101.4 Å²	101.4	36%	0.355	57%	0.571	S	S	.	*			trans	-49.9	106.7	-176.9	0	0	0	0	0	106.5	V22 N26	V22-A24 PolarHBondContact O-N 3.41Å; A24-N26 PolarHBondContact O-N 2.7Å
25	Q	74	Confident	68	Low	165 Å²	165	97.8 Å²	97.8	77%	0.771	55%	0.547	S	S	*	.			trans	-74.1	120.1	-168.5	-175.5	172.8	-11.6	0	0	106.5	K23 R27	K23-Q25 VanDerWaalsContact C-N 3.34Å; K23-Q25 WeakPolarHBondContact O-CA 3.32Å; K23-Q25 PolarHBondContact O-N 2.86Å; Q25-R27 PolarHBondContact O-N 2.96Å
26	N	87.2	Confident	69.9	Low	67 Å²	67	93.3 Å²	93.3	36%	0.358	52%	0.515	S	S	.	.			trans	-53.6	123.2	175	-70.5	-12.4	0	0	0	109	A24 C77 R155 C156 D157	A24-N26 PolarHBondContact O-N 2.7Å; N26-C77 HydrophobicContact CB-CB 4.28Å; N26-C77 VanDerWaalsContact CB-SG 3.58Å; N26-C77 VanDerWaalsContact CG-SG 3.54Å; N26-C77 WeakPolarHBondContact ND2-CB 3.37Å; N26-R155 CarbonylContact C-O 3.58Å; N26-R155 VanDerWaalsContact CA-O 3.28Å; N26-R155 WeakPolarHBondContact CA-O 3.34Å; N26-C156 WeakPolarHBondContact OD1-CA 3.48Å; N26-D157 PolarHBondContact OD1-N 2.66Å
27	R	91.2	Very high	71.3	Confident	176 Å²	176	90.7 Å²	90.7	66%	0.664	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.9	-172.5	-179.7	-173.8	165.7	-173.7	-1.6	110.2	Q25 D29 R155	Q25-R27 PolarHBondContact O-N 2.96Å; R27-D29 PolarHBondContact O-N 3Å; R27-R155 PolarHBondContact N-O 3.27Å; R27-R155 PolarHBondContact O-N 3.22Å
28	P	94.7	Very high	72.9	Confident	65 Å²	65	85.2 Å²	85.2	42%	0.422	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	127.8	164.5	-28.3	37.2	0	0	0	111.4	N75	P28-N75 WeakPolarHBondContact CB-OD1 3.43Å; P28-N75 HydrophobicContact CG-CB 4.38Å
29	D	94	Very high	75	Confident	36 Å²	36	78.1 Å²	78.1	19%	0.193	42%	0.419	C	S	.	.			trans	-139.4	71.9	175.2	177	16.8	0	0	0	108.8	R27 R153 R155	R27-D29 PolarHBondContact O-N 3Å; D29-R153 CarbonylContact C-O 3.6Å; D29-R153 VanDerWaalsContact CG-NH2 3.28Å; D29-R153 PolarHBondContact N-O 3.21Å; D29-R153 CarbonylContact O-C 3.58Å; D29-R153 VanDerWaalsContact O-CB 3.23Å; D29-R153 WeakPolarHBondContact O-CB 3.46Å; D29-R153 WeakPolarHBondContact O-CG 3.17Å; D29-R153 PolarHBondContact O-NE 3.31Å; D29-R153 PolarHBondContact O-NH2 3.18Å; D29-R153 VanDerWaalsContact O-O 3.07Å; D29-R153 IonicContact OD1-CZ 3.28Å; D29-R153 IonicContact OD1-NE 3.79Å; D29-R153 IonicContact OD1-NH2 2.76Å; D29-R153 PolarHBondContact OD1-NH2 2.98Å; D29-R153 IonicContact OD2-CZ 3.94Å; D29-R153 IonicContact OD2-NE 3.5Å; D29-R153 PolarHBondContact OD2-NE 3.33Å; D29-R153 VanDerWaalsContact OD2-NE 3.12Å; D29-R153 IonicContact OD2-NH2 3.01Å; D29-R153 PolarHBondContact OD2-NH2 3.32Å; D29-R155 HydrophobicContact CB-CG 3.97Å; D29-R155 IonicContact OD2-CZ 3.46Å; D29-R155 IonicContact OD2-NE 3.57Å; D29-R155 PolarHBondContact OD2-NE 2.92Å; D29-R155 IonicContact OD2-NH2 2.69Å; D29-R155 PolarHBondContact OD2-NH2 3.17Å
30	P	95.4	Very high	76.5	Confident	70 Å²	70	70.7 Å²	70.7	46%	0.455	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-59.1	147.6	-173.3	-21.7	32.8	0	0	0	113.1	T32 Q71	P30-T32 PolarHBondContact O-N 3.21Å; P30-Q71 VanDerWaalsContact CA-OE1 3.23Å; P30-Q71 HydrophobicContact CB-CG 4.28Å; P30-Q71 HydrophobicContact CG-CG 4.18Å
31	L	90.1	Very high	77.9	Confident	13 Å²	13	67.9 Å²	67.9	7%	0.068	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-66.1	134.9	172.7	-60.8	-172.6	0	0	0	109.9	Q35 Q36 M39 L106 C151 R153	L31-Q35 HydrophobicContact CB-CB 3.83Å; L31-Q35 HydrophobicContact CD2-CB 4.11Å; L31-Q35 HydrophobicContact CG-CB 4.39Å; L31-Q36 HydrophobicContact CB-CG 4.1Å; L31-M39 HydrophobicContact CD1-CG 3.98Å; L31-L106 HydrophobicContact CD2-CD1 3.82Å; L31-C151 HydrophobicContact CD1-CB 3.74Å; L31-R153 HydrophobicContact CD2-CB 3.63Å; L31-R153 HydrophobicContact CD2-CG 4.28Å; L31-R153 HydrophobicContact CG-CB 4Å
32	T	82.1	Confident	79.8	Confident	61 Å²	61	59.2 Å²	59.2	37%	0.374	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-65.7	161.9	171.2	66.8	0	0	0	0	110.8	P30 L34 Q35 Q36	P30-T32 PolarHBondContact O-N 3.21Å; T32-L34 PolarHBondContact O-N 3.03Å; T32-L34 VanDerWaalsContact O-N 3.15Å; T32-Q35 WeakPolarHBondContact O-CA 3.29Å; T32-Q35 PolarHBondContact O-N 2.89Å; T32-Q35 WeakPolarHBondContact OG1-CG 3.34Å; T32-Q35 PolarHBondContact OG1-N 2.73Å; T32-Q36 WeakPolarHBondContact O-CG 3.44Å; T32-Q36 PolarHBondContact O-N 2.64Å
33	G	77.3	Confident	81.6	Confident	59 Å²	59	53.3 Å²	53.3	61%	0.608	28%	0.281	S	S	*	.	H	α-helix	trans	-54.5	-35.2	175.7	0	0	0	0	0	112.9	Y37	G33-Y37 PolarHBondContact O-N 2.78Å
34	L	70	Confident	82.9	Confident	27 Å²	27	44.6 Å²	44.6	14%	0.141	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-52.1	169.5	163.1	62.6	0	0	0	112.3	T32 Q36 Y37 T38 R332 V378 W381	T32-L34 PolarHBondContact O-N 3.03Å; T32-L34 VanDerWaalsContact O-N 3.15Å; L34-Q36 VanDerWaalsContact C-N 3.26Å; L34-Q36 PolarHBondContact O-N 2.98Å; L34-Y37 CarbonylContact O-C 3.46Å; L34-Y37 WeakPolarHBondContact O-CA 3.33Å; L34-Y37 WeakPolarHBondContact O-CB 3.28Å; L34-Y37 PolarHBondContact O-N 3.27Å; L34-T38 PolarHBondContact O-N 2.78Å; L34-T38 PolarHBondContact O-OG1 2.82Å; L34-R332 WeakPolarHBondContact CD1-O 3.44Å; L34-V378 HydrophobicContact CD2-CB 3.27Å; L34-V378 HydrophobicContact CD2-CG1 3.46Å; L34-V378 VanDerWaalsContact CD2-CG1 3.46Å; L34-V378 HydrophobicContact CD2-CG2 3.77Å; L34-W381 HydrophobicContact CD2-CZ2 4.12Å
35	Q	83.5	Confident	83.6	Confident	36 Å²	36	44.2 Å²	44.2	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-64.1	-34	-177.4	-74.8	173.8	-27.8	0	0	111.9	L31 T32 T38 M39 L106	L31-Q35 HydrophobicContact CB-CB 3.83Å; L31-Q35 HydrophobicContact CD2-CB 4.11Å; L31-Q35 HydrophobicContact CG-CB 4.39Å; T32-Q35 WeakPolarHBondContact O-CA 3.29Å; T32-Q35 PolarHBondContact O-N 2.89Å; T32-Q35 WeakPolarHBondContact OG1-CG 3.34Å; T32-Q35 PolarHBondContact OG1-N 2.73Å; Q35-T38 PolarHBondContact O-N 3.11Å; Q35-M39 WeakPolarHBondContact O-CG 3.32Å; Q35-M39 PolarHBondContact O-N 3.01Å; Q35-L106 HydrophobicContact CB-CD2 4.09Å; Q35-L106 HydrophobicContact CG-CD2 4.1Å
36	Q	86.2	Confident	84	Confident	19 Å²	19	36.6 Å²	36.6	9%	0.089	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-49.8	168.6	-65.4	-71.6	-7.4	0	0	110.5	L31 T32 L34 T38 M39 L40 L62 C151	L31-Q36 HydrophobicContact CB-CG 4.1Å; T32-Q36 WeakPolarHBondContact O-CG 3.44Å; T32-Q36 PolarHBondContact O-N 2.64Å; L34-Q36 VanDerWaalsContact C-N 3.26Å; L34-Q36 PolarHBondContact O-N 2.98Å; Q36-T38 VanDerWaalsContact C-N 3.33Å; Q36-T38 PolarHBondContact O-N 3.1Å; Q36-M39 WeakPolarHBondContact O-CA 2.95Å; Q36-M39 WeakPolarHBondContact O-CB 3.35Å; Q36-M39 PolarHBondContact O-N 2.95Å; Q36-L40 PolarHBondContact O-N 2.91Å; Q36-L62 HydrophobicContact CB-CD1 3.63Å; Q36-L62 HydrophobicContact CB-CD2 4Å; Q36-L62 HydrophobicContact CB-CG 4.44Å; Q36-L62 WeakPolarHBondContact O-CD2 3.38Å; Q36-C151 PolarHBondContact NE2-O 3.21Å; Q36-C151 PolarHBondContact OE1-O 3.16Å
37	Y	78.8	Confident	83.7	Confident	55 Å²	55	33.6 Å²	33.6	22%	0.216	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-39.9	-179.7	-161.9	-92.2	0	0	0	111.7	G33 L34 M39 L40 M41 L62 V336	G33-Y37 PolarHBondContact O-N 2.78Å; L34-Y37 CarbonylContact O-C 3.46Å; L34-Y37 WeakPolarHBondContact O-CA 3.33Å; L34-Y37 WeakPolarHBondContact O-CB 3.28Å; L34-Y37 PolarHBondContact O-N 3.27Å; Y37-M39 VanDerWaalsContact C-N 3.3Å; Y37-M39 PolarHBondContact O-N 2.9Å; Y37-L40 HydrophobicContact CD2-CD2 4.33Å; Y37-L40 HydrophobicContact CE2-CD2 4.19Å; Y37-L40 WeakPolarHBondContact O-CB 3.44Å; Y37-L40 PolarHBondContact O-N 3.45Å; Y37-M41 HydrophobicContact CD1-CG 3.85Å; Y37-M41 HydrophobicContact CE1-CG 3.7Å; Y37-M41 HydrophobicContact CE1-SD 3.87Å; Y37-M41 VanDerWaalsContact O-CG 3.27Å; Y37-M41 WeakPolarHBondContact O-CG 3.22Å; Y37-M41 PolarHBondContact O-N 3.48Å; Y37-L62 HydrophobicContact CD2-CD1 4.21Å; Y37-V336 HydrophobicContact CD1-CG2 4.23Å; Y37-V336 HydrophobicContact CE1-CG2 3.76Å
38	T	79.3	Confident	82.8	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-42.7	171.2	-60.6	0	0	0	0	111.4	L34 Q35 Q36 M41 L42 L106 E334	L34-T38 PolarHBondContact O-N 2.78Å; L34-T38 PolarHBondContact O-OG1 2.82Å; Q35-T38 PolarHBondContact O-N 3.11Å; Q36-T38 VanDerWaalsContact C-N 3.33Å; Q36-T38 PolarHBondContact O-N 3.1Å; T38-M41 PolarHBondContact O-N 3.21Å; T38-L42 HydrophobicContact CG2-CD1 3.88Å; T38-L42 HydrophobicContact CG2-CG 4.15Å; T38-L42 WeakPolarHBondContact O-CB 3.44Å; T38-L42 VanDerWaalsContact O-CG 3.3Å; T38-L42 WeakPolarHBondContact O-CG 3.23Å; T38-L42 PolarHBondContact O-N 2.87Å; T38-L106 HydrophobicContact CG2-CD2 3.9Å; T38-E334 HydrophobicContact CG2-CB 3.94Å
39	M	87.9	Confident	81.8	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-45.6	176.1	-74.8	-59.8	-74.4	0	0	112.5	L31 Q35 Q36 Y37 M41 L42 H43 L106 Y109 C151 V162 C164	L31-M39 HydrophobicContact CD1-CG 3.98Å; Q35-M39 WeakPolarHBondContact O-CG 3.32Å; Q35-M39 PolarHBondContact O-N 3.01Å; Q36-M39 WeakPolarHBondContact O-CA 2.95Å; Q36-M39 WeakPolarHBondContact O-CB 3.35Å; Q36-M39 PolarHBondContact O-N 2.95Å; Y37-M39 VanDerWaalsContact C-N 3.3Å; Y37-M39 PolarHBondContact O-N 2.9Å; M39-M41 VanDerWaalsContact C-N 3.28Å; M39-M41 PolarHBondContact O-N 2.8Å; M39-L42 PolarHBondContact O-N 2.99Å; M39-L42 HydrophobicContact SD-CD1 4.5Å; M39-H43 PolarHBondContact O-N 2.98Å; M39-H43 VanDerWaalsContact O-N 3.1Å; M39-H43 PolarHBondContact O-ND1 3.37Å; M39-L106 HydrophobicContact CG-CG 4.07Å; M39-L106 HydrophobicContact SD-CB 3.91Å; M39-L106 HydrophobicContact SD-CG 3.73Å; M39-Y109 HydrophobicContact CE-CD1 3.67Å; M39-Y109 HydrophobicContact CE-CD2 4.49Å; M39-Y109 HydrophobicContact CE-CE1 4.17Å; M39-Y109 HydrophobicContact CE-CG 3.86Å; M39-C151 HydrophobicContact CG-CB 4.49Å; M39-V162 HydrophobicContact CE-CG1 4.31Å; M39-C164 WeakPolarHBondContact CE-SG 3.5Å
40	L	82.3	Confident	80.7	Confident	6 Å²	6	28.3 Å²	28.3	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-54.2	-47.3	174	170	66.7	0	0	0	111.3	Q36 Y37 H43 N44 F59 L62 V149	Q36-L40 PolarHBondContact O-N 2.91Å; Y37-L40 HydrophobicContact CD2-CD2 4.33Å; Y37-L40 HydrophobicContact CE2-CD2 4.19Å; Y37-L40 WeakPolarHBondContact O-CB 3.44Å; Y37-L40 PolarHBondContact O-N 3.45Å; L40-H43 PolarHBondContact O-N 2.86Å; L40-N44 PolarHBondContact O-N 3.4Å; L40-F59 HydrophobicContact CD1-CB 3.31Å; L40-F59 HydrophobicContact CD1-CG 4.46Å; L40-L62 HydrophobicContact CB-CD2 3.77Å; L40-L62 HydrophobicContact CB-CG 4.32Å; L40-L62 HydrophobicContact CD2-CD2 4.5Å; L40-L62 HydrophobicContact CD2-CG 4.2Å; L40-V149 HydrophobicContact CB-CG1 4.32Å; L40-V149 HydrophobicContact CD1-CG1 3.95Å
41	M	76.6	Confident	79	Confident	16 Å²	16	33.4 Å²	33.4	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-66.8	-45.4	-177.3	-66.7	-57.1	-50.1	0	0	112.3	Y37 T38 M39 H43 N44 E45 V336	Y37-M41 HydrophobicContact CD1-CG 3.85Å; Y37-M41 HydrophobicContact CE1-CG 3.7Å; Y37-M41 HydrophobicContact CE1-SD 3.87Å; Y37-M41 VanDerWaalsContact O-CG 3.27Å; Y37-M41 WeakPolarHBondContact O-CG 3.22Å; Y37-M41 PolarHBondContact O-N 3.48Å; T38-M41 PolarHBondContact O-N 3.21Å; M39-M41 VanDerWaalsContact C-N 3.28Å; M39-M41 PolarHBondContact O-N 2.8Å; M41-H43 VanDerWaalsContact C-N 3.3Å; M41-H43 PolarHBondContact O-N 2.81Å; M41-N44 PolarHBondContact O-N 3.12Å; M41-E45 WeakPolarHBondContact O-CB 3.39Å; M41-E45 PolarHBondContact O-N 2.85Å; M41-V336 HydrophobicContact CE-CG2 4.12Å; M41-V336 HydrophobicContact CG-CG2 3.66Å; M41-V336 HydrophobicContact SD-CG2 4.12Å
42	L	83.8	Confident	77.5	Confident	14 Å²	14	39.9 Å²	39.9	7%	0.073	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-38.6	178.2	-71.3	171.9	0	0	0	112.1	T38 M39 E45 E46 L106 M110	T38-L42 HydrophobicContact CG2-CD1 3.88Å; T38-L42 HydrophobicContact CG2-CG 4.15Å; T38-L42 WeakPolarHBondContact O-CB 3.44Å; T38-L42 VanDerWaalsContact O-CG 3.3Å; T38-L42 WeakPolarHBondContact O-CG 3.23Å; T38-L42 PolarHBondContact O-N 2.87Å; M39-L42 PolarHBondContact O-N 2.99Å; M39-L42 HydrophobicContact SD-CD1 4.5Å; L42-E45 PolarHBondContact O-N 2.85Å; L42-E46 WeakPolarHBondContact O-CG 3.22Å; L42-E46 PolarHBondContact O-N 3.24Å; L42-L106 HydrophobicContact CD1-CB 4.26Å; L42-M110 HydrophobicContact CB-CE 4.5Å; L42-M110 HydrophobicContact CB-CG 3.78Å; L42-M110 HydrophobicContact CB-SD 4.16Å; L42-M110 HydrophobicContact CD1-CG 4.05Å; L42-M110 HydrophobicContact CG-CG 4.46Å; L42-M110 WeakPolarHBondContact O-CE 3.4Å
43	H	87.4	Confident	76.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-50.5	174.6	-78.4	70	0	0	0	111.4	M39 L40 M41 E45 E46 R47 F59 Y109 Y166	M39-H43 PolarHBondContact O-N 2.98Å; M39-H43 VanDerWaalsContact O-N 3.1Å; M39-H43 PolarHBondContact O-ND1 3.37Å; L40-H43 PolarHBondContact O-N 2.86Å; M41-H43 VanDerWaalsContact C-N 3.3Å; M41-H43 PolarHBondContact O-N 2.81Å; H43-E45 VanDerWaalsContact C-N 3.34Å; H43-E45 PolarHBondContact O-N 3.39Å; H43-E46 PolarHBondContact O-N 3.03Å; H43-R47 WeakPolarHBondContact O-CB 3.18Å; H43-R47 WeakPolarHBondContact O-CD 3.34Å; H43-R47 WeakPolarHBondContact O-CG 3.3Å; H43-R47 PolarHBondContact O-N 2.92Å; H43-F59 HydrophobicContact CB-CD2 3.63Å; H43-F59 HydrophobicContact CB-CE2 3.87Å; H43-F59 AromaticContact CD2-CE2 3.64Å; H43-Y109 AromaticContact CE1-CE1 3.98Å; H43-Y109 AromaticContact NE2-CE1 3.9Å; H43-Y166 AromaticContact CD2-CE1 3.74Å; H43-Y166 AromaticContact NE2-CE1 3.41Å; H43-Y166 WeakPolarHBondContact NE2-CE1 3.48Å; H43-Y166 AromaticContact NE2-CZ 3.49Å; H43-Y166 PolarHBondContact NE2-OH 3.35Å
44	N	78.8	Confident	74.9	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.032	20%	0.196	C	C	.	.	H	α-helix	trans	-66.5	-35.8	-179.5	-76.7	-17.6	0	0	0	112.4	L40 M41 R48 F59 C227	L40-N44 PolarHBondContact O-N 3.4Å; M41-N44 PolarHBondContact O-N 3.12Å; N44-R48 PolarHBondContact O-N 2.96Å; N44-R48 VanDerWaalsContact O-N 3.12Å; N44-F59 PolarHBondContact ND2-O 2.99Å; N44-F59 PolarHBondContact OD1-N 2.85Å; N44-C227 HydrophobicContact CB-CB 3.78Å; N44-C227 WeakPolarHBondContact O-CB 3.39Å
45	E	75.7	Confident	74.1	Confident	36 Å²	36	45 Å²	45	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-45.1	175	-164.3	-160	142	0	0	111.7	M41 L42 H43 R48 K49	M41-E45 WeakPolarHBondContact O-CB 3.39Å; M41-E45 PolarHBondContact O-N 2.85Å; L42-E45 PolarHBondContact O-N 2.85Å; H43-E45 VanDerWaalsContact C-N 3.34Å; H43-E45 PolarHBondContact O-N 3.39Å; E45-R48 PolarHBondContact O-N 3.22Å; E45-K49 PolarHBondContact O-N 2.93Å; E45-K49 VanDerWaalsContact OE1-CE 3.28Å; E45-K49 WeakPolarHBondContact OE1-CE 3.33Å; E45-K49 IonicContact OE1-NZ 3.47Å; E45-K49 PolarHBondContact OE1-NZ 2.66Å
46	E	81.2	Confident	73.4	Confident	5 Å²	5	43.7 Å²	43.7	2%	0.023	21%	0.21	C	C	.	.	H	α-helix	trans	-70.9	-42.3	179.5	-72.5	-55.3	146.2	0	0	112.5	L42 H43 R48 K49 M110 R114 F142	L42-E46 WeakPolarHBondContact O-CG 3.22Å; L42-E46 PolarHBondContact O-N 3.24Å; H43-E46 PolarHBondContact O-N 3.03Å; E46-R48 PolarHBondContact O-N 3.39Å; E46-K49 PolarHBondContact O-N 3.27Å; E46-K49 IonicContact OE1-NZ 2.66Å; E46-K49 PolarHBondContact OE1-NZ 2.88Å; E46-M110 HydrophobicContact CB-CE 3.73Å; E46-M110 HydrophobicContact CG-CB 4.49Å; E46-M110 HydrophobicContact CG-CE 3.49Å; E46-M110 VanDerWaalsContact CG-CE 3.49Å; E46-R114 HydrophobicContact CG-CG 4.29Å; E46-R114 WeakPolarHBondContact OE1-CD 2.88Å; E46-R114 IonicContact OE1-CZ 3.64Å; E46-R114 IonicContact OE1-NE 3.11Å; E46-R114 IonicContact OE1-NH1 3.1Å; E46-R114 PolarHBondContact OE1-NH1 2.74Å; E46-R114 WeakPolarHBondContact OE2-CD 3.46Å; E46-R114 WeakPolarHBondContact OE2-CG 2.97Å; E46-F142 HydrophobicContact CB-CE1 3.9Å; E46-F142 HydrophobicContact CB-CZ 3.98Å
47	R	80.7	Confident	72.6	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-56	-41.1	174.7	-69.2	167.7	76.6	84.7	-2.2	110.9	H43 K49 I50 M56 E57 V141 W143 F144	H43-R47 WeakPolarHBondContact O-CB 3.18Å; H43-R47 WeakPolarHBondContact O-CD 3.34Å; H43-R47 WeakPolarHBondContact O-CG 3.3Å; H43-R47 PolarHBondContact O-N 2.92Å; R47-K49 VanDerWaalsContact C-N 3.28Å; R47-K49 PolarHBondContact O-N 3.4Å; R47-I50 PolarHBondContact O-N 2.8Å; R47-M56 HydrophobicContact CB-CE 3.73Å; R47-M56 HydrophobicContact CB-CG 4.18Å; R47-M56 HydrophobicContact CB-SD 3.75Å; R47-M56 HydrophobicContact CG-CE 4.26Å; R47-M56 HydrophobicContact CG-CG 4.25Å; R47-M56 HydrophobicContact CG-SD 3.64Å; R47-M56 WeakPolarHBondContact O-CE 3.4Å; R47-E57 PolarHBondContact NE-O 3.49Å; R47-E57 PolarHBondContact NH2-O 2.67Å; R47-V141 WeakPolarHBondContact CD-O 3.1Å; R47-V141 WeakPolarHBondContact CG-O 3.35Å; R47-V141 PolarHBondContact NH1-O 3.47Å; R47-W143 PolarHBondContact NH1-O 2.77Å; R47-W143 PolarHBondContact NH2-O 2.81Å; R47-F144 PolarHBondContact NH2-O 2.85Å
48	R	73	Confident	72.4	Confident	65 Å²	65	45.1 Å²	45.1	25%	0.245	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-31.5	177.1	-177.6	-177.6	64	-127.9	6.4	114	N44 E45 E46 I50 P229	N44-R48 PolarHBondContact O-N 2.96Å; N44-R48 VanDerWaalsContact O-N 3.12Å; E45-R48 PolarHBondContact O-N 3.22Å; E46-R48 PolarHBondContact O-N 3.39Å; R48-I50 PolarHBondContact O-N 3.35Å; R48-P229 PolarHBondContact NH1-O 3.01Å
49	K	74.3	Confident	72.5	Confident	78 Å²	78	45.5 Å²	45.5	34%	0.339	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.2	-177.3	-67.7	170.6	-168.7	168.1	0	112.9	E45 E46 R47 E51	E45-K49 PolarHBondContact O-N 2.93Å; E45-K49 VanDerWaalsContact OE1-CE 3.28Å; E45-K49 WeakPolarHBondContact OE1-CE 3.33Å; E45-K49 IonicContact OE1-NZ 3.47Å; E45-K49 PolarHBondContact OE1-NZ 2.66Å; E46-K49 PolarHBondContact O-N 3.27Å; E46-K49 IonicContact OE1-NZ 2.66Å; E46-K49 PolarHBondContact OE1-NZ 2.88Å; R47-K49 VanDerWaalsContact C-N 3.28Å; R47-K49 PolarHBondContact O-N 3.4Å; K49-E51 PolarHBondContact O-N 3.32Å
50	I	69.4	Low	72	Confident	22 Å²	22	50.6 Å²	50.6	11%	0.113	25%	0.247	C	C	.	.			trans	-87.6	91.4	-177.3	-48.2	-45.5	0	0	0	110.3	R47 R48 N52 Q53 M56 L117 F142	R47-I50 PolarHBondContact O-N 2.8Å; R48-I50 PolarHBondContact O-N 3.35Å; I50-N52 VanDerWaalsContact C-N 3.26Å; I50-N52 PolarHBondContact O-N 3.06Å; I50-Q53 HydrophobicContact CB-CB 4.46Å; I50-Q53 HydrophobicContact CG2-CB 3.75Å; I50-Q53 HydrophobicContact CG2-CG 3.68Å; I50-Q53 PolarHBondContact O-N 3.49Å; I50-M56 HydrophobicContact CB-CE 3.68Å; I50-M56 HydrophobicContact CG1-CE 3.73Å; I50-M56 HydrophobicContact CG2-CE 4.43Å; I50-L117 HydrophobicContact CD1-CD1 3.63Å; I50-L117 HydrophobicContact CD1-CD2 3.34Å; I50-L117 HydrophobicContact CD1-CG 4.15Å; I50-L117 HydrophobicContact CG1-CD2 4.19Å; I50-F142 HydrophobicContact CD1-CD1 4.09Å; I50-F142 HydrophobicContact CD1-CE1 3.74Å; I50-F142 HydrophobicContact CD1-CZ 4.48Å; I50-F142 HydrophobicContact CG1-CD1 3.69Å; I50-F142 HydrophobicContact CG1-CE1 3.77Å
51	E	60.8	Low	71.8	Confident	178 Å²	178	54.5 Å²	54.5	83%	0.832	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-27.9	-178	-61.9	-180	171.8	0	0	113.3	K49	K49-E51 PolarHBondContact O-N 3.32Å
52	N	58.3	Low	72.1	Confident	148 Å²	148	56 Å²	56	79%	0.791	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	4.8	-174.4	-64.7	-34.5	0	0	0	114.3	I50	I50-N52 VanDerWaalsContact C-N 3.26Å; I50-N52 PolarHBondContact O-N 3.06Å
53	Q	55.6	Low	72.4	Confident	47 Å²	47	57.1 Å²	57.1	22%	0.22	28%	0.281	C	S	.	.			trans	-120.4	94.3	178.5	-74.2	-168.2	-48.3	0	0	111.4	I50 N55 M56 Y122	I50-Q53 HydrophobicContact CB-CB 4.46Å; I50-Q53 HydrophobicContact CG2-CB 3.75Å; I50-Q53 HydrophobicContact CG2-CG 3.68Å; I50-Q53 PolarHBondContact O-N 3.49Å; Q53-N55 VanDerWaalsContact C-N 3.3Å; Q53-N55 PolarHBondContact O-N 3.28Å; Q53-M56 HydrophobicContact CB-CE 4.39Å; Q53-Y122 HydrophobicContact CG-CE1 3.97Å
54	I	49.4	Very low	72.7	Confident	102 Å²	102	63.2 Å²	63.2	52%	0.523	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-8.2	-174.9	60.6	173	0	0	0	115.2	Q224	I54-Q224 CarbonylContact O-C 3.59Å
55	N	53.4	Low	73.5	Confident	105 Å²	105	66.9 Å²	66.9	56%	0.561	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	31.5	-171.8	-70.6	-17.3	0	0	0	113.3	Q53 E57 F144	Q53-N55 VanDerWaalsContact C-N 3.3Å; Q53-N55 PolarHBondContact O-N 3.28Å; N55-E57 PolarHBondContact O-N 3.23Å; N55-F144 WeakPolarHBondContact O-CB 3.24Å
56	M	68.3	Low	74.6	Confident	9 Å²	9	65.3 Å²	65.3	4%	0.044	33%	0.325	C	S	.	.			trans	-90.9	107	-176.9	-171.2	159.5	40.2	0	0	111.8	R47 I50 Q53 F142 F144 V225	R47-M56 HydrophobicContact CB-CE 3.73Å; R47-M56 HydrophobicContact CB-CG 4.18Å; R47-M56 HydrophobicContact CB-SD 3.75Å; R47-M56 HydrophobicContact CG-CE 4.26Å; R47-M56 HydrophobicContact CG-CG 4.25Å; R47-M56 HydrophobicContact CG-SD 3.64Å; R47-M56 WeakPolarHBondContact O-CE 3.4Å; I50-M56 HydrophobicContact CB-CE 3.68Å; I50-M56 HydrophobicContact CG1-CE 3.73Å; I50-M56 HydrophobicContact CG2-CE 4.43Å; Q53-M56 HydrophobicContact CB-CE 4.39Å; M56-F142 HydrophobicContact SD-CB 4.4Å; M56-F142 HydrophobicContact SD-CD1 4.38Å; M56-F144 CarbonylContact C-O 3.54Å; M56-V225 VanDerWaalsContact O-CB 3.25Å; M56-V225 WeakPolarHBondContact O-CB 3.22Å; M56-V225 WeakPolarHBondContact O-CG1 3.47Å
57	E	69.7	Low	75.4	Confident	79 Å²	79	65.3 Å²	65.3	37%	0.369	33%	0.326	S	S	.	.			trans	-59.7	175.4	174	-65.7	-177.2	169	0	0	112.1	R47 N55 F144 E145 A146 C227	R47-E57 PolarHBondContact NE-O 3.49Å; R47-E57 PolarHBondContact NH2-O 2.67Å; N55-E57 PolarHBondContact O-N 3.23Å; E57-F144 VanDerWaalsContact CB-O 3.25Å; E57-F144 WeakPolarHBondContact CB-O 3.37Å; E57-F144 WeakPolarHBondContact CG-O 3.5Å; E57-F144 PolarHBondContact N-O 2.78Å; E57-E145 VanDerWaalsContact OE2-CA 3.25Å; E57-E145 WeakPolarHBondContact OE2-CA 3.32Å; E57-A146 HydrophobicContact CB-CB 4.18Å; E57-A146 PolarHBondContact OE2-N 3.08Å; E57-C227 PolarHBondContact O-SG 3.27Å
58	C	75.3	Confident	76.2	Confident	26 Å²	26	69.5 Å²	69.5	18%	0.176	35%	0.349	C	S	.	.			trans	-122.8	151.7	-175.8	-50.1	0	0	0	0	109.7	E60 F226 C227	C58-E60 PolarHBondContact O-N 3.13Å; C58-F226 PolarHBondContact SG-O 2.91Å; C58-F226 VanDerWaalsContact SG-O 3.35Å; C58-C227 WeakPolarHBondContact CA-SG 3.19Å; C58-C227 HydrophobicContact CB-CB 3.63Å; C58-C227 WeakPolarHBondContact CB-SG 3.49Å; C58-C227 WeakPolarHBondContact SG-CA 3.39Å; C58-C227 WeakPolarHBondContact SG-CB 3.38Å; C58-C227 PolarHBondContact SG-N 3.42Å; C58-C227 CovalentContact SG-SG 2.04Å; C58-C227 PolarHBondContact SG-SG 2.84Å
59	F	81	Confident	77.4	Confident	9 Å²	9	68.9 Å²	68.9	4%	0.039	35%	0.347	C	S	.	.			trans	-71	120.1	166.1	-66.8	-74	0	0	0	108.1	L40 H43 N44 A146 K147 V149 Y166	L40-F59 HydrophobicContact CD1-CB 3.31Å; L40-F59 HydrophobicContact CD1-CG 4.46Å; H43-F59 HydrophobicContact CB-CD2 3.63Å; H43-F59 HydrophobicContact CB-CE2 3.87Å; H43-F59 AromaticContact CD2-CE2 3.64Å; N44-F59 PolarHBondContact ND2-O 2.99Å; N44-F59 PolarHBondContact OD1-N 2.85Å; F59-A146 HydrophobicContact CD1-CB 3.91Å; F59-A146 HydrophobicContact CD2-CB 4.3Å; F59-A146 HydrophobicContact CE1-CB 3.79Å; F59-A146 HydrophobicContact CE2-CB 4.22Å; F59-A146 HydrophobicContact CG-CB 4.16Å; F59-A146 HydrophobicContact CZ-CB 3.96Å; F59-K147 CarbonylContact C-O 3.55Å; F59-V149 HydrophobicContact CB-CG1 4.3Å; F59-V149 HydrophobicContact CD1-CB 3.89Å; F59-V149 HydrophobicContact CD1-CG1 4.17Å; F59-V149 HydrophobicContact CE1-CB 4.14Å; F59-V149 HydrophobicContact CG-CB 4.34Å; F59-V149 HydrophobicContact CG-CG1 4.17Å; F59-Y166 AromaticContact CE1-CD1 3.55Å; F59-Y166 HydrophobicContact CE1-CD1 3.55Å; F59-Y166 HydrophobicContact CE1-CE1 4.14Å; F59-Y166 HydrophobicContact CE2-CD1 4.49Å; F59-Y166 HydrophobicContact CE2-CE1 4.33Å; F59-Y166 AromaticContact CZ-CD1 3.45Å; F59-Y166 HydrophobicContact CZ-CD1 3.45Å; F59-Y166 VanDerWaalsContact CZ-CD1 3.45Å; F59-Y166 AromaticContact CZ-CE1 3.66Å; F59-Y166 HydrophobicContact CZ-CE1 3.66Å
60	E	77.1	Confident	78.5	Confident	108 Å²	108	65.1 Å²	65.1	51%	0.505	33%	0.331	S	S	.	.			trans	-74.9	-41.1	-177	-63.7	178.9	175.4	0	0	111.3	C58 K147 Y148	C58-E60 PolarHBondContact O-N 3.13Å; E60-K147 PolarHBondContact N-O 3.42Å; E60-Y148 HydrophobicContact CB-CD1 4.39Å; E60-Y148 HydrophobicContact CB-CE1 4.01Å; E60-Y148 WeakPolarHBondContact OE2-CE1 3.45Å; E60-Y148 PolarHBondContact OE2-OH 3.25Å
61	N	77.4	Confident	79.9	Confident	87 Å²	87	65 Å²	65	47%	0.465	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	172.8	-175.6	-148.2	-22.1	0	0	0	112.1	Y148 V149	N61-Y148 HydrophobicContact CB-CD1 4.07Å; N61-Y148 HydrophobicContact CB-CE1 4.17Å; N61-Y148 WeakPolarHBondContact O-CA 2.91Å; N61-V149 PolarHBondContact O-N 2.69Å
62	L	83.7	Confident	81.7	Confident	49 Å²	49	59 Å²	59	26%	0.257	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	147.7	165.3	-62.2	172.6	0	0	0	111.1	Q36 Y37 L40 V149	Q36-L62 HydrophobicContact CB-CD1 3.63Å; Q36-L62 HydrophobicContact CB-CD2 4Å; Q36-L62 HydrophobicContact CB-CG 4.44Å; Q36-L62 WeakPolarHBondContact O-CD2 3.38Å; Y37-L62 HydrophobicContact CD2-CD1 4.21Å; L40-L62 HydrophobicContact CB-CD2 3.77Å; L40-L62 HydrophobicContact CB-CG 4.32Å; L40-L62 HydrophobicContact CD2-CD2 4.5Å; L40-L62 HydrophobicContact CD2-CG 4.2Å; L62-V149 WeakPolarHBondContact CA-O 3.47Å; L62-V149 HydrophobicContact CD2-CG1 4.41Å
63	N	90.2	Very high	83.5	Confident	36 Å²	36	53 Å²	53	19%	0.193	28%	0.275	C	S	.	.			trans	-125	121.1	169.2	-179	-66.1	0	0	0	110.2	T65 L66 A67 Y148 V149	N63-T65 VanDerWaalsContact C-N 3.34Å; N63-T65 PolarHBondContact O-N 3.5Å; N63-T65 WeakPolarHBondContact OD1-CA 3.43Å; N63-T65 VanDerWaalsContact OD1-CB 3.24Å; N63-T65 WeakPolarHBondContact OD1-CB 3.09Å; N63-T65 PolarHBondContact OD1-N 2.89Å; N63-L66 HydrophobicContact CB-CB 4.21Å; N63-L66 HydrophobicContact CB-CD1 3.9Å; N63-L66 HydrophobicContact CB-CG 3.91Å; N63-L66 WeakPolarHBondContact O-CB 3.07Å; N63-L66 PolarHBondContact O-N 2.82Å; N63-L66 PolarHBondContact OD1-N 3.48Å; N63-A67 PolarHBondContact O-N 3.1Å; N63-Y148 HydrophobicContact CB-CD2 4.45Å; N63-Y148 HydrophobicContact CB-CG 4.12Å; N63-V149 PolarHBondContact N-O 3.5Å
64	Q	92.7	Very high	85.5	Confident	128 Å²	128	50.8 Å²	50.8	60%	0.598	27%	0.265	S	S	*	.	H	α-helix	trans	-64.3	-37.3	-176	-169.9	60.2	47.5	0	0	112.3	L66 A67 D68	Q64-L66 VanDerWaalsContact C-N 3.32Å; Q64-L66 PolarHBondContact O-N 3.29Å; Q64-A67 PolarHBondContact O-N 3.08Å; Q64-D68 PolarHBondContact NE2-OD1 3.34Å; Q64-D68 WeakPolarHBondContact O-CB 3.45Å; Q64-D68 PolarHBondContact O-N 3.16Å
65	T	96.9	Very high	87.8	Confident	83 Å²	83	49 Å²	49	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-39.1	176.2	-52.7	0	0	0	0	111.8	N63 Y69	N63-T65 VanDerWaalsContact C-N 3.34Å; N63-T65 PolarHBondContact O-N 3.5Å; N63-T65 WeakPolarHBondContact OD1-CA 3.43Å; N63-T65 VanDerWaalsContact OD1-CB 3.24Å; N63-T65 WeakPolarHBondContact OD1-CB 3.09Å; N63-T65 PolarHBondContact OD1-N 2.89Å; T65-Y69 VanDerWaalsContact O-CB 3.31Å; T65-Y69 WeakPolarHBondContact O-CB 3.48Å; T65-Y69 PolarHBondContact O-N 3.44Å
66	L	97.8	Very high	89.8	Confident	3 Å²	3	50 Å²	50	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-43.2	173.5	-64.2	-177.2	0	0	0	111.5	N63 Q64 Y69 A70 Y91 Y148 A165	N63-L66 HydrophobicContact CB-CB 4.21Å; N63-L66 HydrophobicContact CB-CD1 3.9Å; N63-L66 HydrophobicContact CB-CG 3.91Å; N63-L66 WeakPolarHBondContact O-CB 3.07Å; N63-L66 PolarHBondContact O-N 2.82Å; N63-L66 PolarHBondContact OD1-N 3.48Å; Q64-L66 VanDerWaalsContact C-N 3.32Å; Q64-L66 PolarHBondContact O-N 3.29Å; L66-Y69 PolarHBondContact O-N 3.03Å; L66-A70 WeakPolarHBondContact O-CB 3.42Å; L66-A70 PolarHBondContact O-N 3.37Å; L66-Y91 HydrophobicContact CD2-CD1 3.33Å; L66-Y91 HydrophobicContact CD2-CD2 3.88Å; L66-Y91 HydrophobicContact CD2-CE1 3.49Å; L66-Y91 VanDerWaalsContact CD2-CE1 3.49Å; L66-Y91 HydrophobicContact CD2-CE2 4.02Å; L66-Y91 HydrophobicContact CD2-CG 3.54Å; L66-Y148 WeakPolarHBondContact CD1-O 3.36Å; L66-A165 HydrophobicContact CB-CB 4.07Å; L66-A165 HydrophobicContact CD2-CB 4.19Å
67	A	97.7	Very high	91.1	Very high	5 Å²	5	50 Å²	50	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-45.7	177.8	0	0	0	0	0	111.8	N63 Q64 Y69 A70 Q71	N63-A67 PolarHBondContact O-N 3.1Å; Q64-A67 PolarHBondContact O-N 3.08Å; A67-Y69 PolarHBondContact O-N 3.42Å; A67-A70 PolarHBondContact O-N 3.21Å; A67-Q71 VanDerWaalsContact O-CB 3.24Å; A67-Q71 WeakPolarHBondContact O-CB 3.46Å; A67-Q71 PolarHBondContact O-N 3.27Å
68	D	98	Very high	92.2	Very high	92 Å²	92	47.7 Å²	47.7	49%	0.492	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-41.6	177.5	-65.7	-19.9	0	0	0	111.4	Q64 Q71 S72	Q64-D68 PolarHBondContact NE2-OD1 3.34Å; Q64-D68 WeakPolarHBondContact O-CB 3.45Å; Q64-D68 PolarHBondContact O-N 3.16Å; D68-Q71 PolarHBondContact O-N 2.98Å; D68-S72 WeakPolarHBondContact O-CB 3.36Å; D68-S72 PolarHBondContact O-N 3.28Å
69	Y	98.2	Very high	92.8	Very high	52 Å²	52	52.2 Å²	52.2	20%	0.204	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-52	175.3	-178.4	-107.4	0	0	0	111.3	T65 L66 A67 Q71 S72 L73 S89 Y91 L93 A165	T65-Y69 VanDerWaalsContact O-CB 3.31Å; T65-Y69 WeakPolarHBondContact O-CB 3.48Å; T65-Y69 PolarHBondContact O-N 3.44Å; L66-Y69 PolarHBondContact O-N 3.03Å; A67-Y69 PolarHBondContact O-N 3.42Å; Y69-Q71 VanDerWaalsContact C-N 3.27Å; Y69-Q71 PolarHBondContact O-N 3.48Å; Y69-S72 WeakPolarHBondContact O-CB 3.5Å; Y69-S72 PolarHBondContact O-N 3.5Å; Y69-S72 VanDerWaalsContact O-N 3.13Å; Y69-S72 PolarHBondContact O-OG 3.48Å; Y69-L73 HydrophobicContact CD1-CD1 4.26Å; Y69-L73 HydrophobicContact CE1-CD1 3.8Å; Y69-L73 WeakPolarHBondContact O-CG 3.36Å; Y69-L73 PolarHBondContact O-N 3.12Å; Y69-S89 WeakPolarHBondContact CE1-OG 3.27Å; Y69-S89 PolarHBondContact OH-OG 2.91Å; Y69-Y91 AromaticContact CD1-CD2 3.49Å; Y69-Y91 HydrophobicContact CD1-CD2 3.49Å; Y69-Y91 VanDerWaalsContact CD1-CD2 3.49Å; Y69-Y91 HydrophobicContact CD1-CE2 4.12Å; Y69-Y91 HydrophobicContact CD2-CE2 4.49Å; Y69-Y91 AromaticContact CE1-CD2 3.72Å; Y69-Y91 HydrophobicContact CE1-CD2 3.72Å; Y69-Y91 AromaticContact CG-CD2 3.91Å; Y69-Y91 HydrophobicContact CG-CD2 3.91Å; Y69-Y91 HydrophobicContact CG-CE2 4.06Å; Y69-L93 HydrophobicContact CD1-CD2 4.21Å; Y69-L93 HydrophobicContact CE1-CD1 4.09Å; Y69-L93 HydrophobicContact CE1-CD2 3.85Å; Y69-L93 HydrophobicContact CE1-CG 4.28Å; Y69-A165 HydrophobicContact CD1-CB 4.11Å
70	A	98.5	Very high	93.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-39.9	177.1	0	0	0	0	0	112.1	L66 A67 L73 A74 I163 A165	L66-A70 WeakPolarHBondContact O-CB 3.42Å; L66-A70 PolarHBondContact O-N 3.37Å; A67-A70 PolarHBondContact O-N 3.21Å; A70-L73 PolarHBondContact O-N 3.25Å; A70-A74 PolarHBondContact O-N 3.01Å; A70-I163 HydrophobicContact CB-CG2 4.29Å; A70-I163 WeakPolarHBondContact CB-O 3.27Å; A70-A165 HydrophobicContact CB-CB 4.02Å
71	Q	98.5	Very high	93.8	Very high	20 Å²	20	53.3 Å²	53.3	9%	0.093	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-41.7	176	-172.3	59.4	51.3	0	0	112	P30 A67 D68 Y69 L73 A74 N75 R153	P30-Q71 VanDerWaalsContact CA-OE1 3.23Å; P30-Q71 HydrophobicContact CB-CG 4.28Å; P30-Q71 HydrophobicContact CG-CG 4.18Å; A67-Q71 VanDerWaalsContact O-CB 3.24Å; A67-Q71 WeakPolarHBondContact O-CB 3.46Å; A67-Q71 PolarHBondContact O-N 3.27Å; D68-Q71 PolarHBondContact O-N 2.98Å; Y69-Q71 VanDerWaalsContact C-N 3.27Å; Y69-Q71 PolarHBondContact O-N 3.48Å; Q71-L73 PolarHBondContact O-N 2.73Å; Q71-A74 PolarHBondContact O-N 2.74Å; Q71-N75 PolarHBondContact NE2-OD1 3.03Å; Q71-N75 PolarHBondContact O-N 2.85Å; Q71-N75 PolarHBondContact O-ND2 3.31Å; Q71-N75 PolarHBondContact O-OD1 3.02Å; Q71-R153 PolarHBondContact NE2-O 3.39Å; Q71-R153 PolarHBondContact OE1-O 2.92Å
72	S	97.6	Very high	94.3	Very high	52 Å²	52	52.9 Å²	52.9	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-35.5	176.8	80.1	0	0	0	0	112.2	D68 Y69 N76	D68-S72 WeakPolarHBondContact O-CB 3.36Å; D68-S72 PolarHBondContact O-N 3.28Å; Y69-S72 WeakPolarHBondContact O-CB 3.5Å; Y69-S72 PolarHBondContact O-N 3.5Å; Y69-S72 VanDerWaalsContact O-N 3.13Å; Y69-S72 PolarHBondContact O-OG 3.48Å; S72-N76 PolarHBondContact O-ND2 3.26Å; S72-N76 VanDerWaalsContact O-ND2 3.08Å
73	L	97.6	Very high	94.4	Very high	21 Å²	21	54.4 Å²	54.4	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-72.5	-45	175.2	-58.5	-178.2	0	0	0	111.4	Y69 A70 Q71 N75 N76 P78 F85 L93 I163	Y69-L73 HydrophobicContact CD1-CD1 4.26Å; Y69-L73 HydrophobicContact CE1-CD1 3.8Å; Y69-L73 WeakPolarHBondContact O-CG 3.36Å; Y69-L73 PolarHBondContact O-N 3.12Å; A70-L73 PolarHBondContact O-N 3.25Å; Q71-L73 PolarHBondContact O-N 2.73Å; L73-N75 VanDerWaalsContact C-N 3.27Å; L73-N75 PolarHBondContact O-N 2.78Å; L73-N76 PolarHBondContact O-N 2.74Å; L73-N76 VanDerWaalsContact O-N 3.17Å; L73-P78 VanDerWaalsContact O-CD 3.28Å; L73-P78 WeakPolarHBondContact O-CD 3.45Å; L73-F85 HydrophobicContact CD1-CE1 3.91Å; L73-F85 HydrophobicContact CD1-CZ 3.9Å; L73-F85 HydrophobicContact CD2-CE1 4.27Å; L73-F85 HydrophobicContact CD2-CE2 4.43Å; L73-F85 HydrophobicContact CD2-CZ 3.55Å; L73-F85 HydrophobicContact CG-CZ 4.36Å; L73-L93 HydrophobicContact CD1-CD1 3.63Å; L73-L93 HydrophobicContact CD1-CD2 3.82Å; L73-L93 HydrophobicContact CD1-CG 4.41Å; L73-I163 HydrophobicContact CB-CD1 3.79Å
74	A	97.6	Very high	94.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-37.4	-179.7	0	0	0	0	0	111.8	A70 Q71 N76 C77 A154 I163	A70-A74 PolarHBondContact O-N 3.01Å; Q71-A74 PolarHBondContact O-N 2.74Å; A74-N76 PolarHBondContact O-N 3.21Å; A74-N76 VanDerWaalsContact O-N 3.1Å; A74-C77 PolarHBondContact O-N 2.86Å; A74-A154 HydrophobicContact CB-CB 4.04Å; A74-A154 WeakPolarHBondContact O-CB 3.3Å; A74-I163 HydrophobicContact CB-CD1 4.22Å; A74-I163 HydrophobicContact CB-CG1 4.32Å
75	N	96.9	Very high	94.1	Very high	65 Å²	65	54.6 Å²	54.6	35%	0.348	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-28.2	178.1	-70.4	-13.7	0	0	0	113.7	P28 Q71 L73 C77	P28-N75 WeakPolarHBondContact CB-OD1 3.43Å; P28-N75 HydrophobicContact CG-CB 4.38Å; Q71-N75 PolarHBondContact NE2-OD1 3.03Å; Q71-N75 PolarHBondContact O-N 2.85Å; Q71-N75 PolarHBondContact O-ND2 3.31Å; Q71-N75 PolarHBondContact O-OD1 3.02Å; L73-N75 VanDerWaalsContact C-N 3.27Å; L73-N75 PolarHBondContact O-N 2.78Å; N75-C77 VanDerWaalsContact C-N 3.3Å
76	N	95.2	Very high	93.7	Very high	127 Å²	127	51.3 Å²	51.3	68%	0.679	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-2.7	179	-63	-49.7	0	0	0	113.2	S72 L73 A74	S72-N76 PolarHBondContact O-ND2 3.26Å; S72-N76 VanDerWaalsContact O-ND2 3.08Å; L73-N76 PolarHBondContact O-N 2.74Å; L73-N76 VanDerWaalsContact O-N 3.17Å; A74-N76 PolarHBondContact O-N 3.21Å; A74-N76 VanDerWaalsContact O-N 3.1Å
77	C	94.8	Very high	93.2	Very high	9 Å²	9	56.4 Å²	56.4	6%	0.061	30%	0.298	C	S	.	.			trans	45.6	56.1	-178.5	-74.3	0	0	0	0	113.7	N26 A74 N75 N79 C156	N26-C77 HydrophobicContact CB-CB 4.28Å; N26-C77 VanDerWaalsContact CB-SG 3.58Å; N26-C77 VanDerWaalsContact CG-SG 3.54Å; N26-C77 WeakPolarHBondContact ND2-CB 3.37Å; A74-C77 PolarHBondContact O-N 2.86Å; N75-C77 VanDerWaalsContact C-N 3.3Å; C77-N79 PolarHBondContact O-N 3.08Å; C77-C156 WeakPolarHBondContact CA-SG 3.01Å; C77-C156 HydrophobicContact CB-CB 3.58Å; C77-C156 WeakPolarHBondContact CB-SG 3.33Å; C77-C156 VanDerWaalsContact SG-CA 3.55Å; C77-C156 WeakPolarHBondContact SG-CB 3.45Å; C77-C156 CovalentContact SG-SG 2.03Å; C77-C156 PolarHBondContact SG-SG 3.35Å
78	P	93.5	Very high	92.8	Very high	29 Å²	29	60.2 Å²	60.2	19%	0.188	32%	0.324	C	S	.	.			trans	-57.9	139.8	179.6	24.6	-34.8	0	0	0	111.5	L73 E80 L81 K97 L161 I163	L73-P78 VanDerWaalsContact O-CD 3.28Å; L73-P78 WeakPolarHBondContact O-CD 3.45Å; P78-E80 VanDerWaalsContact C-N 3.29Å; P78-L81 HydrophobicContact CB-CD2 4.23Å; P78-L81 HydrophobicContact CG-CD2 3.98Å; P78-K97 PolarHBondContact O-NZ 3.22Å; P78-L161 HydrophobicContact CG-CD2 4.12Å; P78-I163 HydrophobicContact CG-CD1 4Å
79	N	88.8	Confident	92.5	Very high	121 Å²	121	56 Å²	56	65%	0.647	30%	0.302	S	S	*	.	S	Bend	trans	-64.7	-39.7	172.3	-80	-33.2	0	0	0	111.3	C77 K97	C77-N79 PolarHBondContact O-N 3.08Å; N79-K97 PolarHBondContact O-NZ 3.17Å
80	E	89.1	Confident	92.2	Very high	126 Å²	126	57.2 Å²	57.2	59%	0.589	32%	0.316	S	S	*	.			trans	-152.4	160	177.6	59.2	-179.8	-164.3	0	0	110.1	P78 Y95	P78-E80 VanDerWaalsContact C-N 3.29Å; E80-Y95 WeakPolarHBondContact CA-OH 3.46Å; E80-Y95 WeakPolarHBondContact CB-OH 3.46Å
81	L	88.7	Confident	92	Very high	14 Å²	14	59.6 Å²	59.6	7%	0.073	33%	0.325	C	S	.	.			trans	-98.8	98.7	164.3	-59.6	-176.3	0	0	0	107.8	P78 F85 L86 L93 Y95 I163	P78-L81 HydrophobicContact CB-CD2 4.23Å; P78-L81 HydrophobicContact CG-CD2 3.98Å; L81-F85 HydrophobicContact CB-CD1 4.41Å; L81-F85 HydrophobicContact CD2-CD1 4Å; L81-F85 HydrophobicContact CD2-CE1 3.93Å; L81-L86 HydrophobicContact CB-CD2 3.8Å; L81-L86 HydrophobicContact CB-CG 4.15Å; L81-L86 HydrophobicContact CD1-CD2 4.12Å; L81-L93 HydrophobicContact CD1-CB 4.16Å; L81-Y95 HydrophobicContact CB-CD1 3.96Å; L81-Y95 HydrophobicContact CB-CE1 4.05Å; L81-Y95 HydrophobicContact CD1-CD1 3.78Å; L81-Y95 HydrophobicContact CD1-CG 4.3Å; L81-Y95 HydrophobicContact CG-CD1 3.62Å; L81-Y95 HydrophobicContact CG-CE1 4.11Å; L81-Y95 HydrophobicContact CG-CG 4.22Å; L81-I163 HydrophobicContact CD1-CG2 4.37Å; L81-I163 HydrophobicContact CD2-CD1 4.49Å
82	N	88	Confident	91.7	Very high	78 Å²	78	58.7 Å²	58.7	42%	0.417	32%	0.321	S	S	.	.			trans	-69.2	160.7	-176.3	69.2	37.9	0	0	0	112.7	T84 F85 L86	N82-T84 VanDerWaalsContact C-N 3.28Å; N82-T84 PolarHBondContact O-N 3.05Å; N82-T84 PolarHBondContact OD1-N 3Å; N82-F85 PolarHBondContact O-N 3.48Å; N82-F85 VanDerWaalsContact O-N 3.08Å; N82-F85 VanDerWaalsContact OD1-CB 3.25Å; N82-F85 WeakPolarHBondContact OD1-CB 3.18Å; N82-F85 PolarHBondContact OD1-N 2Å; N82-L86 WeakPolarHBondContact O-CG 3.48Å; N82-L86 PolarHBondContact O-N 3.04Å
83	D	85.3	Confident	91.6	Very high	82 Å²	82	56.3 Å²	56.3	44%	0.439	30%	0.304	S	S	.	.	H	α-helix	trans	-57.9	-39	-174.1	-65.1	-38.2	0	0	0	112.3	L86 Q87 K132	D83-L86 PolarHBondContact O-N 3.37Å; D83-Q87 WeakPolarHBondContact O-CB 3.29Å; D83-Q87 WeakPolarHBondContact O-CG 3.46Å; D83-Q87 PolarHBondContact O-N 3.08Å; D83-K132 IonicContact OD2-NZ 2.69Å; D83-K132 PolarHBondContact OD2-NZ 2.85Å
84	T	88.2	Confident	91.4	Very high	104 Å²	104	55.3 Å²	55.3	64%	0.638	30%	0.299	S	S	*	.	H	α-helix	trans	-63.8	-43.2	177.1	-52.7	0	0	0	0	111.8	N82 Q87 S88	N82-T84 VanDerWaalsContact C-N 3.28Å; N82-T84 PolarHBondContact O-N 3.05Å; N82-T84 PolarHBondContact OD1-N 3Å; T84-Q87 PolarHBondContact O-N 3.08Å; T84-S88 WeakPolarHBondContact O-CB 3.31Å; T84-S88 PolarHBondContact O-N 3.42Å; T84-S88 PolarHBondContact O-OG 2.75Å
85	F	89.6	Confident	91.3	Very high	63 Å²	63	56.8 Å²	56.8	28%	0.276	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-47.5	178.4	179.8	-101.6	0	0	0	111.1	L73 L81 N82 Q87 S88 S89 L93	L73-F85 HydrophobicContact CD1-CE1 3.91Å; L73-F85 HydrophobicContact CD1-CZ 3.9Å; L73-F85 HydrophobicContact CD2-CE1 4.27Å; L73-F85 HydrophobicContact CD2-CE2 4.43Å; L73-F85 HydrophobicContact CD2-CZ 3.55Å; L73-F85 HydrophobicContact CG-CZ 4.36Å; L81-F85 HydrophobicContact CB-CD1 4.41Å; L81-F85 HydrophobicContact CD2-CD1 4Å; L81-F85 HydrophobicContact CD2-CE1 3.93Å; N82-F85 PolarHBondContact O-N 3.48Å; N82-F85 VanDerWaalsContact O-N 3.08Å; N82-F85 VanDerWaalsContact OD1-CB 3.25Å; N82-F85 WeakPolarHBondContact OD1-CB 3.18Å; N82-F85 PolarHBondContact OD1-N 2Å; F85-Q87 VanDerWaalsContact C-N 3.29Å; F85-Q87 PolarHBondContact O-N 2.97Å; F85-S88 PolarHBondContact O-N 2.95Å; F85-S88 VanDerWaalsContact O-N 3.09Å; F85-S88 PolarHBondContact O-OG 2.88Å; F85-S89 PolarHBondContact O-N 2.77Å; F85-L93 HydrophobicContact CD1-CD1 4.27Å; F85-L93 HydrophobicContact CE1-CD1 3.54Å; F85-L93 HydrophobicContact CZ-CD1 4.24Å
86	L	89.4	Confident	91.2	Very high	15 Å²	15	55 Å²	55	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-55.3	-45.5	174.2	-66.4	175.9	0	0	0	110.8	L81 N82 D83 S88 S89 L93 K169 I171	L81-L86 HydrophobicContact CB-CD2 3.8Å; L81-L86 HydrophobicContact CB-CG 4.15Å; L81-L86 HydrophobicContact CD1-CD2 4.12Å; N82-L86 WeakPolarHBondContact O-CG 3.48Å; N82-L86 PolarHBondContact O-N 3.04Å; D83-L86 PolarHBondContact O-N 3.37Å; L86-S88 PolarHBondContact O-N 2.89Å; L86-S89 PolarHBondContact O-N 2.94Å; L86-L93 HydrophobicContact CD2-CB 3.64Å; L86-L93 HydrophobicContact CD2-CD1 4.47Å; L86-K169 WeakPolarHBondContact O-CE 3.41Å; L86-K169 PolarHBondContact O-NZ 2.88Å; L86-I171 HydrophobicContact CB-CD1 4.32Å
87	Q	86.9	Confident	91.2	Very high	110 Å²	110	52.2 Å²	52.2	51%	0.514	28%	0.277	S	S	.	.	H	α-helix	trans	-63.9	-35.4	176.5	-74.7	174.4	5.4	0	0	113.6	D83 T84 F85 K169 I171	D83-Q87 WeakPolarHBondContact O-CB 3.29Å; D83-Q87 WeakPolarHBondContact O-CG 3.46Å; D83-Q87 PolarHBondContact O-N 3.08Å; T84-Q87 PolarHBondContact O-N 3.08Å; F85-Q87 VanDerWaalsContact C-N 3.29Å; F85-Q87 PolarHBondContact O-N 2.97Å; Q87-K169 PolarHBondContact O-NZ 2.86Å; Q87-I171 VanDerWaalsContact CA-CD1 3.47Å; Q87-I171 HydrophobicContact CB-CD1 4.17Å; Q87-I171 HydrophobicContact CG-CD1 3.66Å; Q87-I171 HydrophobicContact CG-CG2 4.33Å
88	S	89.5	Confident	91.1	Very high	84 Å²	84	51.9 Å²	51.9	59%	0.587	28%	0.275	S	S	*	.	H	α-helix	trans	-78.5	-21.3	177.9	71.2	0	0	0	0	114.5	T84 F85 L86	T84-S88 WeakPolarHBondContact O-CB 3.31Å; T84-S88 PolarHBondContact O-N 3.42Å; T84-S88 PolarHBondContact O-OG 2.75Å; F85-S88 PolarHBondContact O-N 2.95Å; F85-S88 VanDerWaalsContact O-N 3.09Å; F85-S88 PolarHBondContact O-OG 2.88Å; L86-S88 PolarHBondContact O-N 2.89Å
89	S	91.5	Very high	90.9	Very high	4 Å²	4	60.6 Å²	60.6	3%	0.028	31%	0.306	C	S	.	.			trans	-66	138.4	-176.4	-174	0	0	0	0	111.9	Y69 F85 L86 Y91 L93 K169	Y69-S89 WeakPolarHBondContact CE1-OG 3.27Å; Y69-S89 PolarHBondContact OH-OG 2.91Å; F85-S89 PolarHBondContact O-N 2.77Å; L86-S89 PolarHBondContact O-N 2.94Å; S89-Y91 PolarHBondContact O-N 2.71Å; S89-Y91 PolarHBondContact OG-N 2.99Å; S89-Y91 PolarHBondContact OG-O 3.04Å; S89-L93 WeakPolarHBondContact OG-CD1 3.29Å; S89-K169 PolarHBondContact O-NZ 3.21Å
90	P	90.7	Very high	90.7	Very high	77 Å²	77	56.1 Å²	56.1	50%	0.5	29%	0.288	S	S	.	.	S	Bend	trans	-68.9	-12.5	173	28.7	-34.9	0	0	0	113.4
91	Y	93.9	Very high	90.1	Very high	51 Å²	51	54 Å²	54	20%	0.2	28%	0.279	C	S	.	.	S	Bend	trans	-121.2	159.1	-175.6	-57.3	-57.1	0	0	0	111.3	L66 Y69 S89 Y166	L66-Y91 HydrophobicContact CD2-CD1 3.33Å; L66-Y91 HydrophobicContact CD2-CD2 3.88Å; L66-Y91 HydrophobicContact CD2-CE1 3.49Å; L66-Y91 VanDerWaalsContact CD2-CE1 3.49Å; L66-Y91 HydrophobicContact CD2-CE2 4.02Å; L66-Y91 HydrophobicContact CD2-CG 3.54Å; Y69-Y91 AromaticContact CD1-CD2 3.49Å; Y69-Y91 HydrophobicContact CD1-CD2 3.49Å; Y69-Y91 VanDerWaalsContact CD1-CD2 3.49Å; Y69-Y91 HydrophobicContact CD1-CE2 4.12Å; Y69-Y91 HydrophobicContact CD2-CE2 4.49Å; Y69-Y91 AromaticContact CE1-CD2 3.72Å; Y69-Y91 HydrophobicContact CE1-CD2 3.72Å; Y69-Y91 AromaticContact CG-CD2 3.91Å; Y69-Y91 HydrophobicContact CG-CD2 3.91Å; Y69-Y91 HydrophobicContact CG-CE2 4.06Å; S89-Y91 PolarHBondContact O-N 2.71Å; S89-Y91 PolarHBondContact OG-N 2.99Å; S89-Y91 PolarHBondContact OG-O 3.04Å; Y91-Y166 WeakPolarHBondContact CB-O 3.41Å
92	G	93	Very high	89.5	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	138.4	160.9	0	0	0	0	0	108.7	A165 Y166	G92-A165 CarbonylContact O-C 3.54Å; G92-A165 VanDerWaalsContact O-CA 3.25Å; G92-A165 WeakPolarHBondContact O-CA 3.49Å; G92-Y166 PolarHBondContact N-O 3.04Å; G92-Y166 PolarHBondContact O-N 3.23Å
93	L	95	Very high	89.2	Confident	3 Å²	3	57 Å²	57	2%	0.016	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135	-178.6	-76.8	-179.8	0	0	0	109.5	Y69 L73 L81 F85 L86 S89 N136 I163 C164 A165	Y69-L93 HydrophobicContact CD1-CD2 4.21Å; Y69-L93 HydrophobicContact CE1-CD1 4.09Å; Y69-L93 HydrophobicContact CE1-CD2 3.85Å; Y69-L93 HydrophobicContact CE1-CG 4.28Å; L73-L93 HydrophobicContact CD1-CD1 3.63Å; L73-L93 HydrophobicContact CD1-CD2 3.82Å; L73-L93 HydrophobicContact CD1-CG 4.41Å; L81-L93 HydrophobicContact CD1-CB 4.16Å; F85-L93 HydrophobicContact CD1-CD1 4.27Å; F85-L93 HydrophobicContact CE1-CD1 3.54Å; F85-L93 HydrophobicContact CZ-CD1 4.24Å; L86-L93 HydrophobicContact CD2-CB 3.64Å; L86-L93 HydrophobicContact CD2-CD1 4.47Å; S89-L93 WeakPolarHBondContact OG-CD1 3.29Å; L93-N136 PolarHBondContact O-ND2 3.49Å; L93-N136 PolarHBondContact O-OD1 3.45Å; L93-I163 HydrophobicContact CD2-CG2 4.24Å; L93-C164 WeakPolarHBondContact CA-O 3.44Å; L93-A165 HydrophobicContact CD2-CB 3.88Å
94	A	94.8	Very high	89.2	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.6	168.5	0	0	0	0	0	110.6	Y109 V137 Q140 I163 C164 Y166	A94-Y109 WeakPolarHBondContact CB-OH 3.33Å; A94-V137 HydrophobicContact CB-CB 4.27Å; A94-V137 HydrophobicContact CB-CG2 3.93Å; A94-Q140 HydrophobicContact CB-CB 4.07Å; A94-Q140 HydrophobicContact CB-CG 3.63Å; A94-I163 CarbonylContact O-C 3.48Å; A94-I163 WeakPolarHBondContact O-CA 3.15Å; A94-C164 PolarHBondContact N-O 3.37Å; A94-C164 VanDerWaalsContact N-O 3.08Å; A94-C164 PolarHBondContact O-N 3.12Å; A94-Y166 HydrophobicContact CB-CE2 4.19Å
95	Y	95.4	Very high	89.4	Confident	30 Å²	30	51.1 Å²	51.1	12%	0.118	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	149.5	-177.5	78.6	-79.3	0	0	0	111.7	E80 L81 A133 V137 L161 V162	E80-Y95 WeakPolarHBondContact CA-OH 3.46Å; E80-Y95 WeakPolarHBondContact CB-OH 3.46Å; L81-Y95 HydrophobicContact CB-CD1 3.96Å; L81-Y95 HydrophobicContact CB-CE1 4.05Å; L81-Y95 HydrophobicContact CD1-CD1 3.78Å; L81-Y95 HydrophobicContact CD1-CG 4.3Å; L81-Y95 HydrophobicContact CG-CD1 3.62Å; L81-Y95 HydrophobicContact CG-CE1 4.11Å; L81-Y95 HydrophobicContact CG-CG 4.22Å; Y95-A133 HydrophobicContact CE1-CB 4.11Å; Y95-A133 HydrophobicContact CE2-CB 4.45Å; Y95-V137 WeakPolarHBondContact O-CG2 3.34Å; Y95-L161 HydrophobicContact CD2-CD1 3.8Å; Y95-L161 HydrophobicContact CG-CD1 4.45Å; Y95-V162 CarbonylContact C-O 3.21Å; Y95-V162 WeakPolarHBondContact CA-O 3.33Å
96	N	94.9	Very high	89.5	Confident	29 Å²	29	48.4 Å²	48.4	16%	0.155	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	146.5	169.3	-179.4	-95.8	0	0	0	110.3	Y109 A112 V162	N96-Y109 HydrophobicContact CB-CD2 3.63Å; N96-Y109 HydrophobicContact CB-CE2 4.39Å; N96-Y109 HydrophobicContact CB-CG 4.18Å; N96-A112 HydrophobicContact CB-CB 4.47Å; N96-A112 WeakPolarHBondContact ND2-CB 3.41Å; N96-V162 PolarHBondContact N-O 3.16Å; N96-V162 PolarHBondContact O-N 2.69Å
97	K	93.9	Very high	89.4	Confident	67 Å²	67	52 Å²	52	29%	0.291	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	108.1	172.5	-71.6	178.9	174.8	179	0	108.7	P78 N79 T160 L161	P78-K97 PolarHBondContact O-NZ 3.22Å; N79-K97 PolarHBondContact O-NZ 3.17Å; K97-T160 CarbonylContact C-O 3.41Å; K97-T160 WeakPolarHBondContact CA-O 3.5Å; K97-L161 HydrophobicContact CG-CD1 3.78Å
98	A	92.5	Very high	89.7	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	134	171.2	0	0	0	0	0	109.9	G100 A103 E108 N159 T160	A98-G100 PolarHBondContact O-N 2.88Å; A98-A103 HydrophobicContact CB-CB 3.76Å; A98-E108 HydrophobicContact CB-CB 3.71Å; A98-E108 HydrophobicContact CB-CG 3.68Å; A98-N159 WeakPolarHBondContact O-CB 3.44Å; A98-T160 PolarHBondContact N-O 2.91Å; A98-T160 PolarHBondContact O-N 3.41Å
99	Y	89.8	Confident	89.9	Confident	211 Å²	211	45.4 Å²	45.4	83%	0.827	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.6	-179.2	-70.1	-73.5	0	0	0	111.4	N159	Y99-N159 WeakPolarHBondContact CA-OD1 3.3Å
100	G	84.3	Confident	89.9	Confident	27 Å²	27	45.3 Å²	45.3	28%	0.278	23%	0.233	S	C	.	.	S	Bend	trans	89.6	154.6	178.5	0	0	0	0	0	114.2	A98 T102 G158 T160	A98-G100 PolarHBondContact O-N 2.88Å; G100-T102 VanDerWaalsContact C-N 3.33Å; G100-G158 CarbonylContact C-O 3.09Å; G100-G158 VanDerWaalsContact C-O 3.26Å; G100-G158 WeakPolarHBondContact CA-O 2.95Å; G100-G158 PolarHBondContact N-O 3.08Å; G100-T160 PolarHBondContact O-N 3.09Å; G100-T160 PolarHBondContact O-OG1 2.97Å
101	M	76.5	Confident	89.9	Confident	82 Å²	82	46.1 Å²	46.1	40%	0.404	23%	0.231	S	C	.	.	S	Bend	trans	-85.9	-2.7	-177.7	-62.1	-73.1	-74.9	0	0	113.5	R155 G158	M101-R155 VanDerWaalsContact C-NH1 3.32Å; M101-R155 HydrophobicContact CE-CB 3.42Å; M101-R155 VanDerWaalsContact CE-CB 3.42Å; M101-R155 HydrophobicContact CE-CG 4.01Å; M101-R155 PolarHBondContact O-NH1 3.31Å; M101-R155 HydrophobicContact SD-CB 3.85Å; M101-G158 WeakPolarHBondContact CG-O 3.19Å; M101-G158 PolarHBondContact N-O 3.08Å; M101-G158 WeakPolarHBondContact SD-CA 2.96Å
102	T	76.6	Confident	89.8	Confident	140 Å²	140	44.4 Å²	44.4	86%	0.859	23%	0.227	S	C	*	.	S	Bend	trans	-100.8	-16.9	177.8	54.2	0	0	0	0	112.5	G100	G100-T102 VanDerWaalsContact C-N 3.33Å
103	A	81	Confident	89.8	Confident	14 Å²	14	44.4 Å²	44.4	12%	0.116	23%	0.227	C	C	.	.			trans	-58.9	143.2	174.9	0	0	0	0	0	110.6	A98 G105 E108 R155 T160	A98-A103 HydrophobicContact CB-CB 3.76Å; A103-G105 VanDerWaalsContact C-N 3.33Å; A103-E108 WeakPolarHBondContact CB-OE1 3.41Å; A103-R155 PolarHBondContact O-NH1 3.42Å; A103-T160 PolarHBondContact O-OG1 3.28Å
104	T	86.7	Confident	89.5	Confident	63 Å²	63	48.3 Å²	48.3	39%	0.387	24%	0.241	S	C	.	.			trans	-77.7	-29.2	173.3	66.4	0	0	0	0	110.6	L106 R153	T104-L106 VanDerWaalsContact C-N 3.26Å; T104-L106 WeakPolarHBondContact O-CD1 3.32Å; T104-L106 PolarHBondContact OG1-N 2.65Å; T104-R153 WeakPolarHBondContact O-CD 2.87Å; T104-R153 PolarHBondContact O-NH1 3.37Å
105	G	91.4	Very high	89.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	82.3	-2.9	-176.5	0	0	0	0	0	113.6	A103 E108 Y109	A103-G105 VanDerWaalsContact C-N 3.33Å; G105-E108 VanDerWaalsContact C-OE2 3.29Å; G105-E108 WeakPolarHBondContact CA-OE2 3.4Å; G105-E108 PolarHBondContact N-OE2 3.09Å; G105-E108 VanDerWaalsContact N-OE2 3.15Å; G105-Y109 VanDerWaalsContact O-CB 3.24Å; G105-Y109 WeakPolarHBondContact O-CB 3.08Å; G105-Y109 PolarHBondContact O-N 2.76Å
106	L	91	Very high	88.9	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-78.1	-52.5	-174.5	-80.4	56.3	0	0	0	110.7	L31 Q35 T38 M39 L42 T104 E108 M110	L31-L106 HydrophobicContact CD2-CD1 3.82Å; Q35-L106 HydrophobicContact CB-CD2 4.09Å; Q35-L106 HydrophobicContact CG-CD2 4.1Å; T38-L106 HydrophobicContact CG2-CD2 3.9Å; M39-L106 HydrophobicContact CG-CG 4.07Å; M39-L106 HydrophobicContact SD-CB 3.91Å; M39-L106 HydrophobicContact SD-CG 3.73Å; L42-L106 HydrophobicContact CD1-CB 4.26Å; T104-L106 VanDerWaalsContact C-N 3.26Å; T104-L106 WeakPolarHBondContact O-CD1 3.32Å; T104-L106 PolarHBondContact OG1-N 2.65Å; L106-E108 PolarHBondContact N-OE2 3.44Å; L106-M110 WeakPolarHBondContact O-CG 3.16Å; L106-M110 PolarHBondContact O-N 2.89Å
107	Q	88	Confident	88.3	Confident	91 Å²	91	50.8 Å²	50.8	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-70.5	-40.3	179.6	-68.3	-176.1	2.9	0	0	110.8	Y109 M110 E111	Q107-Y109 VanDerWaalsContact C-N 3.29Å; Q107-Y109 PolarHBondContact O-N 2.96Å; Q107-M110 CarbonylContact O-C 3.55Å; Q107-M110 PolarHBondContact O-N 2.68Å; Q107-E111 WeakPolarHBondContact O-CG 3.43Å; Q107-E111 PolarHBondContact O-N 2.91Å
108	E	92.5	Very high	87.8	Confident	55 Å²	55	55.1 Å²	55.1	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-35.5	179.5	-60.6	89.5	159.7	0	0	112.1	A98 A103 G105 L106 M110 E111 A112	A98-E108 HydrophobicContact CB-CB 3.71Å; A98-E108 HydrophobicContact CB-CG 3.68Å; A103-E108 WeakPolarHBondContact CB-OE1 3.41Å; G105-E108 VanDerWaalsContact C-OE2 3.29Å; G105-E108 WeakPolarHBondContact CA-OE2 3.4Å; G105-E108 PolarHBondContact N-OE2 3.09Å; G105-E108 VanDerWaalsContact N-OE2 3.15Å; L106-E108 PolarHBondContact N-OE2 3.44Å; E108-M110 VanDerWaalsContact C-N 3.33Å; E108-M110 PolarHBondContact O-N 2.88Å; E108-E111 PolarHBondContact O-N 3.42Å; E108-A112 WeakPolarHBondContact O-CB 3.19Å; E108-A112 PolarHBondContact O-N 3.34Å
109	Y	95.5	Very high	87.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-44.5	172.7	-172.9	-80.5	0	0	0	111.5	M39 H43 A94 N96 G105 Q107 A112 A113 V137 V141 V162 C164 Y166	M39-Y109 HydrophobicContact CE-CD1 3.67Å; M39-Y109 HydrophobicContact CE-CD2 4.49Å; M39-Y109 HydrophobicContact CE-CE1 4.17Å; M39-Y109 HydrophobicContact CE-CG 3.86Å; H43-Y109 AromaticContact CE1-CE1 3.98Å; H43-Y109 AromaticContact NE2-CE1 3.9Å; A94-Y109 WeakPolarHBondContact CB-OH 3.33Å; N96-Y109 HydrophobicContact CB-CD2 3.63Å; N96-Y109 HydrophobicContact CB-CE2 4.39Å; N96-Y109 HydrophobicContact CB-CG 4.18Å; G105-Y109 VanDerWaalsContact O-CB 3.24Å; G105-Y109 WeakPolarHBondContact O-CB 3.08Å; G105-Y109 PolarHBondContact O-N 2.76Å; Q107-Y109 VanDerWaalsContact C-N 3.29Å; Q107-Y109 PolarHBondContact O-N 2.96Å; Y109-A112 PolarHBondContact O-N 3.38Å; Y109-A113 PolarHBondContact O-N 2.88Å; Y109-V137 HydrophobicContact CD1-CG1 4.25Å; Y109-V137 HydrophobicContact CE1-CG1 3.86Å; Y109-V141 HydrophobicContact CE1-CG2 3.9Å; Y109-V162 HydrophobicContact CD2-CB 4.07Å; Y109-V162 HydrophobicContact CD2-CG1 3.8Å; Y109-V162 HydrophobicContact CE2-CG1 4.33Å; Y109-V162 HydrophobicContact CG-CG1 4.42Å; Y109-C164 HydrophobicContact CE2-CB 4.37Å; Y109-C164 WeakPolarHBondContact OH-CB 3.35Å; Y109-Y166 WeakPolarHBondContact CE1-OH 3.48Å; Y109-Y166 PolarHBondContact OH-OH 3.27Å
110	M	90.5	Very high	86.9	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-75.3	-33.4	-179.8	-58.8	-57.8	-49.4	0	0	112.4	L42 E46 L106 Q107 E108 A113 R114 V141	L42-M110 HydrophobicContact CB-CE 4.5Å; L42-M110 HydrophobicContact CB-CG 3.78Å; L42-M110 HydrophobicContact CB-SD 4.16Å; L42-M110 HydrophobicContact CD1-CG 4.05Å; L42-M110 HydrophobicContact CG-CG 4.46Å; L42-M110 WeakPolarHBondContact O-CE 3.4Å; E46-M110 HydrophobicContact CB-CE 3.73Å; E46-M110 HydrophobicContact CG-CB 4.49Å; E46-M110 HydrophobicContact CG-CE 3.49Å; E46-M110 VanDerWaalsContact CG-CE 3.49Å; L106-M110 WeakPolarHBondContact O-CG 3.16Å; L106-M110 PolarHBondContact O-N 2.89Å; Q107-M110 CarbonylContact O-C 3.55Å; Q107-M110 PolarHBondContact O-N 2.68Å; E108-M110 VanDerWaalsContact C-N 3.33Å; E108-M110 PolarHBondContact O-N 2.88Å; M110-A113 WeakPolarHBondContact O-CB 3.35Å; M110-A113 PolarHBondContact O-N 3.43Å; M110-R114 WeakPolarHBondContact O-CB 3.29Å; M110-R114 WeakPolarHBondContact O-CG 3.42Å; M110-R114 PolarHBondContact O-N 3.49Å; M110-V141 HydrophobicContact CE-CG1 3.73Å
111	E	91.2	Very high	86.5	Confident	95 Å²	95	48.2 Å²	48.2	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-61.5	-43.7	170.2	-74.4	173.9	-179.9	0	0	111.8	Q107 E108 A113 R114 S115	Q107-E111 WeakPolarHBondContact O-CG 3.43Å; Q107-E111 PolarHBondContact O-N 2.91Å; E108-E111 PolarHBondContact O-N 3.42Å; E111-A113 VanDerWaalsContact C-N 3.33Å; E111-A113 PolarHBondContact O-N 2.83Å; E111-R114 PolarHBondContact O-N 3.43Å; E111-R114 IonicContact OE1-NH2 3.66Å; E111-S115 WeakPolarHBondContact O-CB 3.25Å; E111-S115 PolarHBondContact O-N 3.22Å
112	A	92	Very high	86.2	Confident	14 Å²	14	48.9 Å²	48.9	12%	0.116	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-44.2	175.3	0	0	0	0	0	111.5	N96 E108 Y109 S115	N96-A112 HydrophobicContact CB-CB 4.47Å; N96-A112 WeakPolarHBondContact ND2-CB 3.41Å; E108-A112 WeakPolarHBondContact O-CB 3.19Å; E108-A112 PolarHBondContact O-N 3.34Å; Y109-A112 PolarHBondContact O-N 3.38Å; A112-S115 PolarHBondContact O-N 2.74Å; A112-S115 PolarHBondContact O-OG 2.73Å
113	A	91.8	Very high	85.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-57.6	-54.2	173.2	0	0	0	0	0	111.3	Y109 M110 E111 S115 M116 V137 V141 F142	Y109-A113 PolarHBondContact O-N 2.88Å; M110-A113 WeakPolarHBondContact O-CB 3.35Å; M110-A113 PolarHBondContact O-N 3.43Å; E111-A113 VanDerWaalsContact C-N 3.33Å; E111-A113 PolarHBondContact O-N 2.83Å; A113-S115 VanDerWaalsContact C-N 3.28Å; A113-S115 PolarHBondContact O-N 3.26Å; A113-M116 PolarHBondContact O-N 2.89Å; A113-V137 HydrophobicContact CB-CG1 3.65Å; A113-V141 HydrophobicContact CB-CB 3.9Å; A113-V141 HydrophobicContact CB-CG1 3.92Å; A113-V141 HydrophobicContact CB-CG2 3.83Å; A113-F142 HydrophobicContact CB-CD2 4.4Å; A113-F142 HydrophobicContact CB-CE2 3.71Å; A113-F142 HydrophobicContact CB-CZ 4.5Å
114	R	89	Confident	85.5	Confident	86 Å²	86	53.9 Å²	53.9	33%	0.325	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-36.6	-177.3	-81.1	-173.9	-77.1	-157.9	18.7	113	E46 M110 E111 M116 L117 F142	E46-R114 HydrophobicContact CG-CG 4.29Å; E46-R114 WeakPolarHBondContact OE1-CD 2.88Å; E46-R114 IonicContact OE1-CZ 3.64Å; E46-R114 IonicContact OE1-NE 3.11Å; E46-R114 IonicContact OE1-NH1 3.1Å; E46-R114 PolarHBondContact OE1-NH1 2.74Å; E46-R114 WeakPolarHBondContact OE2-CD 3.46Å; E46-R114 WeakPolarHBondContact OE2-CG 2.97Å; M110-R114 WeakPolarHBondContact O-CB 3.29Å; M110-R114 WeakPolarHBondContact O-CG 3.42Å; M110-R114 PolarHBondContact O-N 3.49Å; E111-R114 PolarHBondContact O-N 3.43Å; E111-R114 IonicContact OE1-NH2 3.66Å; R114-M116 PolarHBondContact O-N 2.63Å; R114-L117 HydrophobicContact CB-CD1 4.31Å; R114-L117 HydrophobicContact CG-CD1 4.27Å; R114-L117 WeakPolarHBondContact O-CB 3.33Å; R114-L117 PolarHBondContact O-N 3.27Å; R114-F142 HydrophobicContact CG-CZ 4.26Å
115	S	89.4	Confident	84.9	Confident	67 Å²	67	54.2 Å²	54.2	47%	0.469	27%	0.272	S	S	.	.	H	α-helix	trans	-57.8	-22.6	-177.2	74.1	0	0	0	0	113.2	E111 A112 A113	E111-S115 WeakPolarHBondContact O-CB 3.25Å; E111-S115 PolarHBondContact O-N 3.22Å; A112-S115 PolarHBondContact O-N 2.74Å; A112-S115 PolarHBondContact O-OG 2.73Å; A113-S115 VanDerWaalsContact C-N 3.28Å; A113-S115 PolarHBondContact O-N 3.26Å
116	M	87.8	Confident	84.3	Confident	6 Å²	6	60 Å²	60	3%	0.03	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-7.4	-179.9	-59.5	-55.1	-76.4	0	0	114.4	A113 R114 N118 T119 F120 F127 A134 E135 F138	A113-M116 PolarHBondContact O-N 2.89Å; R114-M116 PolarHBondContact O-N 2.63Å; M116-N118 VanDerWaalsContact C-N 3.32Å; M116-N118 PolarHBondContact O-N 2.97Å; M116-T119 WeakPolarHBondContact CA-OG1 3.47Å; M116-T119 WeakPolarHBondContact CE-OG1 3.48Å; M116-T119 PolarHBondContact O-N 3.48Å; M116-T119 VanDerWaalsContact O-N 3.16Å; M116-T119 PolarHBondContact O-OG1 2.04Å; M116-T119 VanDerWaalsContact O-OG1 3.08Å; M116-F120 WeakPolarHBondContact O-CB 3.41Å; M116-F120 PolarHBondContact O-N 3.14Å; M116-F127 HydrophobicContact CB-CD1 4.26Å; M116-F127 HydrophobicContact CB-CE1 3.85Å; M116-F127 HydrophobicContact CE-CB 4.14Å; M116-F127 HydrophobicContact CE-CD1 3.49Å; M116-F127 VanDerWaalsContact CE-CD1 3.49Å; M116-F127 HydrophobicContact CE-CE1 3.95Å; M116-F127 HydrophobicContact CE-CG 3.9Å; M116-A134 HydrophobicContact CG-CB 3.66Å; M116-A134 HydrophobicContact SD-CB 3.74Å; M116-E135 HydrophobicContact CE-CB 4.42Å; M116-E135 HydrophobicContact CE-CG 3.52Å; M116-F138 HydrophobicContact CB-CB 3.75Å; M116-F138 HydrophobicContact CB-CD2 3.67Å; M116-F138 HydrophobicContact CB-CG 3.87Å; M116-F138 HydrophobicContact CG-CB 4.18Å
117	L	83.3	Confident	83.8	Confident	38 Å²	38	60.6 Å²	60.6	20%	0.199	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-43	179.6	-79.2	163.6	0	0	0	112.5	I50 R114 T119 F138 F142	I50-L117 HydrophobicContact CD1-CD1 3.63Å; I50-L117 HydrophobicContact CD1-CD2 3.34Å; I50-L117 HydrophobicContact CD1-CG 4.15Å; I50-L117 HydrophobicContact CG1-CD2 4.19Å; R114-L117 HydrophobicContact CB-CD1 4.31Å; R114-L117 HydrophobicContact CG-CD1 4.27Å; R114-L117 WeakPolarHBondContact O-CB 3.33Å; R114-L117 PolarHBondContact O-N 3.27Å; L117-T119 VanDerWaalsContact C-N 3.27Å; L117-T119 PolarHBondContact O-N 3.36Å; L117-F138 HydrophobicContact CD2-CE2 3.66Å; L117-F138 HydrophobicContact CD2-CZ 4.44Å; L117-F138 HydrophobicContact CG-CE2 3.99Å; L117-F142 HydrophobicContact CD1-CE1 4.38Å; L117-F142 HydrophobicContact CD1-CE2 4.29Å; L117-F142 HydrophobicContact CD1-CZ 3.89Å; L117-F142 HydrophobicContact CD2-CD1 4.49Å; L117-F142 HydrophobicContact CD2-CD2 4.45Å; L117-F142 HydrophobicContact CD2-CE1 4.43Å; L117-F142 HydrophobicContact CD2-CE2 4.38Å; L117-F142 HydrophobicContact CD2-CG 4.49Å; L117-F142 HydrophobicContact CD2-CZ 4.38Å; L117-F142 HydrophobicContact CG-CE2 4.18Å; L117-F142 HydrophobicContact CG-CZ 4.23Å
118	N	83.1	Confident	83.5	Confident	158 Å²	158	62.3 Å²	62.3	85%	0.845	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-9.1	-178.4	-66	-26.4	0	0	0	113.3	M116	M116-N118 VanDerWaalsContact C-N 3.32Å; M116-N118 PolarHBondContact O-N 2.97Å
119	T	85.3	Confident	82.9	Confident	15 Å²	15	64.9 Å²	64.9	9%	0.092	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-13.4	-178.6	68.5	0	0	0	0	112.2	M116 L117 F127 D128 L129	M116-T119 WeakPolarHBondContact CA-OG1 3.47Å; M116-T119 WeakPolarHBondContact CE-OG1 3.48Å; M116-T119 PolarHBondContact O-N 3.48Å; M116-T119 VanDerWaalsContact O-N 3.16Å; M116-T119 PolarHBondContact O-OG1 2.04Å; M116-T119 VanDerWaalsContact O-OG1 3.08Å; L117-T119 VanDerWaalsContact C-N 3.27Å; L117-T119 PolarHBondContact O-N 3.36Å; T119-F127 CarbonylContact O-C 3.58Å; T119-F127 VanDerWaalsContact O-CA 3.25Å; T119-F127 WeakPolarHBondContact O-CA 3.31Å; T119-D128 PolarHBondContact O-N 2.81Å; T119-L129 HydrophobicContact CG2-CB 4.13Å; T119-L129 HydrophobicContact CG2-CD1 3.7Å; T119-L129 HydrophobicContact CG2-CG 3.76Å
120	F	78.7	Confident	82.1	Confident	25 Å²	25	74.2 Å²	74.2	11%	0.11	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.1	-179.6	-172.3	-119.2	0	0	0	111.8	M116 Y122 N125 F127 F138	M116-F120 WeakPolarHBondContact O-CB 3.41Å; M116-F120 PolarHBondContact O-N 3.14Å; F120-Y122 AromaticContact CD1-CD1 3.57Å; F120-Y122 HydrophobicContact CD1-CD1 3.57Å; F120-Y122 HydrophobicContact CD1-CD2 4.28Å; F120-Y122 AromaticContact CD1-CE1 3.4Å; F120-Y122 HydrophobicContact CD1-CE1 3.4Å; F120-Y122 VanDerWaalsContact CD1-CE1 3.4Å; F120-Y122 HydrophobicContact CD1-CE2 4.17Å; F120-Y122 HydrophobicContact CD1-CG 4.01Å; F120-Y122 AromaticContact CD1-CZ 3.75Å; F120-Y122 AromaticContact CE1-CD1 3.34Å; F120-Y122 HydrophobicContact CE1-CD1 3.34Å; F120-Y122 AromaticContact CE1-CE1 3.47Å; F120-Y122 HydrophobicContact CE1-CE1 3.47Å; F120-Y122 VanDerWaalsContact CE1-CE1 3.47Å; F120-Y122 HydrophobicContact CE1-CG 4.02Å; F120-N125 WeakPolarHBondContact CZ-OD1 3.45Å; F120-F127 HydrophobicContact CB-CD1 3.66Å; F120-F127 HydrophobicContact CB-CE1 3.54Å; F120-F127 HydrophobicContact CB-CZ 4.44Å; F120-F127 AromaticContact CD2-CD1 3.64Å; F120-F127 HydrophobicContact CD2-CD1 3.64Å; F120-F127 HydrophobicContact CD2-CD2 4.02Å; F120-F127 AromaticContact CD2-CE1 3.37Å; F120-F127 HydrophobicContact CD2-CE1 3.37Å; F120-F127 AromaticContact CD2-CE2 3.79Å; F120-F127 HydrophobicContact CD2-CE2 3.79Å; F120-F127 AromaticContact CD2-CG 3.98Å; F120-F127 HydrophobicContact CD2-CG 3.98Å; F120-F127 AromaticContact CD2-CZ 3.47Å; F120-F127 HydrophobicContact CD2-CZ 3.47Å; F120-F127 VanDerWaalsContact CD2-CZ 3.47Å; F120-F127 HydrophobicContact CE2-CD2 4.49Å; F120-F127 HydrophobicContact CE2-CE1 4.34Å; F120-F127 HydrophobicContact CE2-CE2 4.08Å; F120-F127 HydrophobicContact CE2-CZ 4.01Å; F120-F127 HydrophobicContact CG-CD1 4.09Å; F120-F127 AromaticContact CG-CE1 3.74Å; F120-F127 HydrophobicContact CG-CE1 3.74Å; F120-F127 HydrophobicContact CG-CZ 4.17Å; F120-F138 HydrophobicContact CB-CE1 4.03Å; F120-F138 HydrophobicContact CB-CE2 4.31Å; F120-F138 HydrophobicContact CB-CZ 3.75Å; F120-F138 AromaticContact CD1-CE1 3.49Å; F120-F138 HydrophobicContact CD1-CE1 3.49Å; F120-F138 VanDerWaalsContact CD1-CE1 3.49Å; F120-F138 AromaticContact CD1-CZ 3.45Å; F120-F138 HydrophobicContact CD1-CZ 3.45Å; F120-F138 VanDerWaalsContact CD1-CZ 3.45Å; F120-F138 HydrophobicContact CD2-CE1 4.04Å; F120-F138 AromaticContact CE1-CE1 3.85Å; F120-F138 HydrophobicContact CE1-CE1 3.85Å; F120-F138 HydrophobicContact CE1-CZ 4.17Å; F120-F138 HydrophobicContact CE2-CE1 4.38Å; F120-F138 HydrophobicContact CG-CD1 4.49Å; F120-F138 AromaticContact CG-CE1 3.57Å; F120-F138 HydrophobicContact CG-CE1 3.57Å; F120-F138 AromaticContact CG-CZ 3.67Å; F120-F138 HydrophobicContact CG-CZ 3.67Å; F120-F138 HydrophobicContact CZ-CE1 4.29Å
121	N	75.2	Confident	81.8	Confident	56 Å²	56	78 Å²	78	30%	0.299	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	107.6	171.5	-175.4	-35.4	0	0	0	110	Q123 T124 N125 Q126	N121-Q123 VanDerWaalsContact C-N 3.27Å; N121-Q123 PolarHBondContact O-N 3.47Å; N121-Q123 WeakPolarHBondContact OD1-CA 3.39Å; N121-Q123 WeakPolarHBondContact OD1-CB 3.37Å; N121-Q123 PolarHBondContact OD1-N 2.88Å; N121-T124 WeakPolarHBondContact CB-OG1 3.27Å; N121-T124 VanDerWaalsContact CG-OG1 3.26Å; N121-T124 PolarHBondContact O-N 3.45Å; N121-T124 PolarHBondContact OD1-N 3.09Å; N121-T124 VanDerWaalsContact OD1-N 3.1Å; N121-T124 PolarHBondContact OD1-OG1 2.92Å; N121-N125 WeakPolarHBondContact O-CA 3.42Å; N121-N125 PolarHBondContact O-N 3.18Å; N121-Q126 PolarHBondContact N-O 3.35Å; N121-Q126 PolarHBondContact O-N 3.43Å
122	Y	70.6	Confident	81.5	Confident	95 Å²	95	80.2 Å²	80.2	37%	0.373	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.7	179.2	-64.7	-81.1	0	0	0	113.9	Q53 F120	Q53-Y122 HydrophobicContact CG-CE1 3.97Å; F120-Y122 AromaticContact CD1-CD1 3.57Å; F120-Y122 HydrophobicContact CD1-CD1 3.57Å; F120-Y122 HydrophobicContact CD1-CD2 4.28Å; F120-Y122 AromaticContact CD1-CE1 3.4Å; F120-Y122 HydrophobicContact CD1-CE1 3.4Å; F120-Y122 VanDerWaalsContact CD1-CE1 3.4Å; F120-Y122 HydrophobicContact CD1-CE2 4.17Å; F120-Y122 HydrophobicContact CD1-CG 4.01Å; F120-Y122 AromaticContact CD1-CZ 3.75Å; F120-Y122 AromaticContact CE1-CD1 3.34Å; F120-Y122 HydrophobicContact CE1-CD1 3.34Å; F120-Y122 AromaticContact CE1-CE1 3.47Å; F120-Y122 HydrophobicContact CE1-CE1 3.47Å; F120-Y122 VanDerWaalsContact CE1-CE1 3.47Å; F120-Y122 HydrophobicContact CE1-CG 4.02Å
123	Q	66.4	Low	81.1	Confident	187 Å²	187	80.7 Å²	80.7	87%	0.874	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-38.1	-179.9	-61	-179.1	-11.4	0	0	111.6	N121	N121-Q123 VanDerWaalsContact C-N 3.27Å; N121-Q123 PolarHBondContact O-N 3.47Å; N121-Q123 WeakPolarHBondContact OD1-CA 3.39Å; N121-Q123 WeakPolarHBondContact OD1-CB 3.37Å; N121-Q123 PolarHBondContact OD1-N 2.88Å
124	T	76.9	Confident	80.9	Confident	72 Å²	72	81 Å²	81	44%	0.442	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-10.4	-178.2	64.4	0	0	0	0	113.2	N121 Q126	N121-T124 WeakPolarHBondContact CB-OG1 3.27Å; N121-T124 VanDerWaalsContact CG-OG1 3.26Å; N121-T124 PolarHBondContact O-N 3.45Å; N121-T124 PolarHBondContact OD1-N 3.09Å; N121-T124 VanDerWaalsContact OD1-N 3.1Å; N121-T124 PolarHBondContact OD1-OG1 2.92Å; T124-Q126 WeakPolarHBondContact O-CG 3.38Å; T124-Q126 PolarHBondContact O-N 3.37Å
125	N	72.5	Confident	80.8	Confident	71 Å²	71	78.2 Å²	78.2	38%	0.38	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	35.5	-172	-171.7	19.2	0	0	0	112.7	F120 N121 R139	F120-N125 WeakPolarHBondContact CZ-OD1 3.45Å; N121-N125 WeakPolarHBondContact O-CA 3.42Å; N121-N125 PolarHBondContact O-N 3.18Å; N125-R139 PolarHBondContact O-NH2 2.96Å; N125-R139 PolarHBondContact OD1-NH1 2.83Å
126	Q	80.1	Confident	80.8	Confident	122 Å²	122	75.9 Å²	75.9	57%	0.57	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	158.8	-178.6	-67	179.8	17.2	0	0	111	N121 T124	N121-Q126 PolarHBondContact N-O 3.35Å; N121-Q126 PolarHBondContact O-N 3.43Å; T124-Q126 WeakPolarHBondContact O-CG 3.38Å; T124-Q126 PolarHBondContact O-N 3.37Å
127	F	80.9	Confident	81	Confident	18 Å²	18	75.6 Å²	75.6	8%	0.079	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.9	172.3	-60.7	-92.3	0	0	0	110.3	M116 T119 F120 L129 E135 F138 R139	M116-F127 HydrophobicContact CB-CD1 4.26Å; M116-F127 HydrophobicContact CB-CE1 3.85Å; M116-F127 HydrophobicContact CE-CB 4.14Å; M116-F127 HydrophobicContact CE-CD1 3.49Å; M116-F127 VanDerWaalsContact CE-CD1 3.49Å; M116-F127 HydrophobicContact CE-CE1 3.95Å; M116-F127 HydrophobicContact CE-CG 3.9Å; T119-F127 CarbonylContact O-C 3.58Å; T119-F127 VanDerWaalsContact O-CA 3.25Å; T119-F127 WeakPolarHBondContact O-CA 3.31Å; F120-F127 HydrophobicContact CB-CD1 3.66Å; F120-F127 HydrophobicContact CB-CE1 3.54Å; F120-F127 HydrophobicContact CB-CZ 4.44Å; F120-F127 AromaticContact CD2-CD1 3.64Å; F120-F127 HydrophobicContact CD2-CD1 3.64Å; F120-F127 HydrophobicContact CD2-CD2 4.02Å; F120-F127 AromaticContact CD2-CE1 3.37Å; F120-F127 HydrophobicContact CD2-CE1 3.37Å; F120-F127 AromaticContact CD2-CE2 3.79Å; F120-F127 HydrophobicContact CD2-CE2 3.79Å; F120-F127 AromaticContact CD2-CG 3.98Å; F120-F127 HydrophobicContact CD2-CG 3.98Å; F120-F127 AromaticContact CD2-CZ 3.47Å; F120-F127 HydrophobicContact CD2-CZ 3.47Å; F120-F127 VanDerWaalsContact CD2-CZ 3.47Å; F120-F127 HydrophobicContact CE2-CD2 4.49Å; F120-F127 HydrophobicContact CE2-CE1 4.34Å; F120-F127 HydrophobicContact CE2-CE2 4.08Å; F120-F127 HydrophobicContact CE2-CZ 4.01Å; F120-F127 HydrophobicContact CG-CD1 4.09Å; F120-F127 AromaticContact CG-CE1 3.74Å; F120-F127 HydrophobicContact CG-CE1 3.74Å; F120-F127 HydrophobicContact CG-CZ 4.17Å; F127-L129 VanDerWaalsContact C-N 3.33Å; F127-L129 WeakPolarHBondContact CB-O 3.3Å; F127-E135 HydrophobicContact CB-CG 4.24Å; F127-E135 HydrophobicContact CD1-CG 4.26Å; F127-E135 HydrophobicContact CD2-CB 4.07Å; F127-E135 HydrophobicContact CD2-CG 3.35Å; F127-E135 WeakPolarHBondContact CD2-OE2 3.31Å; F127-E135 HydrophobicContact CE1-CG 4.4Å; F127-E135 HydrophobicContact CE2-CB 3.69Å; F127-E135 HydrophobicContact CE2-CG 3.52Å; F127-E135 HydrophobicContact CG-CG 3.72Å; F127-E135 HydrophobicContact CZ-CB 4.07Å; F127-E135 HydrophobicContact CZ-CG 4.05Å; F127-F138 HydrophobicContact CE1-CB 4.34Å; F127-F138 AromaticContact CE1-CD1 3.64Å; F127-F138 HydrophobicContact CE1-CD1 3.64Å; F127-F138 HydrophobicContact CE1-CD2 4.48Å; F127-F138 HydrophobicContact CE1-CE1 4.01Å; F127-F138 AromaticContact CE1-CG 3.89Å; F127-F138 HydrophobicContact CE1-CG 3.89Å; F127-F138 HydrophobicContact CZ-CB 4.28Å; F127-F138 AromaticContact CZ-CD1 3.43Å; F127-F138 HydrophobicContact CZ-CD1 3.43Å; F127-F138 VanDerWaalsContact CZ-CD1 3.43Å; F127-F138 AromaticContact CZ-CE1 3.98Å; F127-F138 HydrophobicContact CZ-CE1 3.98Å; F127-F138 AromaticContact CZ-CG 3.99Å; F127-F138 HydrophobicContact CZ-CG 3.99Å; F127-R139 HydrophobicContact CZ-CG 4.39Å
128	D	81.9	Confident	81.3	Confident	127 Å²	127	74 Å²	74	68%	0.679	37%	0.367	S	S	*	.	S	Bend	trans	-73.6	-29	174.1	-66.9	-24.6	0	0	0	111.7	T119	T119-D128 PolarHBondContact O-N 2.81Å
129	L	78.9	Confident	81.5	Confident	109 Å²	109	67.1 Å²	67.1	57%	0.571	33%	0.329	S	S	*	.	S	Bend	trans	-104.9	133	172.7	-64.5	-173.7	0	0	0	110.8	T119 F127 D131	T119-L129 HydrophobicContact CG2-CB 4.13Å; T119-L129 HydrophobicContact CG2-CD1 3.7Å; T119-L129 HydrophobicContact CG2-CG 3.76Å; F127-L129 VanDerWaalsContact C-N 3.33Å; F127-L129 WeakPolarHBondContact CB-O 3.3Å; L129-D131 PolarHBondContact O-N 3.48Å
130	K	79.7	Confident	81.7	Confident	195 Å²	195	66.7 Å²	66.7	85%	0.848	33%	0.326	S	S	*	.			trans	-97.5	78.3	-179.1	-64.4	-175.4	-179.3	178.5	0	111.4
131	D	83.6	Confident	82.2	Confident	83 Å²	83	65.5 Å²	65.5	44%	0.444	32%	0.321	S	S	.	.			trans	-114.3	97.8	165.1	-178.6	-21.7	0	0	0	108.9	L129 A133 A134 E135	L129-D131 PolarHBondContact O-N 3.48Å; D131-A133 PolarHBondContact O-N 3.21Å; D131-A133 VanDerWaalsContact O-N 3.16Å; D131-A133 PolarHBondContact OD1-N 3.25Å; D131-A134 HydrophobicContact CB-CB 3.95Å; D131-A134 PolarHBondContact O-N 3.05Å; D131-A134 PolarHBondContact OD1-N 3.4Å; D131-A134 VanDerWaalsContact OD1-N 3.11Å; D131-E135 WeakPolarHBondContact O-CB 3.45Å; D131-E135 WeakPolarHBondContact O-CG 3.43Å; D131-E135 PolarHBondContact O-N 3.5Å
132	K	84.7	Confident	82.5	Confident	141 Å²	141	63 Å²	63	61%	0.613	31%	0.308	S	S	*	.	H	α-helix	trans	-55.6	-36.5	-176	-72.6	-168.2	172.3	-163.2	0	113.6	D83 N136	D83-K132 IonicContact OD2-NZ 2.69Å; D83-K132 PolarHBondContact OD2-NZ 2.85Å; K132-N136 WeakPolarHBondContact O-CB 3.47Å; K132-N136 PolarHBondContact O-N 3.28Å
133	A	84.1	Confident	82.7	Confident	24 Å²	24	61.6 Å²	61.6	20%	0.198	30%	0.302	C	S	.	.	H	α-helix	trans	-71.9	-49.2	-178	0	0	0	0	0	110	Y95 D131 E135 N136 V137	Y95-A133 HydrophobicContact CE1-CB 4.11Å; Y95-A133 HydrophobicContact CE2-CB 4.45Å; D131-A133 PolarHBondContact O-N 3.21Å; D131-A133 VanDerWaalsContact O-N 3.16Å; D131-A133 PolarHBondContact OD1-N 3.25Å; A133-E135 PolarHBondContact O-N 3.44Å; A133-N136 PolarHBondContact O-N 2.88Å; A133-V137 VanDerWaalsContact O-CG2 3.28Å; A133-V137 WeakPolarHBondContact O-CG2 3.47Å; A133-V137 PolarHBondContact O-N 3.15Å
134	A	86.1	Confident	82.6	Confident	6 Å²	6	56.1 Å²	56.1	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-39.6	176.7	0	0	0	0	0	112.1	M116 D131 N136 V137 F138	M116-A134 HydrophobicContact CG-CB 3.66Å; M116-A134 HydrophobicContact SD-CB 3.74Å; D131-A134 HydrophobicContact CB-CB 3.95Å; D131-A134 PolarHBondContact O-N 3.05Å; D131-A134 PolarHBondContact OD1-N 3.4Å; D131-A134 VanDerWaalsContact OD1-N 3.11Å; A134-N136 VanDerWaalsContact C-N 3.34Å; A134-N136 PolarHBondContact O-N 3.25Å; A134-V137 PolarHBondContact O-N 3.38Å; A134-F138 WeakPolarHBondContact O-CB 3.35Å; A134-F138 PolarHBondContact O-N 3.37Å
135	E	88.2	Confident	82.2	Confident	28 Å²	28	54.1 Å²	54.1	13%	0.131	26%	0.261	C	S	.	.	H	α-helix	trans	-57.1	-46.2	173	-74.6	-174.1	-143.5	0	0	111.4	M116 F127 D131 A133 F138 R139	M116-E135 HydrophobicContact CE-CB 4.42Å; M116-E135 HydrophobicContact CE-CG 3.52Å; F127-E135 HydrophobicContact CB-CG 4.24Å; F127-E135 HydrophobicContact CD1-CG 4.26Å; F127-E135 HydrophobicContact CD2-CB 4.07Å; F127-E135 HydrophobicContact CD2-CG 3.35Å; F127-E135 WeakPolarHBondContact CD2-OE2 3.31Å; F127-E135 HydrophobicContact CE1-CG 4.4Å; F127-E135 HydrophobicContact CE2-CB 3.69Å; F127-E135 HydrophobicContact CE2-CG 3.52Å; F127-E135 HydrophobicContact CG-CG 3.72Å; F127-E135 HydrophobicContact CZ-CB 4.07Å; F127-E135 HydrophobicContact CZ-CG 4.05Å; D131-E135 WeakPolarHBondContact O-CB 3.45Å; D131-E135 WeakPolarHBondContact O-CG 3.43Å; D131-E135 PolarHBondContact O-N 3.5Å; A133-E135 PolarHBondContact O-N 3.44Å; E135-F138 PolarHBondContact O-N 3.1Å; E135-R139 WeakPolarHBondContact O-CB 3.46Å; E135-R139 VanDerWaalsContact O-CG 3.27Å; E135-R139 WeakPolarHBondContact O-CG 3.31Å; E135-R139 PolarHBondContact O-N 3.34Å
136	N	89.5	Confident	82.4	Confident	17 Å²	17	51 Å²	51	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-40.5	-179.7	-177	48	0	0	0	111.6	L93 K132 A133 A134 R139 Q140	L93-N136 PolarHBondContact O-ND2 3.49Å; L93-N136 PolarHBondContact O-OD1 3.45Å; K132-N136 WeakPolarHBondContact O-CB 3.47Å; K132-N136 PolarHBondContact O-N 3.28Å; A133-N136 PolarHBondContact O-N 2.88Å; A134-N136 VanDerWaalsContact C-N 3.34Å; A134-N136 PolarHBondContact O-N 3.25Å; N136-R139 PolarHBondContact O-N 3.17Å; N136-Q140 WeakPolarHBondContact O-CG 3.49Å; N136-Q140 PolarHBondContact O-N 2.91Å; N136-Q140 PolarHBondContact OD1-NE2 3.48Å
137	V	91.4	Very high	82.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.3	-50.1	172.1	177.7	0	0	0	0	110.5	A94 Y95 Y109 A113 A133 A134 R139 Q140 V141	A94-V137 HydrophobicContact CB-CB 4.27Å; A94-V137 HydrophobicContact CB-CG2 3.93Å; Y95-V137 WeakPolarHBondContact O-CG2 3.34Å; Y109-V137 HydrophobicContact CD1-CG1 4.25Å; Y109-V137 HydrophobicContact CE1-CG1 3.86Å; A113-V137 HydrophobicContact CB-CG1 3.65Å; A133-V137 VanDerWaalsContact O-CG2 3.28Å; A133-V137 WeakPolarHBondContact O-CG2 3.47Å; A133-V137 PolarHBondContact O-N 3.15Å; A134-V137 PolarHBondContact O-N 3.38Å; V137-R139 VanDerWaalsContact C-N 3.31Å; V137-R139 PolarHBondContact O-N 3.43Å; V137-Q140 PolarHBondContact O-N 2.81Å; V137-V141 HydrophobicContact CG1-CG2 4.04Å; V137-V141 WeakPolarHBondContact O-CB 3.11Å; V137-V141 VanDerWaalsContact O-CG2 3.23Å; V137-V141 WeakPolarHBondContact O-CG2 3.48Å; V137-V141 PolarHBondContact O-N 3.25Å
138	F	90.1	Very high	82.8	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-53.9	-48.4	175.3	173.9	-84.9	0	0	0	111.8	M116 L117 F120 F127 A134 E135 Q140 V141 F142	M116-F138 HydrophobicContact CB-CB 3.75Å; M116-F138 HydrophobicContact CB-CD2 3.67Å; M116-F138 HydrophobicContact CB-CG 3.87Å; M116-F138 HydrophobicContact CG-CB 4.18Å; L117-F138 HydrophobicContact CD2-CE2 3.66Å; L117-F138 HydrophobicContact CD2-CZ 4.44Å; L117-F138 HydrophobicContact CG-CE2 3.99Å; F120-F138 HydrophobicContact CB-CE1 4.03Å; F120-F138 HydrophobicContact CB-CE2 4.31Å; F120-F138 HydrophobicContact CB-CZ 3.75Å; F120-F138 AromaticContact CD1-CE1 3.49Å; F120-F138 HydrophobicContact CD1-CE1 3.49Å; F120-F138 VanDerWaalsContact CD1-CE1 3.49Å; F120-F138 AromaticContact CD1-CZ 3.45Å; F120-F138 HydrophobicContact CD1-CZ 3.45Å; F120-F138 VanDerWaalsContact CD1-CZ 3.45Å; F120-F138 HydrophobicContact CD2-CE1 4.04Å; F120-F138 AromaticContact CE1-CE1 3.85Å; F120-F138 HydrophobicContact CE1-CE1 3.85Å; F120-F138 HydrophobicContact CE1-CZ 4.17Å; F120-F138 HydrophobicContact CE2-CE1 4.38Å; F120-F138 HydrophobicContact CG-CD1 4.49Å; F120-F138 AromaticContact CG-CE1 3.57Å; F120-F138 HydrophobicContact CG-CE1 3.57Å; F120-F138 AromaticContact CG-CZ 3.67Å; F120-F138 HydrophobicContact CG-CZ 3.67Å; F120-F138 HydrophobicContact CZ-CE1 4.29Å; F127-F138 HydrophobicContact CE1-CB 4.34Å; F127-F138 AromaticContact CE1-CD1 3.64Å; F127-F138 HydrophobicContact CE1-CD1 3.64Å; F127-F138 HydrophobicContact CE1-CD2 4.48Å; F127-F138 HydrophobicContact CE1-CE1 4.01Å; F127-F138 AromaticContact CE1-CG 3.89Å; F127-F138 HydrophobicContact CE1-CG 3.89Å; F127-F138 HydrophobicContact CZ-CB 4.28Å; F127-F138 AromaticContact CZ-CD1 3.43Å; F127-F138 HydrophobicContact CZ-CD1 3.43Å; F127-F138 VanDerWaalsContact CZ-CD1 3.43Å; F127-F138 AromaticContact CZ-CE1 3.98Å; F127-F138 HydrophobicContact CZ-CE1 3.98Å; F127-F138 AromaticContact CZ-CG 3.99Å; F127-F138 HydrophobicContact CZ-CG 3.99Å; A134-F138 WeakPolarHBondContact O-CB 3.35Å; A134-F138 PolarHBondContact O-N 3.37Å; E135-F138 PolarHBondContact O-N 3.1Å; F138-Q140 VanDerWaalsContact C-N 3.32Å; F138-Q140 PolarHBondContact O-N 3.48Å; F138-V141 PolarHBondContact O-N 3.46Å; F138-F142 AromaticContact CD2-CD2 3.45Å; F138-F142 HydrophobicContact CD2-CD2 3.45Å; F138-F142 VanDerWaalsContact CD2-CD2 3.45Å; F138-F142 HydrophobicContact CD2-CE2 4.04Å; F138-F142 HydrophobicContact CD2-CG 4.33Å; F138-F142 HydrophobicContact CE2-CB 4.22Å; F138-F142 AromaticContact CE2-CD2 3.69Å; F138-F142 HydrophobicContact CE2-CD2 3.69Å; F138-F142 HydrophobicContact CE2-CE2 4.38Å; F138-F142 HydrophobicContact CE2-CG 4.19Å; F138-F142 HydrophobicContact CG-CD2 4.1Å; F138-F142 HydrophobicContact CZ-CB 4.26Å; F138-F142 PolarHBondContact O-N 2.92Å
139	R	86.8	Confident	83.3	Confident	12 Å²	12	45.3 Å²	45.3	5%	0.045	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-36.3	-178	-77.3	-179.4	-173.1	-70.8	-2.3	112.6	N125 F127 E135 N136 V137 W143 V170	N125-R139 PolarHBondContact O-NH2 2.96Å; N125-R139 PolarHBondContact OD1-NH1 2.83Å; F127-R139 HydrophobicContact CZ-CG 4.39Å; E135-R139 WeakPolarHBondContact O-CB 3.46Å; E135-R139 VanDerWaalsContact O-CG 3.27Å; E135-R139 WeakPolarHBondContact O-CG 3.31Å; E135-R139 PolarHBondContact O-N 3.34Å; N136-R139 PolarHBondContact O-N 3.17Å; V137-R139 VanDerWaalsContact C-N 3.31Å; V137-R139 PolarHBondContact O-N 3.43Å; R139-W143 WeakPolarHBondContact O-CB 3.25Å; R139-V170 HydrophobicContact CB-CG1 4.15Å
140	Q	89.1	Confident	84.2	Confident	7 Å²	7	40.1 Å²	40.1	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-78.3	-36.8	175.4	-54.5	-49.3	-38.5	0	0	112.4	A94 N136 V137 F138 Y166 V170	A94-Q140 HydrophobicContact CB-CB 4.07Å; A94-Q140 HydrophobicContact CB-CG 3.63Å; N136-Q140 WeakPolarHBondContact O-CG 3.49Å; N136-Q140 PolarHBondContact O-N 2.91Å; N136-Q140 PolarHBondContact OD1-NE2 3.48Å; V137-Q140 PolarHBondContact O-N 2.81Å; F138-Q140 VanDerWaalsContact C-N 3.32Å; F138-Q140 PolarHBondContact O-N 3.48Å; Q140-Y166 HydrophobicContact CB-CD2 3.61Å; Q140-Y166 HydrophobicContact CB-CE1 4.37Å; Q140-Y166 HydrophobicContact CB-CE2 3.37Å; Q140-Y166 HydrophobicContact CB-CG 4.22Å; Q140-Y166 HydrophobicContact CG-CD2 3.86Å; Q140-Y166 HydrophobicContact CG-CE2 3.84Å; Q140-V170 PolarHBondContact NE2-O 2.68Å
141	V	89	Confident	85	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-74.7	-42.1	-175	172.4	0	0	0	0	112.6	R47 Y109 M110 A113 V137 F138	R47-V141 WeakPolarHBondContact CD-O 3.1Å; R47-V141 WeakPolarHBondContact CG-O 3.35Å; R47-V141 PolarHBondContact NH1-O 3.47Å; Y109-V141 HydrophobicContact CE1-CG2 3.9Å; M110-V141 HydrophobicContact CE-CG1 3.73Å; A113-V141 HydrophobicContact CB-CB 3.9Å; A113-V141 HydrophobicContact CB-CG1 3.92Å; A113-V141 HydrophobicContact CB-CG2 3.83Å; V137-V141 HydrophobicContact CG1-CG2 4.04Å; V137-V141 WeakPolarHBondContact O-CB 3.11Å; V137-V141 VanDerWaalsContact O-CG2 3.23Å; V137-V141 WeakPolarHBondContact O-CG2 3.48Å; V137-V141 PolarHBondContact O-N 3.25Å; F138-V141 PolarHBondContact O-N 3.46Å
142	F	83	Confident	85.7	Confident	3 Å²	3	26.9 Å²	26.9	1%	0.013	12%	0.122	C	C	.	.	S	Bend	trans	-109.1	18.8	-172.7	-62.5	-72.9	0	0	0	113.7	E46 I50 M56 A113 R114 L117 F138	E46-F142 HydrophobicContact CB-CE1 3.9Å; E46-F142 HydrophobicContact CB-CZ 3.98Å; I50-F142 HydrophobicContact CD1-CD1 4.09Å; I50-F142 HydrophobicContact CD1-CE1 3.74Å; I50-F142 HydrophobicContact CD1-CZ 4.48Å; I50-F142 HydrophobicContact CG1-CD1 3.69Å; I50-F142 HydrophobicContact CG1-CE1 3.77Å; M56-F142 HydrophobicContact SD-CB 4.4Å; M56-F142 HydrophobicContact SD-CD1 4.38Å; A113-F142 HydrophobicContact CB-CD2 4.4Å; A113-F142 HydrophobicContact CB-CE2 3.71Å; A113-F142 HydrophobicContact CB-CZ 4.5Å; R114-F142 HydrophobicContact CG-CZ 4.26Å; L117-F142 HydrophobicContact CD1-CE1 4.38Å; L117-F142 HydrophobicContact CD1-CE2 4.29Å; L117-F142 HydrophobicContact CD1-CZ 3.89Å; L117-F142 HydrophobicContact CD2-CD1 4.49Å; L117-F142 HydrophobicContact CD2-CD2 4.45Å; L117-F142 HydrophobicContact CD2-CE1 4.43Å; L117-F142 HydrophobicContact CD2-CE2 4.38Å; L117-F142 HydrophobicContact CD2-CG 4.49Å; L117-F142 HydrophobicContact CD2-CZ 4.38Å; L117-F142 HydrophobicContact CG-CE2 4.18Å; L117-F142 HydrophobicContact CG-CZ 4.23Å; F138-F142 AromaticContact CD2-CD2 3.45Å; F138-F142 HydrophobicContact CD2-CD2 3.45Å; F138-F142 VanDerWaalsContact CD2-CD2 3.45Å; F138-F142 HydrophobicContact CD2-CE2 4.04Å; F138-F142 HydrophobicContact CD2-CG 4.33Å; F138-F142 HydrophobicContact CE2-CB 4.22Å; F138-F142 AromaticContact CE2-CD2 3.69Å; F138-F142 HydrophobicContact CE2-CD2 3.69Å; F138-F142 HydrophobicContact CE2-CE2 4.38Å; F138-F142 HydrophobicContact CE2-CG 4.19Å; F138-F142 HydrophobicContact CG-CD2 4.1Å; F138-F142 HydrophobicContact CZ-CB 4.26Å; F138-F142 PolarHBondContact O-N 2.92Å
143	W	73.8	Confident	86.4	Confident	65 Å²	65	20.7 Å²	20.7	25%	0.246	10%	0.095	C	C	.	.			trans	-67.5	153	173.5	-164.5	-123.4	0	0	0	112.3	R47 R139 E145 V170	R47-W143 PolarHBondContact NH1-O 2.77Å; R47-W143 PolarHBondContact NH2-O 2.81Å; R139-W143 WeakPolarHBondContact O-CB 3.25Å; W143-E145 VanDerWaalsContact CD1-N 3.35Å; W143-V170 HydrophobicContact CB-CG2 3.72Å; W143-V170 HydrophobicContact CD2-CB 4.25Å; W143-V170 HydrophobicContact CD2-CG1 3.67Å; W143-V170 HydrophobicContact CD2-CG2 3.52Å; W143-V170 HydrophobicContact CE3-CG1 3.56Å; W143-V170 HydrophobicContact CE3-CG2 4.26Å; W143-V170 HydrophobicContact CG-CB 4.36Å; W143-V170 HydrophobicContact CG-CG1 4.27Å; W143-V170 HydrophobicContact CG-CG2 3.25Å; W143-V170 HydrophobicContact CH2-CG1 4.16Å; W143-V170 HydrophobicContact CZ2-CG1 4.22Å; W143-V170 HydrophobicContact CZ3-CG1 3.83Å
144	F	64.4	Low	87	Confident	72 Å²	72	19.5 Å²	19.5	32%	0.316	9%	0.085	S	C	.	.	S	Bend	trans	-63.8	-45.8	179.3	80.7	-88.7	0	0	0	112.6	R47 N55 M56 E57	R47-F144 PolarHBondContact NH2-O 2.85Å; N55-F144 WeakPolarHBondContact O-CB 3.24Å; M56-F144 CarbonylContact C-O 3.54Å; E57-F144 VanDerWaalsContact CB-O 3.25Å; E57-F144 WeakPolarHBondContact CB-O 3.37Å; E57-F144 WeakPolarHBondContact CG-O 3.5Å; E57-F144 PolarHBondContact N-O 2.78Å
145	E	69	Low	87.4	Confident	30 Å²	30	21 Å²	21	14%	0.14	9%	0.09	C	C	.	.			trans	-83.4	136.5	-179.6	-98	155.8	-168.7	0	0	112	E57 W143 I168 K175	E57-E145 VanDerWaalsContact OE2-CA 3.25Å; E57-E145 WeakPolarHBondContact OE2-CA 3.32Å; W143-E145 VanDerWaalsContact CD1-N 3.35Å; E145-I168 HydrophobicContact CB-CB 4.46Å; E145-I168 HydrophobicContact CB-CG1 4.11Å; E145-I168 HydrophobicContact CB-CG2 3.83Å; E145-K175 WeakPolarHBondContact OE1-CE 3.42Å; E145-K175 IonicContact OE1-NZ 3.83Å; E145-K175 PolarHBondContact OE1-NZ 3.01Å; E145-K175 WeakPolarHBondContact OE2-CE 3.45Å; E145-K175 IonicContact OE2-NZ 2.68Å; E145-K175 PolarHBondContact OE2-NZ 3.16Å
146	A	76.1	Confident	87.6	Confident	5 Å²	5	19.9 Å²	19.9	4%	0.041	9%	0.085	C	C	.	.			trans	-151.6	147.9	176.4	0	0	0	0	0	111.4	E57 F59	E57-A146 HydrophobicContact CB-CB 4.18Å; E57-A146 PolarHBondContact OE2-N 3.08Å; F59-A146 HydrophobicContact CD1-CB 3.91Å; F59-A146 HydrophobicContact CD2-CB 4.3Å; F59-A146 HydrophobicContact CE1-CB 3.79Å; F59-A146 HydrophobicContact CE2-CB 4.22Å; F59-A146 HydrophobicContact CG-CB 4.16Å; F59-A146 HydrophobicContact CZ-CB 3.96Å
147	K	81.2	Confident	87.7	Confident	89 Å²	89	23.8 Å²	23.8	39%	0.387	11%	0.106	S	C	.	.			trans	-143.9	-72.5	176.5	-168.2	171.6	-172.4	169.8	0	112.5	F59 E60 T167	F59-K147 CarbonylContact C-O 3.55Å; E60-K147 PolarHBondContact N-O 3.42Å; K147-T167 HydrophobicContact CB-CG2 4.45Å
148	Y	88	Confident	87.6	Confident	59 Å²	59	25 Å²	25	23%	0.231	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	152.6	176.3	-49.1	-55.3	0	0	0	111.5	E60 N61 N63 L66 T167	E60-Y148 HydrophobicContact CB-CD1 4.39Å; E60-Y148 HydrophobicContact CB-CE1 4.01Å; E60-Y148 WeakPolarHBondContact OE2-CE1 3.45Å; E60-Y148 PolarHBondContact OE2-OH 3.25Å; N61-Y148 HydrophobicContact CB-CD1 4.07Å; N61-Y148 HydrophobicContact CB-CE1 4.17Å; N61-Y148 WeakPolarHBondContact O-CA 2.91Å; N63-Y148 HydrophobicContact CB-CD2 4.45Å; N63-Y148 HydrophobicContact CB-CG 4.12Å; L66-Y148 WeakPolarHBondContact CD1-O 3.36Å; Y148-T167 WeakPolarHBondContact CB-OG1 3.25Å; Y148-T167 PolarHBondContact N-OG1 2.84Å; Y148-T167 PolarHBondContact O-N 3Å; Y148-T167 VanDerWaalsContact O-N 3.13Å; Y148-T167 PolarHBondContact O-OG1 2.96Å
149	V	93	Very high	87.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150	174.8	63	0	0	0	0	109.4	L40 F59 N61 L62 N63 C164 A165 Y166	L40-V149 HydrophobicContact CB-CG1 4.32Å; L40-V149 HydrophobicContact CD1-CG1 3.95Å; F59-V149 HydrophobicContact CB-CG1 4.3Å; F59-V149 HydrophobicContact CD1-CB 3.89Å; F59-V149 HydrophobicContact CD1-CG1 4.17Å; F59-V149 HydrophobicContact CE1-CB 4.14Å; F59-V149 HydrophobicContact CG-CB 4.34Å; F59-V149 HydrophobicContact CG-CG1 4.17Å; N61-V149 PolarHBondContact O-N 2.69Å; L62-V149 WeakPolarHBondContact CA-O 3.47Å; L62-V149 HydrophobicContact CD2-CG1 4.41Å; N63-V149 PolarHBondContact N-O 3.5Å; V149-C164 HydrophobicContact CG2-CB 4.31Å; V149-A165 WeakPolarHBondContact CA-O 3.26Å; V149-Y166 HydrophobicContact CB-CD1 4.12Å; V149-Y166 HydrophobicContact CB-CE1 4.27Å; V149-Y166 HydrophobicContact CG2-CD1 3.73Å; V149-Y166 HydrophobicContact CG2-CE1 3.53Å
150	G	96.7	Very high	88.1	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	137.2	167.3	0	0	0	0	0	109.4	A165	G150-A165 PolarHBondContact N-O 3.37Å; G150-A165 PolarHBondContact O-N 2.9Å
151	C	98.4	Very high	88.5	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.007	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	161.1	-174	-55.4	0	0	0	0	111.8	L31 Q36 M39 I163 C164	L31-C151 HydrophobicContact CD1-CB 3.74Å; Q36-C151 PolarHBondContact NE2-O 3.21Å; Q36-C151 PolarHBondContact OE1-O 3.16Å; M39-C151 HydrophobicContact CG-CB 4.49Å; C151-I163 CarbonylContact C-O 3.57Å; C151-I163 WeakPolarHBondContact CA-O 3.15Å; C151-I163 WeakPolarHBondContact CB-O 3.43Å; C151-C164 HydrophobicContact CB-CB 4.09Å; C151-C164 WeakPolarHBondContact CB-SG 3.48Å; C151-C164 WeakPolarHBondContact SG-CB 3.42Å; C151-C164 CovalentContact SG-SG 2.05Å; C151-C164 PolarHBondContact SG-SG 3.45Å
152	G	98.3	Very high	88.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.3	174.7	0	0	0	0	0	109.7	V162 I163	G152-V162 WeakPolarHBondContact O-CA 3.48Å; G152-I163 PolarHBondContact N-O 2.87Å; G152-I163 PolarHBondContact O-N 3.26Å
153	R	97.7	Very high	89.6	Confident	10 Å²	10	25.7 Å²	25.7	4%	0.038	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.9	178.8	-180	-176.2	71.9	-157.6	-3.9	111.9	D29 L31 Q71 T104 T160 L161 V162	D29-R153 CarbonylContact C-O 3.6Å; D29-R153 VanDerWaalsContact CG-NH2 3.28Å; D29-R153 PolarHBondContact N-O 3.21Å; D29-R153 CarbonylContact O-C 3.58Å; D29-R153 VanDerWaalsContact O-CB 3.23Å; D29-R153 WeakPolarHBondContact O-CB 3.46Å; D29-R153 WeakPolarHBondContact O-CG 3.17Å; D29-R153 PolarHBondContact O-NE 3.31Å; D29-R153 PolarHBondContact O-NH2 3.18Å; D29-R153 VanDerWaalsContact O-O 3.07Å; D29-R153 IonicContact OD1-CZ 3.28Å; D29-R153 IonicContact OD1-NE 3.79Å; D29-R153 IonicContact OD1-NH2 2.76Å; D29-R153 PolarHBondContact OD1-NH2 2.98Å; D29-R153 IonicContact OD2-CZ 3.94Å; D29-R153 IonicContact OD2-NE 3.5Å; D29-R153 PolarHBondContact OD2-NE 3.33Å; D29-R153 VanDerWaalsContact OD2-NE 3.12Å; D29-R153 IonicContact OD2-NH2 3.01Å; D29-R153 PolarHBondContact OD2-NH2 3.32Å; L31-R153 HydrophobicContact CD2-CB 3.63Å; L31-R153 HydrophobicContact CD2-CG 4.28Å; L31-R153 HydrophobicContact CG-CB 4Å; Q71-R153 PolarHBondContact NE2-O 3.39Å; Q71-R153 PolarHBondContact OE1-O 2.92Å; T104-R153 WeakPolarHBondContact O-CD 2.87Å; T104-R153 PolarHBondContact O-NH1 3.37Å; R153-T160 HydrophobicContact CG-CG2 3.91Å; R153-L161 VanDerWaalsContact CA-O 3.26Å; R153-L161 WeakPolarHBondContact CA-O 3.49Å; R153-L161 WeakPolarHBondContact CG-O 3.35Å; R153-V162 HydrophobicContact CB-CG2 4.35Å; R153-V162 HydrophobicContact CG-CG2 4.16Å
154	A	96.7	Very high	90.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.1	169.9	0	0	0	0	0	110.3	A74 L161	A74-A154 HydrophobicContact CB-CB 4.04Å; A74-A154 WeakPolarHBondContact O-CB 3.3Å; A154-L161 PolarHBondContact N-O 3.17Å; A154-L161 PolarHBondContact O-N 2.95Å
155	R	94.6	Very high	92.3	Very high	37 Å²	37	19.1 Å²	19.1	14%	0.14	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118	170.9	-55.2	-59.6	178.5	152.1	6	108.4	N26 R27 D29 M101 A103 N159 T160	N26-R155 CarbonylContact C-O 3.58Å; N26-R155 VanDerWaalsContact CA-O 3.28Å; N26-R155 WeakPolarHBondContact CA-O 3.34Å; R27-R155 PolarHBondContact N-O 3.27Å; R27-R155 PolarHBondContact O-N 3.22Å; D29-R155 HydrophobicContact CB-CG 3.97Å; D29-R155 IonicContact OD2-CZ 3.46Å; D29-R155 IonicContact OD2-NE 3.57Å; D29-R155 PolarHBondContact OD2-NE 2.92Å; D29-R155 IonicContact OD2-NH2 2.69Å; D29-R155 PolarHBondContact OD2-NH2 3.17Å; M101-R155 VanDerWaalsContact C-NH1 3.32Å; M101-R155 HydrophobicContact CE-CB 3.42Å; M101-R155 VanDerWaalsContact CE-CB 3.42Å; M101-R155 HydrophobicContact CE-CG 4.01Å; M101-R155 PolarHBondContact O-NH1 3.31Å; M101-R155 HydrophobicContact SD-CB 3.85Å; A103-R155 PolarHBondContact O-NH1 3.42Å; R155-N159 WeakPolarHBondContact CA-O 3.46Å; R155-T160 PolarHBondContact NH1-OG1 3.33Å
156	C	93.3	Very high	93.5	Very high	5 Å²	5	17.8 Å²	17.8	3%	0.034	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	117.9	-167.3	-57.1	0	0	0	0	110.4	N26 C77 G158 N159 L161	N26-C156 WeakPolarHBondContact OD1-CA 3.48Å; C77-C156 WeakPolarHBondContact CA-SG 3.01Å; C77-C156 HydrophobicContact CB-CB 3.58Å; C77-C156 WeakPolarHBondContact CB-SG 3.33Å; C77-C156 VanDerWaalsContact SG-CA 3.55Å; C77-C156 WeakPolarHBondContact SG-CB 3.45Å; C77-C156 CovalentContact SG-SG 2.03Å; C77-C156 PolarHBondContact SG-SG 3.35Å; C156-G158 VanDerWaalsContact C-N 3.27Å; C156-G158 PolarHBondContact O-N 3.27Å; C156-G158 VanDerWaalsContact O-N 3.14Å; C156-N159 PolarHBondContact N-O 3.48Å; C156-N159 WeakPolarHBondContact O-CA 3.42Å; C156-N159 WeakPolarHBondContact O-CB 3.46Å; C156-N159 PolarHBondContact O-N 3.07Å; C156-L161 HydrophobicContact CB-CB 4.35Å
157	D	90.3	Very high	94.1	Very high	98 Å²	98	19 Å²	19	52%	0.524	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	42.5	174.8	-61.3	-44.1	0	0	0	114.7	N26 N159	N26-D157 PolarHBondContact OD1-N 2.66Å; D157-N159 VanDerWaalsContact C-N 3.31Å; D157-N159 PolarHBondContact O-N 3.16Å; D157-N159 PolarHBondContact O-ND2 3.04Å
158	G	89.7	Confident	94.2	Very high	25 Å²	25	16.1 Å²	16.1	26%	0.258	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	2.6	-179.3	0	0	0	0	0	115.2	G100 M101 C156	G100-G158 CarbonylContact C-O 3.09Å; G100-G158 VanDerWaalsContact C-O 3.26Å; G100-G158 WeakPolarHBondContact CA-O 2.95Å; G100-G158 PolarHBondContact N-O 3.08Å; M101-G158 WeakPolarHBondContact CG-O 3.19Å; M101-G158 PolarHBondContact N-O 3.08Å; M101-G158 WeakPolarHBondContact SD-CA 2.96Å; C156-G158 VanDerWaalsContact C-N 3.27Å; C156-G158 PolarHBondContact O-N 3.27Å; C156-G158 VanDerWaalsContact O-N 3.14Å
159	N	93.7	Very high	93.9	Very high	41 Å²	41	15 Å²	15	22%	0.219	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	166.2	179.1	-58.1	-66.7	0	0	0	111.4	A98 Y99 R155 C156 D157	A98-N159 WeakPolarHBondContact O-CB 3.44Å; Y99-N159 WeakPolarHBondContact CA-OD1 3.3Å; R155-N159 WeakPolarHBondContact CA-O 3.46Å; C156-N159 PolarHBondContact N-O 3.48Å; C156-N159 WeakPolarHBondContact O-CA 3.42Å; C156-N159 WeakPolarHBondContact O-CB 3.46Å; C156-N159 PolarHBondContact O-N 3.07Å; D157-N159 VanDerWaalsContact C-N 3.31Å; D157-N159 PolarHBondContact O-N 3.16Å; D157-N159 PolarHBondContact O-ND2 3.04Å
160	T	94.7	Very high	92.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113	174.4	-55.7	0	0	0	0	109.2	K97 A98 G100 A103 R153 R155	K97-T160 CarbonylContact C-O 3.41Å; K97-T160 WeakPolarHBondContact CA-O 3.5Å; A98-T160 PolarHBondContact N-O 2.91Å; A98-T160 PolarHBondContact O-N 3.41Å; G100-T160 PolarHBondContact O-N 3.09Å; G100-T160 PolarHBondContact O-OG1 2.97Å; A103-T160 PolarHBondContact O-OG1 3.28Å; R153-T160 HydrophobicContact CG-CG2 3.91Å; R155-T160 PolarHBondContact NH1-OG1 3.33Å
161	L	96.1	Very high	91.4	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123.5	177.5	175.3	66	0	0	0	109.2	P78 Y95 K97 R153 A154 C156 I163	P78-L161 HydrophobicContact CG-CD2 4.12Å; Y95-L161 HydrophobicContact CD2-CD1 3.8Å; Y95-L161 HydrophobicContact CG-CD1 4.45Å; K97-L161 HydrophobicContact CG-CD1 3.78Å; R153-L161 VanDerWaalsContact CA-O 3.26Å; R153-L161 WeakPolarHBondContact CA-O 3.49Å; R153-L161 WeakPolarHBondContact CG-O 3.35Å; A154-L161 PolarHBondContact N-O 3.17Å; A154-L161 PolarHBondContact O-N 2.95Å; C156-L161 HydrophobicContact CB-CB 4.35Å; L161-I163 HydrophobicContact CD1-CG1 4.23Å; L161-I163 HydrophobicContact CD2-CD1 4.21Å; L161-I163 HydrophobicContact CD2-CG1 4.35Å; L161-I163 HydrophobicContact CG-CG1 4.13Å
162	V	97.4	Very high	89.7	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.3	168.5	177.1	0	0	0	0	108.6	M39 Y95 N96 Y109 G152 R153	M39-V162 HydrophobicContact CE-CG1 4.31Å; Y95-V162 CarbonylContact C-O 3.21Å; Y95-V162 WeakPolarHBondContact CA-O 3.33Å; N96-V162 PolarHBondContact N-O 3.16Å; N96-V162 PolarHBondContact O-N 2.69Å; Y109-V162 HydrophobicContact CD2-CB 4.07Å; Y109-V162 HydrophobicContact CD2-CG1 3.8Å; Y109-V162 HydrophobicContact CE2-CG1 4.33Å; Y109-V162 HydrophobicContact CG-CG1 4.42Å; G152-V162 WeakPolarHBondContact O-CA 3.48Å; R153-V162 HydrophobicContact CB-CG2 4.35Å; R153-V162 HydrophobicContact CG-CG2 4.16Å
163	I	97.9	Very high	87.3	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.5	172.1	-57.8	-173.1	0	0	0	107.2	A70 L73 A74 P78 L81 L93 A94 C151 G152 L161	A70-I163 HydrophobicContact CB-CG2 4.29Å; A70-I163 WeakPolarHBondContact CB-O 3.27Å; L73-I163 HydrophobicContact CB-CD1 3.79Å; A74-I163 HydrophobicContact CB-CD1 4.22Å; A74-I163 HydrophobicContact CB-CG1 4.32Å; P78-I163 HydrophobicContact CG-CD1 4Å; L81-I163 HydrophobicContact CD1-CG2 4.37Å; L81-I163 HydrophobicContact CD2-CD1 4.49Å; L93-I163 HydrophobicContact CD2-CG2 4.24Å; A94-I163 CarbonylContact O-C 3.48Å; A94-I163 WeakPolarHBondContact O-CA 3.15Å; C151-I163 CarbonylContact C-O 3.57Å; C151-I163 WeakPolarHBondContact CA-O 3.15Å; C151-I163 WeakPolarHBondContact CB-O 3.43Å; G152-I163 PolarHBondContact N-O 2.87Å; G152-I163 PolarHBondContact O-N 3.26Å; L161-I163 HydrophobicContact CD1-CG1 4.23Å; L161-I163 HydrophobicContact CD2-CD1 4.21Å; L161-I163 HydrophobicContact CD2-CG1 4.35Å; L161-I163 HydrophobicContact CG-CG1 4.13Å
164	C	98.2	Very high	84.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	139.4	169.6	-63.1	0	0	0	0	110.5	M39 L93 A94 Y109 V149 C151 Y166	M39-C164 WeakPolarHBondContact CE-SG 3.5Å; L93-C164 WeakPolarHBondContact CA-O 3.44Å; A94-C164 PolarHBondContact N-O 3.37Å; A94-C164 VanDerWaalsContact N-O 3.08Å; A94-C164 PolarHBondContact O-N 3.12Å; Y109-C164 HydrophobicContact CE2-CB 4.37Å; Y109-C164 WeakPolarHBondContact OH-CB 3.35Å; V149-C164 HydrophobicContact CG2-CB 4.31Å; C151-C164 HydrophobicContact CB-CB 4.09Å; C151-C164 WeakPolarHBondContact CB-SG 3.48Å; C151-C164 WeakPolarHBondContact SG-CB 3.42Å; C151-C164 CovalentContact SG-SG 2.05Å; C151-C164 PolarHBondContact SG-SG 3.45Å; C164-Y166 HydrophobicContact CB-CE1 4.43Å; C164-Y166 HydrophobicContact CB-CE2 3.65Å; C164-Y166 WeakPolarHBondContact CB-OH 3.33Å; C164-Y166 WeakPolarHBondContact O-CE2 3.27Å
165	A	97.7	Very high	81.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.9	171.5	0	0	0	0	0	110.2	L66 Y69 A70 G92 L93 V149 G150	L66-A165 HydrophobicContact CB-CB 4.07Å; L66-A165 HydrophobicContact CD2-CB 4.19Å; Y69-A165 HydrophobicContact CD1-CB 4.11Å; A70-A165 HydrophobicContact CB-CB 4.02Å; G92-A165 CarbonylContact O-C 3.54Å; G92-A165 VanDerWaalsContact O-CA 3.25Å; G92-A165 WeakPolarHBondContact O-CA 3.49Å; L93-A165 HydrophobicContact CD2-CB 3.88Å; V149-A165 WeakPolarHBondContact CA-O 3.26Å; G150-A165 PolarHBondContact N-O 3.37Å; G150-A165 PolarHBondContact O-N 2.9Å
166	Y	94.7	Very high	78.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.008	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.7	-172.8	-56.3	-89.3	0	0	0	109.9	H43 F59 Y91 G92 A94 Y109 Q140 V149 C164 I168	H43-Y166 AromaticContact CD2-CE1 3.74Å; H43-Y166 AromaticContact NE2-CE1 3.41Å; H43-Y166 WeakPolarHBondContact NE2-CE1 3.48Å; H43-Y166 AromaticContact NE2-CZ 3.49Å; H43-Y166 PolarHBondContact NE2-OH 3.35Å; F59-Y166 AromaticContact CE1-CD1 3.55Å; F59-Y166 HydrophobicContact CE1-CD1 3.55Å; F59-Y166 HydrophobicContact CE1-CE1 4.14Å; F59-Y166 HydrophobicContact CE2-CD1 4.49Å; F59-Y166 HydrophobicContact CE2-CE1 4.33Å; F59-Y166 AromaticContact CZ-CD1 3.45Å; F59-Y166 HydrophobicContact CZ-CD1 3.45Å; F59-Y166 VanDerWaalsContact CZ-CD1 3.45Å; F59-Y166 AromaticContact CZ-CE1 3.66Å; F59-Y166 HydrophobicContact CZ-CE1 3.66Å; Y91-Y166 WeakPolarHBondContact CB-O 3.41Å; G92-Y166 PolarHBondContact N-O 3.04Å; G92-Y166 PolarHBondContact O-N 3.23Å; A94-Y166 HydrophobicContact CB-CE2 4.19Å; Y109-Y166 WeakPolarHBondContact CE1-OH 3.48Å; Y109-Y166 PolarHBondContact OH-OH 3.27Å; Q140-Y166 HydrophobicContact CB-CD2 3.61Å; Q140-Y166 HydrophobicContact CB-CE1 4.37Å; Q140-Y166 HydrophobicContact CB-CE2 3.37Å; Q140-Y166 HydrophobicContact CB-CG 4.22Å; Q140-Y166 HydrophobicContact CG-CD2 3.86Å; Q140-Y166 HydrophobicContact CG-CE2 3.84Å; V149-Y166 HydrophobicContact CB-CD1 4.12Å; V149-Y166 HydrophobicContact CB-CE1 4.27Å; V149-Y166 HydrophobicContact CG2-CD1 3.73Å; V149-Y166 HydrophobicContact CG2-CE1 3.53Å; C164-Y166 HydrophobicContact CB-CE1 4.43Å; C164-Y166 HydrophobicContact CB-CE2 3.65Å; C164-Y166 WeakPolarHBondContact CB-OH 3.33Å; C164-Y166 WeakPolarHBondContact O-CE2 3.27Å; Y166-I168 WeakPolarHBondContact CB-O 3.35Å; Y166-I168 PolarHBondContact O-N 3.25Å
167	T	88.1	Confident	75.9	Confident	29 Å²	29	45.5 Å²	45.5	18%	0.178	25%	0.25	C	S	.	.	S	Bend	trans	-59	-39	174.9	-52.7	0	0	0	0	111.6	K147 Y148	K147-T167 HydrophobicContact CB-CG2 4.45Å; Y148-T167 WeakPolarHBondContact CB-OG1 3.25Å; Y148-T167 PolarHBondContact N-OG1 2.84Å; Y148-T167 PolarHBondContact O-N 3Å; Y148-T167 VanDerWaalsContact O-N 3.13Å; Y148-T167 PolarHBondContact O-OG1 2.96Å
168	I	82.2	Confident	73.2	Confident	29 Å²	29	48.3 Å²	48.3	15%	0.149	26%	0.258	C	S	.	.	S	Bend	trans	-94.2	129.4	179.5	-53.4	-60.5	0	0	0	108.5	E145 Y166 V170 T177	E145-I168 HydrophobicContact CB-CB 4.46Å; E145-I168 HydrophobicContact CB-CG1 4.11Å; E145-I168 HydrophobicContact CB-CG2 3.83Å; Y166-I168 WeakPolarHBondContact CB-O 3.35Å; Y166-I168 PolarHBondContact O-N 3.25Å; I168-V170 HydrophobicContact CG2-CG2 4.44Å; I168-T177 HydrophobicContact CD1-CG2 4.18Å
169	K	83.3	Confident	70.3	Confident	35 Å²	35	55.2 Å²	55.2	15%	0.152	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.6	-177.1	179.3	178.2	177.7	175.3	0	110.6	L86 Q87 S89 I171	L86-K169 WeakPolarHBondContact O-CE 3.41Å; L86-K169 PolarHBondContact O-NZ 2.88Å; Q87-K169 PolarHBondContact O-NZ 2.86Å; S89-K169 PolarHBondContact O-NZ 3.21Å; K169-I171 HydrophobicContact CD-CD1 4.45Å; K169-I171 HydrophobicContact CG-CG1 4.31Å
170	V	69.6	Low	67.2	Low	6 Å²	6	58.9 Å²	58.9	4%	0.036	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	114.5	-180	-171.8	0	0	0	0	109.5	R139 Q140 W143 I168	R139-V170 HydrophobicContact CB-CG1 4.15Å; Q140-V170 PolarHBondContact NE2-O 2.68Å; W143-V170 HydrophobicContact CB-CG2 3.72Å; W143-V170 HydrophobicContact CD2-CB 4.25Å; W143-V170 HydrophobicContact CD2-CG1 3.67Å; W143-V170 HydrophobicContact CD2-CG2 3.52Å; W143-V170 HydrophobicContact CE3-CG1 3.56Å; W143-V170 HydrophobicContact CE3-CG2 4.26Å; W143-V170 HydrophobicContact CG-CB 4.36Å; W143-V170 HydrophobicContact CG-CG1 4.27Å; W143-V170 HydrophobicContact CG-CG2 3.25Å; W143-V170 HydrophobicContact CH2-CG1 4.16Å; W143-V170 HydrophobicContact CZ2-CG1 4.22Å; W143-V170 HydrophobicContact CZ3-CG1 3.83Å; I168-V170 HydrophobicContact CG2-CG2 4.44Å
171	I	67.1	Low	63.9	Low	30 Å²	30	67.4 Å²	67.4	15%	0.154	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.9	172.6	-61.5	-175.5	0	0	0	108.3	L86 Q87 K169 G173 I174	L86-I171 HydrophobicContact CB-CD1 4.32Å; Q87-I171 VanDerWaalsContact CA-CD1 3.47Å; Q87-I171 HydrophobicContact CB-CD1 4.17Å; Q87-I171 HydrophobicContact CG-CD1 3.66Å; Q87-I171 HydrophobicContact CG-CG2 4.33Å; K169-I171 HydrophobicContact CD-CD1 4.45Å; K169-I171 HydrophobicContact CG-CG1 4.31Å; I171-G173 PolarHBondContact O-N 2.75Å; I171-I174 PolarHBondContact O-N 2.74Å
172	K	61.5	Low	60.6	Low	146 Å²	146	76.2 Å²	76.2	64%	0.635	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	110.4	169	-174.4	177.2	-178	173.1	0	109.9
173	G	48.4	Very low	57.1	Low	69 Å²	69	83.1 Å²	83.1	71%	0.711	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	0.3	171.9	0	0	0	0	0	118	I171	I171-G173 PolarHBondContact O-N 2.75Å
174	I	40.7	Very low	53.5	Low	105 Å²	105	92.7 Å²	92.7	54%	0.538	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	132.5	179	-57.2	178.7	0	0	0	111.2	I171 E176	I171-I174 PolarHBondContact O-N 2.74Å; I174-E176 HydrophobicContact CG2-CG 4.29Å
175	K	39.4	Very low	50	Low	116 Å²	116	101.6 Å²	101.6	50%	0.504	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118	168.8	-174.5	-174	-176.1	-171.6	0	108.7	E145	E145-K175 WeakPolarHBondContact OE1-CE 3.42Å; E145-K175 IonicContact OE1-NZ 3.83Å; E145-K175 PolarHBondContact OE1-NZ 3.01Å; E145-K175 WeakPolarHBondContact OE2-CE 3.45Å; E145-K175 IonicContact OE2-NZ 2.68Å; E145-K175 PolarHBondContact OE2-NZ 3.16Å
176	E	32.4	Very low	46.6	Very low	125 Å²	125	109.7 Å²	109.7	58%	0.584	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.8	167.2	-81.3	-171.2	-176.8	0	0	109.8	I174	I174-E176 HydrophobicContact CG2-CG 4.29Å
177	T	32	Very low	43.2	Very low	97 Å²	97	118.8 Å²	118.8	60%	0.595	59%	0.587	S	S	*	*			trans	-101.7	130.7	170.5	24.4	0	0	0	0	109.5	I168	I168-T177 HydrophobicContact CD1-CG2 4.18Å
178	K	33.3	Very low	40.2	Very low	158 Å²	158	126.3 Å²	126.3	69%	0.687	62%	0.62	S	S	*	*			trans	-120.9	115.9	167.4	-71.9	-174.7	-179.3	176.1	0	109.2
179	E	28.5	Very low	37.4	Very low	170 Å²	170	131.1 Å²	131.1	79%	0.794	65%	0.651	S	S	*	*			trans	-67.2	137.5	170.3	-74.7	-178	155	0	0	110.6	K181	E179-K181 PolarHBondContact O-N 3.11Å
180	I	27.9	Very low	34.6	Very low	117 Å²	117	138.8 Å²	138.8	60%	0.6	68%	0.684	S	S	*	*			trans	-69.1	96	168	-57.4	170	0	0	0	106.8	E182	I180-E182 PolarHBondContact O-N 2.79Å
181	K	25.7	Very low	32.4	Very low	179 Å²	179	147.4 Å²	147.4	78%	0.778	72%	0.724	S	S	*	*			trans	-79.9	112.9	165.8	-75.7	-175.2	177.4	-179.1	0	108.2	E179 T183	E179-K181 PolarHBondContact O-N 3.11Å; K181-T183 PolarHBondContact O-N 3.24Å
182	E	27.3	Very low	30.4	Very low	186 Å²	186	154 Å²	154	87%	0.869	76%	0.758	S	S	*	*			trans	-48.9	128	161.1	-85.9	-177.2	150.8	0	0	109	I180 K184	I180-E182 PolarHBondContact O-N 2.79Å; E182-K184 PolarHBondContact O-N 3.34Å
183	T	22.5	Very low	28.7	Very low	146 Å²	146	156.4 Å²	156.4	90%	0.896	77%	0.768	S	S	*	*			trans	-56.3	102.8	-179.4	26.6	0	0	0	0	111.4	K181	K181-T183 PolarHBondContact O-N 3.24Å
184	K	24	Very low	27.6	Very low	202 Å²	202	161 Å²	161	88%	0.878	77%	0.771	S	S	*	*			trans	-121.6	127.3	143.8	-86.1	-175.9	176.1	176.2	0	108.3	E182	E182-K184 PolarHBondContact O-N 3.34Å
185	E	23.9	Very low	26.7	Very low	186 Å²	186	163 Å²	163	87%	0.869	79%	0.788	S	S	*	*			trans	-39.9	142.8	175.5	-64.7	172.6	127.3	0	0	112.7
186	I	26	Very low	26	Very low	171 Å²	171	165.8 Å²	165.8	88%	0.877	80%	0.8	S	S	*	*				-174.4	135.3	125	-86.6	146.9	0	0	0	109
187	K	23.4	Very low	25.5	Very low	192 Å²	192	169.4 Å²	169.4	84%	0.835	82%	0.818	S	S	*	*			trans	-59.5	136	173.5	-63.9	164	174.1	174	0	111.7
188	E	25.9	Very low	25.2	Very low	187 Å²	187	170.2 Å²	170.2	87%	0.874	82%	0.822	S	S	*	*				171.9	136.7	114.8	-100.7	-176.9	158.7	0	0	112.2
189	T	23	Very low	24.7	Very low	130 Å²	130	170.9 Å²	170.9	80%	0.798	83%	0.828	S	S	*	*			trans	-53	132.1	165.8	27.9	0	0	0	0	114.3
190	K	24.8	Very low	24.4	Very low	197 Å²	197	168.7 Å²	168.7	86%	0.857	83%	0.828	S	S	*	*				-177.5	150.5	122.3	-104	173.7	179	-180	0	113.1
191	E	23.1	Very low	24.2	Very low	186 Å²	186	168.2 Å²	168.2	87%	0.869	83%	0.83	S	S	*	*			trans	-44.5	140.3	-177.2	-63.7	168.1	129.3	0	0	115.3
192	I	25.9	Very low	24	Very low	168 Å²	168	165.8 Å²	165.8	86%	0.862	83%	0.83	S	S	*	*			trans	-125.3	104.4	161.7	-58.5	176.5	0	0	0	108.1
193	K	23.8	Very low	24	Very low	198 Å²	198	163.6 Å²	163.6	86%	0.861	82%	0.824	S	S	*	*			trans	-98.4	118.7	155.3	-87.1	-179.8	174.8	175.9	0	106.9
194	E	26.1	Very low	24.1	Very low	166 Å²	166	164.4 Å²	164.4	78%	0.776	82%	0.817	S	S	*	*			trans	178.4	116.2	130.8	-110.1	-178.4	169	0	0	110	K196	E194-K196 PolarHBondContact O-N 2.95Å
195	T	22.6	Very low	24.1	Very low	146 Å²	146	163.7 Å²	163.7	90%	0.896	82%	0.817	S	S	*	*			trans	-62.9	113.9	160.9	28.7	0	0	0	0	109.7
196	K	24.6	Very low	24.1	Very low	174 Å²	174	161.8 Å²	161.8	76%	0.757	81%	0.813	S	S	*	*			trans	-103.6	124.5	159.8	-76.5	-170.7	177.4	-178.3	0	109.3	E194 V198	E194-K196 PolarHBondContact O-N 2.95Å; K196-V198 PolarHBondContact O-N 3.45Å
197	E	21.7	Very low	24.2	Very low	202 Å²	202	159.9 Å²	159.9	94%	0.944	80%	0.803	S	S	*	*			trans	-61.1	117.9	164.8	-160.5	168.6	-157.4	0	0	107.5
198	V	25.1	Very low	24.5	Very low	114 Å²	114	156.4 Å²	156.4	69%	0.691	80%	0.797	S	S	*	*			trans	-105.9	112	-177.9	177	0	0	0	0	108.3	K196 V201	K196-V198 PolarHBondContact O-N 3.45Å; V198-V201 HydrophobicContact CG1-CG2 4.19Å
199	E	21.9	Very low	24.9	Very low	172 Å²	172	153.2 Å²	153.2	80%	0.804	79%	0.787	S	S	*	*			trans	-56.2	149.6	162.3	-82.8	-175.6	154.3	0	0	110.7	V201	E199-V201 PolarHBondContact O-N 3.25Å
200	P	22.8	Very low	25.3	Very low	123 Å²	123	154.9 Å²	154.9	80%	0.799	79%	0.785	S	S	*	*			trans	-59	112.3	-177.6	23.6	-32.3	0	0	0	110.5	V202	P200-V202 PolarHBondContact O-N 3.49Å
201	V	24.2	Very low	25.5	Very low	107 Å²	107	148.2 Å²	148.2	65%	0.648	76%	0.762	S	S	*	*			trans	-64	108.5	173.2	177.4	0	0	0	0	108	V198 E199 L203	V198-V201 HydrophobicContact CG1-CG2 4.19Å; E199-V201 PolarHBondContact O-N 3.25Å; V201-L203 HydrophobicContact CG1-CD1 4.1Å; V201-L203 PolarHBondContact O-N 3.05Å; V201-L203 VanDerWaalsContact O-N 3.09Å
202	V	22.4	Very low	25.8	Very low	129 Å²	129	143.6 Å²	143.6	78%	0.782	75%	0.748	S	S	*	*			trans	-66	100.5	158.5	179.9	0	0	0	0	106	P200 H204	P200-V202 PolarHBondContact O-N 3.49Å; V202-H204 PolarHBondContact O-N 2.84Å
203	L	27	Very low	26.1	Very low	140 Å²	140	144.9 Å²	144.9	73%	0.733	75%	0.75	S	S	*	*			trans	-67.5	123	-174.5	-154.4	81.5	0	0	0	109.6	V201	V201-L203 HydrophobicContact CG1-CD1 4.1Å; V201-L203 PolarHBondContact O-N 3.05Å; V201-L203 VanDerWaalsContact O-N 3.09Å
204	H	23.3	Very low	26.6	Very low	162 Å²	162	142.4 Å²	142.4	75%	0.75	74%	0.741	S	S	*	*			trans	-61.3	145.4	175.7	-82	50.9	0	0	0	111.5	V202 N206	V202-H204 PolarHBondContact O-N 2.84Å; H204-N206 PolarHBondContact O-N 2.92Å
205	Q	23.7	Very low	26.8	Very low	187 Å²	187	138.9 Å²	138.9	87%	0.874	72%	0.723	S	S	*	*			trans	-55.4	97.4	168.1	-68.2	163.5	-39.9	0	0	110.2
206	N	25.6	Very low	27	Very low	147 Å²	147	140.2 Å²	140.2	79%	0.786	72%	0.717	S	S	*	*			trans	-115.1	102.2	158.1	-83.4	-30	0	0	0	107.5	H204 V208	H204-N206 PolarHBondContact O-N 2.92Å; N206-V208 PolarHBondContact O-N 3.27Å
207	I	27.2	Very low	27.2	Very low	131 Å²	131	136.8 Å²	136.8	67%	0.672	71%	0.706	S	S	*	*			trans	-66.5	114.6	173.6	-60	168.4	0	0	0	106.6	D209	I207-D209 VanDerWaalsContact CG2-OD1 3.24Å; I207-D209 WeakPolarHBondContact CG2-OD1 3.26Å; I207-D209 PolarHBondContact O-N 2.79Å
208	V	29.6	Very low	27.7	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.715	69%	0.69	S	S	*	*			trans	-76.8	98.8	166.9	-179.5	0	0	0	0	106.6	N206 H210	N206-V208 PolarHBondContact O-N 3.27Å; V208-H210 PolarHBondContact O-N 2.86Å; V208-H210 VanDerWaalsContact O-N 3.12Å
209	D	34.5	Very low	27.8	Very low	121 Å²	121	136.3 Å²	136.3	65%	0.647	69%	0.692	S	S	*	*	S	Bend	trans	-68.3	-6	-172.5	-86.7	-32.6	0	0	0	115.1	I207	I207-D209 VanDerWaalsContact CG2-OD1 3.24Å; I207-D209 WeakPolarHBondContact CG2-OD1 3.26Å; I207-D209 PolarHBondContact O-N 2.79Å
210	H	30.6	Very low	28.1	Very low	165 Å²	165	136.5 Å²	136.5	76%	0.764	69%	0.687	S	S	*	*			trans	-145.8	83.6	-175.5	-61.2	78.5	0	0	0	111.8	V208	V208-H210 PolarHBondContact O-N 2.86Å; V208-H210 VanDerWaalsContact O-N 3.12Å
211	P	30	Very low	28.8	Very low	56 Å²	56	139.1 Å²	139.1	36%	0.364	69%	0.688	S	S	.	*			trans	-73.1	155.5	167.5	32.3	-33.3	0	0	0	110.2	F215 I217	P211-F215 HydrophobicContact CB-CB 3.95Å; P211-F215 HydrophobicContact CG-CB 4.29Å; P211-I217 HydrophobicContact CG-CD1 4.35Å
212	P	29	Very low	29.4	Very low	89 Å²	89	141.7 Å²	141.7	58%	0.578	70%	0.698	S	S	*	*			trans	-54.2	154.1	179.6	-21.6	30.2	0	0	0	112.2	H214 F215	P212-H214 PolarHBondContact O-N 2.7Å; P212-F215 HydrophobicContact CB-CD2 3.94Å; P212-F215 HydrophobicContact CB-CE2 3.99Å; P212-F215 HydrophobicContact CG-CD2 4.08Å; P212-F215 HydrophobicContact CG-CE2 3.96Å; P212-F215 WeakPolarHBondContact O-CD2 3.17Å; P212-F215 PolarHBondContact O-N 2.73Å; P212-F215 VanDerWaalsContact O-N 3.09Å
213	E	33	Very low	30.1	Very low	195 Å²	195	139 Å²	139	91%	0.911	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	3.4	-169.1	-68.7	-171.7	156.4	0	0	117.1
214	H	33.8	Very low	30.3	Very low	147 Å²	147	139.7 Å²	139.7	68%	0.681	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	10.8	176.7	-60.9	-60.3	0	0	0	114.7	P212	P212-H214 PolarHBondContact O-N 2.7Å
215	F	31.2	Very low	31.1	Very low	91 Å²	91	134.9 Å²	134.9	40%	0.399	67%	0.666	S	S	.	*			trans	-114.8	119	-179.1	-64.8	-87.9	0	0	0	111	P211 P212 L228	P211-F215 HydrophobicContact CB-CB 3.95Å; P211-F215 HydrophobicContact CG-CB 4.29Å; P212-F215 HydrophobicContact CB-CD2 3.94Å; P212-F215 HydrophobicContact CB-CE2 3.99Å; P212-F215 HydrophobicContact CG-CD2 4.08Å; P212-F215 HydrophobicContact CG-CE2 3.96Å; P212-F215 WeakPolarHBondContact O-CD2 3.17Å; P212-F215 PolarHBondContact O-N 2.73Å; P212-F215 VanDerWaalsContact O-N 3.09Å; F215-L228 HydrophobicContact CD1-CD1 4.18Å; F215-L228 HydrophobicContact CE1-CD1 3.74Å
216	K	26.2	Very low	32.3	Very low	174 Å²	174	132.1 Å²	132.1	76%	0.757	65%	0.652	S	S	*	*			trans	-106.8	126.2	175.9	-148.7	174.6	-172.4	179.9	0	109.9
217	I	28.1	Very low	33.5	Very low	103 Å²	103	125.4 Å²	125.4	53%	0.528	62%	0.616	S	S	.	*			trans	-85.2	126	178.7	-57.9	171.1	0	0	0	108.4	P211 Y219	P211-I217 HydrophobicContact CG-CD1 4.35Å; I217-Y219 HydrophobicContact CG2-CD2 4.34Å; I217-Y219 HydrophobicContact CG2-CE1 4.25Å; I217-Y219 HydrophobicContact CG2-CE2 3.77Å
218	I	32.5	Very low	34.6	Very low	119 Å²	119	122.1 Å²	122.1	61%	0.61	60%	0.6	S	S	*	*			trans	-123.9	134.4	168.9	-57.5	-180	0	0	0	108.7	F226	I218-F226 WeakPolarHBondContact O-CE2 3.44Å
219	Y	27.2	Very low	35.3	Very low	186 Å²	186	117.3 Å²	117.3	73%	0.729	57%	0.571	S	S	*	*			trans	-98.1	127.4	-175.3	-61.1	-92.8	0	0	0	110.5	I217	I217-Y219 HydrophobicContact CG2-CD2 4.34Å; I217-Y219 HydrophobicContact CG2-CE1 4.25Å; I217-Y219 HydrophobicContact CG2-CE2 3.77Å
220	Y	28.9	Very low	35.7	Very low	176 Å²	176	113.1 Å²	113.1	69%	0.69	55%	0.551	S	S	*	*	S	Bend	trans	-128.6	121.8	160.8	-121.1	-92.4	0	0	0	109.7	N222 S223	Y220-N222 VanDerWaalsContact C-N 3.27Å; Y220-N222 PolarHBondContact O-N 2.73Å; Y220-S223 PolarHBondContact O-N 3.38Å
221	Q	35.9	Very low	36.2	Very low	178 Å²	178	111.4 Å²	111.4	83%	0.832	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.8	45.3	169.5	-62	-170.8	-19.7	0	0	116.2	S223	Q221-S223 VanDerWaalsContact C-N 3.3Å; Q221-S223 PolarHBondContact O-N 2.74Å
222	N	38.1	Very low	37.1	Very low	161 Å²	161	116.7 Å²	116.7	86%	0.861	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.9	30	170	-68.2	1.1	0	0	0	116.4	Y220	Y220-N222 VanDerWaalsContact C-N 3.27Å; Y220-N222 PolarHBondContact O-N 2.73Å
223	S	36.8	Very low	38.4	Very low	72 Å²	72	114.1 Å²	114.1	50%	0.503	55%	0.546	S	S	.	.			trans	-135.6	118	168.4	-65.1	0	0	0	0	110.5	Y220 Q221	Y220-S223 PolarHBondContact O-N 3.38Å; Q221-S223 VanDerWaalsContact C-N 3.3Å; Q221-S223 PolarHBondContact O-N 2.74Å
224	Q	32.1	Very low	40	Very low	155 Å²	155	110.4 Å²	110.4	72%	0.724	53%	0.527	S	S	*	.			trans	-62.8	158.4	172.1	-62.4	165.6	-13.2	0	0	107.6	I54	I54-Q224 CarbonylContact O-C 3.59Å
225	V	40.2	Very low	41.4	Very low	61 Å²	61	103.6 Å²	103.6	37%	0.37	50%	0.496	S	S	.	.			cis	-152.2	144.1	40.3	-179	0	0	0	0	108.8	M56	M56-V225 VanDerWaalsContact O-CB 3.25Å; M56-V225 WeakPolarHBondContact O-CB 3.22Å; M56-V225 WeakPolarHBondContact O-CG1 3.47Å
226	F	47.2	Very low	43.8	Very low	129 Å²	129	104 Å²	104	57%	0.566	50%	0.5	S	S	*	.			trans	-116.5	113.2	175.1	-66.8	-82.9	0	0	0	111.6	C58 I218	C58-F226 PolarHBondContact SG-O 2.91Å; C58-F226 VanDerWaalsContact SG-O 3.35Å; I218-F226 WeakPolarHBondContact O-CE2 3.44Å
227	C	52.6	Low	46.9	Very low	6 Å²	6	101 Å²	101	4%	0.041	49%	0.492	C	S	.	.			trans	-83	114.4	164.1	-55.9	0	0	0	0	108.7	N44 E57 C58	N44-C227 HydrophobicContact CB-CB 3.78Å; N44-C227 WeakPolarHBondContact O-CB 3.39Å; E57-C227 PolarHBondContact O-SG 3.27Å; C58-C227 WeakPolarHBondContact CA-SG 3.19Å; C58-C227 HydrophobicContact CB-CB 3.63Å; C58-C227 WeakPolarHBondContact CB-SG 3.49Å; C58-C227 WeakPolarHBondContact SG-CA 3.39Å; C58-C227 WeakPolarHBondContact SG-CB 3.38Å; C58-C227 PolarHBondContact SG-N 3.42Å; C58-C227 CovalentContact SG-SG 2.04Å; C58-C227 PolarHBondContact SG-SG 2.84Å
228	L	48.3	Very low	50	Low	63 Å²	63	98.3 Å²	98.3	33%	0.33	48%	0.478	S	S	.	.	S	Bend	trans	-45.3	157.7	-173.3	-67.5	175.2	0	0	0	113.7	F215	F215-L228 HydrophobicContact CD1-CD1 4.18Å; F215-L228 HydrophobicContact CE1-CD1 3.74Å
229	P	44.4	Very low	53	Low	17 Å²	17	95.7 Å²	95.7	11%	0.11	46%	0.463	C	S	.	.				-101.7	154.2	-50.2	40.7	-30.8	0	0	0	108.2	R48 D233	R48-P229 PolarHBondContact NH1-O 3.01Å; P229-D233 VanDerWaalsContact C-OD2 3.26Å; P229-D233 WeakPolarHBondContact CA-OD2 3.27Å; P229-D233 HydrophobicContact CB-CB 3.63Å; P229-D233 WeakPolarHBondContact CB-OD2 3.43Å; P229-D233 HydrophobicContact CG-CB 3.96Å
230	S	42.8	Very low	56.2	Low	33 Å²	33	91.6 Å²	91.6	23%	0.231	45%	0.451	C	S	.	.			trans	-50.2	162.4	-172.3	74.9	0	0	0	0	114.3	Q232 D233	S230-Q232 PolarHBondContact O-N 3.05Å; S230-Q232 WeakPolarHBondContact OG-CA 3.39Å; S230-Q232 VanDerWaalsContact OG-CB 3.32Å; S230-Q232 WeakPolarHBondContact OG-CB 3.16Å; S230-Q232 PolarHBondContact OG-N 3.38Å; S230-D233 WeakPolarHBondContact CA-OD2 2.93Å; S230-D233 WeakPolarHBondContact CB-OD2 3.19Å; S230-D233 PolarHBondContact N-OD2 3.41Å; S230-D233 WeakPolarHBondContact O-CB 3.24Å; S230-D233 PolarHBondContact O-N 3.23Å; S230-D233 VanDerWaalsContact OG-CG 3.25Å; S230-D233 PolarHBondContact OG-N 3.02Å; S230-D233 PolarHBondContact OG-OD2 3.46Å
231	M	41.9	Very low	59.5	Low	129 Å²	129	83.2 Å²	83.2	64%	0.635	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-5.5	164.5	-75.7	-172.6	164.9	0	0	113.2	F234	M231-F234 WeakPolarHBondContact O-CD2 3.5Å; M231-F234 WeakPolarHBondContact O-CE2 3.49Å
232	Q	48.3	Very low	62.4	Low	167 Å²	167	75.4 Å²	75.4	78%	0.78	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.4	170.9	-65.9	150.1	1	0	0	112	S230 F234	S230-Q232 PolarHBondContact O-N 3.05Å; S230-Q232 WeakPolarHBondContact OG-CA 3.39Å; S230-Q232 VanDerWaalsContact OG-CB 3.32Å; S230-Q232 WeakPolarHBondContact OG-CB 3.16Å; S230-Q232 PolarHBondContact OG-N 3.38Å; Q232-F234 PolarHBondContact O-N 3.03Å; Q232-F234 VanDerWaalsContact O-N 3.16Å
233	D	56.4	Low	65.2	Low	34 Å²	34	68.3 Å²	68.3	18%	0.182	34%	0.343	C	S	.	.			trans	-91.3	49.8	179.8	-67.9	-47.6	0	0	0	111.8	P229 S230 R286 C337	P229-D233 VanDerWaalsContact C-OD2 3.26Å; P229-D233 WeakPolarHBondContact CA-OD2 3.27Å; P229-D233 HydrophobicContact CB-CB 3.63Å; P229-D233 WeakPolarHBondContact CB-OD2 3.43Å; P229-D233 HydrophobicContact CG-CB 3.96Å; S230-D233 WeakPolarHBondContact CA-OD2 2.93Å; S230-D233 WeakPolarHBondContact CB-OD2 3.19Å; S230-D233 PolarHBondContact N-OD2 3.41Å; S230-D233 WeakPolarHBondContact O-CB 3.24Å; S230-D233 PolarHBondContact O-N 3.23Å; S230-D233 VanDerWaalsContact OG-CG 3.25Å; S230-D233 PolarHBondContact OG-N 3.02Å; S230-D233 PolarHBondContact OG-OD2 3.46Å; D233-R286 HydrophobicContact CB-CB 4.46Å; D233-R286 VanDerWaalsContact CB-O 3.23Å; D233-R286 WeakPolarHBondContact CB-O 3.24Å; D233-C337 WeakPolarHBondContact O-CA 3.33Å; D233-C337 WeakPolarHBondContact O-CB 3.2Å
234	F	68.3	Low	68	Low	117 Å²	117	64.9 Å²	64.9	51%	0.513	32%	0.319	S	S	.	.			trans	-68.6	138.4	161.6	-68.3	-79.2	0	0	0	108.4	M231 Q232 E236	M231-F234 WeakPolarHBondContact O-CD2 3.5Å; M231-F234 WeakPolarHBondContact O-CE2 3.49Å; Q232-F234 PolarHBondContact O-N 3.03Å; Q232-F234 VanDerWaalsContact O-N 3.16Å; F234-E236 PolarHBondContact O-N 2.82Å
235	A	63.1	Low	71	Confident	4 Å²	4	59.7 Å²	59.7	3%	0.033	29%	0.293	C	S	.	.			trans	-61.6	126.6	161.6	0	0	0	0	0	107.9	L238 A280 C287 L290 W383	A235-L238 HydrophobicContact CB-CD2 3.9Å; A235-L238 WeakPolarHBondContact O-CG 3.5Å; A235-A280 HydrophobicContact CB-CB 4.2Å; A235-C287 HydrophobicContact CB-CB 4.21Å; A235-L290 HydrophobicContact CB-CD1 4.49Å; A235-W383 HydrophobicContact CB-CH2 3.7Å; A235-W383 HydrophobicContact CB-CZ2 3.32Å; A235-W383 HydrophobicContact CB-CZ3 4.4Å
236	E	80.7	Confident	73.5	Confident	101 Å²	101	58.5 Å²	58.5	47%	0.472	28%	0.282	S	S	.	.			trans	-93.9	-178.4	167.1	-63.3	-175.7	174.5	0	0	110.8	F234 L238 D284 R286	F234-E236 PolarHBondContact O-N 2.82Å; E236-L238 PolarHBondContact O-N 3.47Å; E236-D284 PolarHBondContact N-OD2 3.14Å; E236-R286 VanDerWaalsContact CG-CZ 3.41Å; E236-R286 IonicContact OE1-CZ 3.39Å; E236-R286 IonicContact OE1-NH1 2.77Å; E236-R286 PolarHBondContact OE1-NH1 3.12Å; E236-R286 IonicContact OE1-NH2 3.25Å; E236-R286 IonicContact OE2-CZ 2.78Å; E236-R286 IonicContact OE2-NH1 2.77Å; E236-R286 PolarHBondContact OE2-NH1 2.88Å; E236-R286 IonicContact OE2-NH2 2.71Å; E236-R286 PolarHBondContact OE2-NH2 3.02Å
237	N	90.5	Very high	75.6	Confident	110 Å²	110	54.6 Å²	54.6	59%	0.588	27%	0.27	S	S	*	.	S	Bend	trans	54.9	47.9	-178.1	-52.2	-51.2	0	0	0	110.7	T281	N237-T281 VanDerWaalsContact CB-OG1 3.29Å; N237-T281 WeakPolarHBondContact CB-OG1 3.34Å; N237-T281 WeakPolarHBondContact O-CB 3.35Å; N237-T281 VanDerWaalsContact O-CG2 3.24Å; N237-T281 WeakPolarHBondContact O-CG2 3.25Å; N237-T281 PolarHBondContact O-N 3.06Å; N237-T281 PolarHBondContact O-OG1 2.89Å
238	L	93.7	Very high	77.4	Confident	47 Å²	47	56.8 Å²	56.8	25%	0.246	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	134.3	175.9	-63.3	-175.8	0	0	0	109.8	A235 E236 R278 V279 A280 W383	A235-L238 HydrophobicContact CB-CD2 3.9Å; A235-L238 WeakPolarHBondContact O-CG 3.5Å; E236-L238 PolarHBondContact O-N 3.47Å; L238-R278 HydrophobicContact CB-CB 4.03Å; L238-R278 HydrophobicContact CD1-CB 4.4Å; L238-V279 CarbonylContact C-O 3.54Å; L238-V279 WeakPolarHBondContact CA-O 3.47Å; L238-A280 HydrophobicContact CD2-CB 4.04Å; L238-W383 HydrophobicContact CD1-CB 3.85Å; L238-W383 HydrophobicContact CD1-CD2 4.04Å; L238-W383 HydrophobicContact CD1-CE3 4.48Å; L238-W383 HydrophobicContact CD1-CG 3.71Å; L238-W383 HydrophobicContact CD2-CD2 3.76Å; L238-W383 HydrophobicContact CD2-CE3 3.51Å; L238-W383 HydrophobicContact CD2-CG 4.33Å; L238-W383 HydrophobicContact CD2-CZ3 3.96Å
239	E	94.8	Very high	79.3	Confident	63 Å²	63	56.4 Å²	56.4	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	158.8	172	67.8	-177.2	156.2	0	0	111.1	L241 T256 R278 V279 T281	E239-L241 PolarHBondContact O-N 3.42Å; E239-T256 HydrophobicContact CG-CG2 3.81Å; E239-T256 WeakPolarHBondContact OE1-CB 3.48Å; E239-R278 CarbonylContact O-C 3.51Å; E239-R278 WeakPolarHBondContact O-CA 3.48Å; E239-R278 WeakPolarHBondContact O-CB 3.45Å; E239-V279 HydrophobicContact CG-CG2 4.21Å; E239-V279 PolarHBondContact N-O 3.28Å; E239-V279 PolarHBondContact O-N 2.69Å; E239-T281 HydrophobicContact CB-CG2 3.95Å; E239-T281 VanDerWaalsContact CD-CG2 3.48Å; E239-T281 HydrophobicContact CG-CG2 3.75Å
240	Q	96.4	Very high	81.5	Confident	101 Å²	101	57.9 Å²	57.9	47%	0.472	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.9	-179	-69.1	-175.3	-14	0	0	110.7	I242 P275	Q240-I242 HydrophobicContact CB-CD1 3.81Å; Q240-I242 HydrophobicContact CB-CG1 4.48Å; Q240-P275 HydrophobicContact CB-CB 4.46Å; Q240-P275 HydrophobicContact CG-CB 4.46Å
241	L	97.7	Very high	83.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	112.5	165	-173.1	64.1	0	0	0	108.3	E239 L254 T256 P275 I276 G277 V279 I327 F380 M382	E239-L241 PolarHBondContact O-N 3.42Å; L241-L254 HydrophobicContact CD1-CB 4.06Å; L241-L254 HydrophobicContact CD2-CD1 4.47Å; L241-L254 HydrophobicContact CG-CB 4.43Å; L241-T256 HydrophobicContact CD1-CG2 3.99Å; L241-P275 WeakPolarHBondContact O-CA 3.29Å; L241-I276 HydrophobicContact CB-CG1 4.24Å; L241-I276 HydrophobicContact CD2-CD1 3.9Å; L241-I276 HydrophobicContact CD2-CG1 4.08Å; L241-I276 HydrophobicContact CG-CD1 4.22Å; L241-I276 HydrophobicContact CG-CG1 4.03Å; L241-I276 WeakPolarHBondContact O-CG1 3.25Å; L241-I276 PolarHBondContact O-N 2.92Å; L241-G277 PolarHBondContact N-O 3.46Å; L241-V279 HydrophobicContact CB-CG1 4.22Å; L241-V279 HydrophobicContact CB-CG2 4.48Å; L241-V279 HydrophobicContact CD2-CG1 4.08Å; L241-I327 HydrophobicContact CD1-CD1 3.81Å; L241-F380 HydrophobicContact CD2-CE2 4.48Å; L241-F380 HydrophobicContact CD2-CZ 4.45Å; L241-M382 HydrophobicContact CD2-SD 3.79Å
242	I	96.7	Very high	86.3	Confident	13 Å²	13	50.7 Å²	50.7	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	138.3	-178.6	-55	-54.9	0	0	0	109.5	Q240 I244 L254 L255 M261 P275	Q240-I242 HydrophobicContact CB-CD1 3.81Å; Q240-I242 HydrophobicContact CB-CG1 4.48Å; I242-I244 HydrophobicContact CG2-CG1 4.32Å; I242-L254 WeakPolarHBondContact O-CA 3.28Å; I242-L255 PolarHBondContact N-O 2.9Å; I242-L255 PolarHBondContact O-N 3.17Å; I242-M261 HydrophobicContact CB-SD 3.54Å; I242-M261 VanDerWaalsContact CB-SD 3.54Å; I242-M261 HydrophobicContact CG1-CE 4.22Å; I242-M261 HydrophobicContact CG1-SD 3.5Å; I242-M261 WeakPolarHBondContact CG1-SD 3.44Å; I242-M261 HydrophobicContact CG2-SD 3.74Å; I242-P275 HydrophobicContact CD1-CB 3.86Å; I242-P275 HydrophobicContact CD1-CG 3.65Å
243	R	96.7	Very high	88.6	Confident	12 Å²	12	44.7 Å²	44.7	5%	0.045	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	131.9	172	-179.9	176.8	168.7	-119.3	-1.4	111.1	N252 Y253 L254 K273 G274 I276 L356 D361	R243-N252 PolarHBondContact NE-OD1 3.36Å; R243-N252 PolarHBondContact NH2-OD1 3.4Å; R243-Y253 VanDerWaalsContact CA-O 3.31Å; R243-Y253 WeakPolarHBondContact CA-O 3.43Å; R243-L254 HydrophobicContact CB-CD2 4.09Å; R243-L254 HydrophobicContact CG-CD2 4.07Å; R243-K273 HydrophobicContact CB-CB 4.1Å; R243-K273 HydrophobicContact CG-CB 4.1Å; R243-K273 HydrophobicContact CG-CG 4.26Å; R243-K273 WeakPolarHBondContact O-CA 3.23Å; R243-K273 WeakPolarHBondContact O-CB 3.39Å; R243-K273 PolarHBondContact O-N 2.05Å; R243-G274 PolarHBondContact N-O 2.94Å; R243-I276 HydrophobicContact CB-CD1 4.46Å; R243-I276 HydrophobicContact CB-CG2 3.41Å; R243-I276 VanDerWaalsContact CB-CG2 3.41Å; R243-I276 HydrophobicContact CG-CG2 4.44Å; R243-L356 VanDerWaalsContact NE-CD2 3.28Å; R243-L356 VanDerWaalsContact NH2-CD2 3.31Å; R243-D361 IonicContact CZ-OD2 2.87Å; R243-D361 IonicContact NH1-OD2 2.95Å; R243-D361 PolarHBondContact NH1-OD2 3.04Å; R243-D361 IonicContact NH2-OD2 3.66Å
244	I	96.1	Very high	90.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.5	171	-57	179.5	0	0	0	108.6	I242 Y253 L255 M261 I264 M265 E271	I242-I244 HydrophobicContact CG2-CG1 4.32Å; I244-Y253 PolarHBondContact N-O 2.88Å; I244-Y253 PolarHBondContact O-N 2.79Å; I244-L255 HydrophobicContact CD1-CD1 3.7Å; I244-L255 HydrophobicContact CG1-CD1 4.19Å; I244-M261 HydrophobicContact CD1-CB 4.29Å; I244-M261 HydrophobicContact CD1-CG 4.19Å; I244-I264 HydrophobicContact CD1-CG2 4.33Å; I244-I264 HydrophobicContact CG2-CG2 3.81Å; I244-M265 HydrophobicContact CD1-CG 3.87Å; I244-M265 HydrophobicContact CD1-SD 3.9Å; I244-M265 HydrophobicContact CG1-SD 4.44Å; I244-M265 HydrophobicContact CG2-SD 4.01Å; I244-E271 WeakPolarHBondContact CA-O 3.23Å
245	W	94.2	Very high	91.9	Very high	46 Å²	46	37.5 Å²	37.5	17%	0.174	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.5	174	177.4	-111.6	0	0	0	110.1	P247 S250 T251 N252 E271 K273 L354	W245-P247 WeakPolarHBondContact O-CD 3.39Å; W245-S250 VanDerWaalsContact CH2-CA 3.42Å; W245-S250 WeakPolarHBondContact CH2-O 3.46Å; W245-S250 VanDerWaalsContact CZ3-O 3.24Å; W245-S250 WeakPolarHBondContact CZ3-O 3.45Å; W245-T251 VanDerWaalsContact CE3-O 3.25Å; W245-N252 HydrophobicContact CE3-CB 4.04Å; W245-N252 HydrophobicContact CZ3-CB 3.97Å; W245-E271 HydrophobicContact CB-CB 4.31Å; W245-E271 PolarHBondContact N-O 3Å; W245-E271 PolarHBondContact O-N 2.87Å; W245-K273 HydrophobicContact CB-CG 4.24Å; W245-L354 HydrophobicContact CZ3-CD1 4.34Å
246	Y	93.8	Very high	93.5	Very high	35 Å²	35	38.3 Å²	38.3	14%	0.137	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	94.9	174.7	-176.2	-122.8	0	0	0	110.1	P248 T249 S250 T251 N267 R269	Y246-P248 HydrophobicContact CD2-CG 4.15Å; Y246-P248 HydrophobicContact CE1-CB 3.89Å; Y246-P248 HydrophobicContact CE1-CG 4.06Å; Y246-P248 HydrophobicContact CE2-CB 4.24Å; Y246-P248 VanDerWaalsContact CE2-CD 3.45Å; Y246-P248 HydrophobicContact CE2-CG 3.5Å; Y246-P248 VanDerWaalsContact CE2-CG 3.5Å; Y246-P248 VanDerWaalsContact CZ-CG 3.45Å; Y246-T249 WeakPolarHBondContact CD1-OG1 3.34Å; Y246-T249 HydrophobicContact CE1-CG2 4.28Å; Y246-T249 PolarHBondContact O-N 2.73Å; Y246-S250 WeakPolarHBondContact O-CA 3.06Å; Y246-S250 PolarHBondContact O-N 2.8Å; Y246-S250 VanDerWaalsContact O-N 3.08Å; Y246-T251 PolarHBondContact N-O 3.37Å; Y246-T251 PolarHBondContact O-N 3.41Å; Y246-N267 HydrophobicContact CE2-CB 4.32Å; Y246-N267 WeakPolarHBondContact CE2-ND2 3.44Å; Y246-N267 WeakPolarHBondContact CE2-OD1 3.28Å; Y246-N267 PolarHBondContact OH-ND2 3.36Å; Y246-R269 HydrophobicContact CE2-CB 4.09Å; Y246-R269 PolarHBondContact OH-NH2 2.86Å
247	P	91.3	Very high	94.1	Very high	48 Å²	48	37.4 Å²	37.4	31%	0.312	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-53.2	-39.8	-175.1	-23.4	29.3	0	0	0	116.4	W245 T249 S250 R269 E271	W245-P247 WeakPolarHBondContact O-CD 3.39Å; P247-T249 PolarHBondContact O-N 3.31Å; P247-T249 VanDerWaalsContact O-N 3.16Å; P247-S250 PolarHBondContact O-N 2.72Å; P247-S250 VanDerWaalsContact O-N 3.08Å; P247-R269 WeakPolarHBondContact CD-O 3.5Å; P247-E271 HydrophobicContact CG-CG 4.39Å; P247-E271 WeakPolarHBondContact CG-OE1 3.31Å
248	P	89.7	Confident	94	Very high	52 Å²	52	39.7 Å²	39.7	34%	0.338	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-59.5	-30.5	-173.4	-29.1	38.9	0	0	0	115.1	Y246 R269	Y246-P248 HydrophobicContact CD2-CG 4.15Å; Y246-P248 HydrophobicContact CE1-CB 3.89Å; Y246-P248 HydrophobicContact CE1-CG 4.06Å; Y246-P248 HydrophobicContact CE2-CB 4.24Å; Y246-P248 VanDerWaalsContact CE2-CD 3.45Å; Y246-P248 HydrophobicContact CE2-CG 3.5Å; Y246-P248 VanDerWaalsContact CE2-CG 3.5Å; Y246-P248 VanDerWaalsContact CZ-CG 3.45Å; P248-R269 HydrophobicContact CG-CB 4.07Å
249	T	88.9	Confident	93.8	Very high	54 Å²	54	42.8 Å²	42.8	33%	0.331	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-116.6	7.5	175.1	51.2	0	0	0	0	112.1	Y246 P247 T251	Y246-T249 WeakPolarHBondContact CD1-OG1 3.34Å; Y246-T249 HydrophobicContact CE1-CG2 4.28Å; Y246-T249 PolarHBondContact O-N 2.73Å; P247-T249 PolarHBondContact O-N 3.31Å; P247-T249 VanDerWaalsContact O-N 3.16Å; T249-T251 WeakPolarHBondContact CB-OG1 3.45Å; T249-T251 PolarHBondContact O-N 2.88Å; T249-T251 PolarHBondContact OG1-OG1 2.91Å
250	S	89.8	Confident	93.7	Very high	48 Å²	48	42.6 Å²	42.6	34%	0.336	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	38.9	-174.4	-60.5	0	0	0	0	112.8	W245 Y246 P247	W245-S250 VanDerWaalsContact CH2-CA 3.42Å; W245-S250 WeakPolarHBondContact CH2-O 3.46Å; W245-S250 VanDerWaalsContact CZ3-O 3.24Å; W245-S250 WeakPolarHBondContact CZ3-O 3.45Å; Y246-S250 WeakPolarHBondContact O-CA 3.06Å; Y246-S250 PolarHBondContact O-N 2.8Å; Y246-S250 VanDerWaalsContact O-N 3.08Å; P247-S250 PolarHBondContact O-N 2.72Å; P247-S250 VanDerWaalsContact O-N 3.08Å
251	T	92.1	Very high	93.5	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132.2	-174.1	-55.2	0	0	0	0	111.3	W245 Y246 T249 Y253 T302 D304	W245-T251 VanDerWaalsContact CE3-O 3.25Å; Y246-T251 PolarHBondContact N-O 3.37Å; Y246-T251 PolarHBondContact O-N 3.41Å; T249-T251 WeakPolarHBondContact CB-OG1 3.45Å; T249-T251 PolarHBondContact O-N 2.88Å; T249-T251 PolarHBondContact OG1-OG1 2.91Å; T251-Y253 HydrophobicContact CG2-CD1 4.11Å; T251-Y253 HydrophobicContact CG2-CD2 4.17Å; T251-Y253 HydrophobicContact CG2-CE1 3.55Å; T251-Y253 HydrophobicContact CG2-CE2 3.63Å; T251-Y253 HydrophobicContact CG2-CG 4.39Å; T251-Y253 WeakPolarHBondContact CG2-OH 3.43Å; T251-T302 PolarHBondContact OG1-O 2.68Å; T251-D304 WeakPolarHBondContact CG2-OD2 3.19Å
252	N	94.1	Very high	93.1	Very high	7 Å²	7	46.3 Å²	46.3	4%	0.037	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	102	-179.2	-176.3	77	0	0	0	110.5	R243 W245 L354 Q355	R243-N252 PolarHBondContact NE-OD1 3.36Å; R243-N252 PolarHBondContact NH2-OD1 3.4Å; W245-N252 HydrophobicContact CE3-CB 4.04Å; W245-N252 HydrophobicContact CZ3-CB 3.97Å; N252-L354 HydrophobicContact CB-CD1 3.88Å; N252-Q355 PolarHBondContact ND2-O 3.01Å
253	Y	96.3	Very high	93	Very high	41 Å²	41	51.3 Å²	51.3	16%	0.161	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.1	178.7	-59.3	-73.1	0	0	0	111.3	R243 I244 T251 I264 D304	R243-Y253 VanDerWaalsContact CA-O 3.31Å; R243-Y253 WeakPolarHBondContact CA-O 3.43Å; I244-Y253 PolarHBondContact N-O 2.88Å; I244-Y253 PolarHBondContact O-N 2.79Å; T251-Y253 HydrophobicContact CG2-CD1 4.11Å; T251-Y253 HydrophobicContact CG2-CD2 4.17Å; T251-Y253 HydrophobicContact CG2-CE1 3.55Å; T251-Y253 HydrophobicContact CG2-CE2 3.63Å; T251-Y253 HydrophobicContact CG2-CG 4.39Å; T251-Y253 WeakPolarHBondContact CG2-OH 3.43Å; Y253-I264 HydrophobicContact CD1-CD1 3.95Å; Y253-I264 HydrophobicContact CD2-CD1 4.06Å; Y253-I264 HydrophobicContact CD2-CG2 4.04Å; Y253-I264 HydrophobicContact CE1-CD1 4.19Å; Y253-I264 HydrophobicContact CE2-CD1 4.27Å; Y253-I264 HydrophobicContact CE2-CG2 4.05Å; Y253-I264 HydrophobicContact CG-CD1 3.88Å; Y253-D304 WeakPolarHBondContact CE1-OD2 3.44Å
254	L	97.9	Very high	92.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.8	165.8	-53.8	-173.7	0	0	0	108.2	L241 I242 R243 I276 Y306 I327 Q355	L241-L254 HydrophobicContact CD1-CB 4.06Å; L241-L254 HydrophobicContact CD2-CD1 4.47Å; L241-L254 HydrophobicContact CG-CB 4.43Å; I242-L254 WeakPolarHBondContact O-CA 3.28Å; R243-L254 HydrophobicContact CB-CD2 4.09Å; R243-L254 HydrophobicContact CG-CD2 4.07Å; L254-I276 HydrophobicContact CD2-CD1 3.65Å; L254-Y306 HydrophobicContact CB-CD1 4.3Å; L254-Y306 HydrophobicContact CB-CD2 3.99Å; L254-Y306 HydrophobicContact CB-CE1 4Å; L254-Y306 HydrophobicContact CB-CE2 3.69Å; L254-Y306 HydrophobicContact CB-CG 4.3Å; L254-Y306 HydrophobicContact CD1-CD2 3.64Å; L254-Y306 HydrophobicContact CD1-CE2 4.07Å; L254-Y306 HydrophobicContact CD1-CG 4.06Å; L254-Y306 HydrophobicContact CG-CD2 3.75Å; L254-Y306 HydrophobicContact CG-CE2 3.62Å; L254-Y306 HydrophobicContact CG-CG 4.41Å; L254-Y306 VanDerWaalsContact N-CZ 3.35Å; L254-Y306 PolarHBondContact N-OH 2.86Å; L254-Y306 VanDerWaalsContact O-CE1 3.3Å; L254-Y306 WeakPolarHBondContact O-CE1 3.24Å; L254-Y306 PolarHBondContact O-OH 2.87Å; L254-I327 HydrophobicContact CB-CD1 4.15Å; L254-Q355 HydrophobicContact CD1-CB 4.18Å
255	L	96.5	Very high	92.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.1	-164.8	-59.2	165.9	0	0	0	111.4	I242 I244 E260 M261 I264	I242-L255 PolarHBondContact N-O 2.9Å; I242-L255 PolarHBondContact O-N 3.17Å; I244-L255 HydrophobicContact CD1-CD1 3.7Å; I244-L255 HydrophobicContact CG1-CD1 4.19Å; L255-E260 HydrophobicContact CD2-CB 4.47Å; L255-E260 VanDerWaalsContact CD2-CD 3.4Å; L255-E260 HydrophobicContact CD2-CG 3.83Å; L255-M261 HydrophobicContact CB-CG 3.72Å; L255-M261 HydrophobicContact CB-SD 4.39Å; L255-M261 HydrophobicContact CD1-CG 3.69Å; L255-M261 HydrophobicContact CG-CG 4.35Å; L255-I264 HydrophobicContact CD1-CD1 3.62Å; L255-I264 HydrophobicContact CD2-CD1 4.26Å
256	T	96.4	Very high	92.5	Very high	20 Å²	20	58 Å²	58	12%	0.123	30%	0.3	C	S	.	.			trans	-115.3	-26	166.4	50	0	0	0	0	111.6	E239 L241 Q258 V279 I327	E239-T256 HydrophobicContact CG-CG2 3.81Å; E239-T256 WeakPolarHBondContact OE1-CB 3.48Å; L241-T256 HydrophobicContact CD1-CG2 3.99Å; T256-Q258 PolarHBondContact O-N 2.78Å; T256-V279 HydrophobicContact CG2-CG2 3.61Å; T256-I327 WeakPolarHBondContact CB-O 3.36Å; T256-I327 WeakPolarHBondContact CG2-O 3.49Å; T256-I327 PolarHBondContact OG1-O 2.83Å
257	N	92.2	Very high	92.4	Very high	83 Å²	83	59 Å²	59	44%	0.444	31%	0.308	S	S	.	.			trans	-75.3	118.3	-177.3	-171.6	-55.6	0	0	0	112.6	L259 E260 M261	N257-L259 PolarHBondContact O-N 2.83Å; N257-L259 WeakPolarHBondContact OD1-CA 3.45Å; N257-L259 VanDerWaalsContact OD1-CB 3.3Å; N257-L259 WeakPolarHBondContact OD1-CB 3.47Å; N257-L259 PolarHBondContact OD1-N 2.79Å; N257-E260 HydrophobicContact CB-CB 4.07Å; N257-E260 PolarHBondContact O-N 2.8Å; N257-E260 PolarHBondContact OD1-N 2.85Å; N257-E260 VanDerWaalsContact OD1-N 3.12Å; N257-M261 WeakPolarHBondContact O-CG 3.34Å; N257-M261 PolarHBondContact O-N 2.76Å
258	Q	88.2	Confident	92.4	Very high	158 Å²	158	68.5 Å²	68.5	74%	0.738	34%	0.338	S	S	*	.	H	α-helix	trans	-63.7	-34.7	-179.8	-67.2	-173.2	-16.3	0	0	114.6	T256 M261 F262	T256-Q258 PolarHBondContact O-N 2.78Å; Q258-M261 HydrophobicContact CB-CE 4.23Å; Q258-M261 HydrophobicContact CG-CE 3.83Å; Q258-F262 WeakPolarHBondContact O-CB 3.49Å; Q258-F262 PolarHBondContact O-N 3.35Å
259	L	91.1	Very high	92.7	Very high	111 Å²	111	73.1 Å²	73.1	58%	0.581	35%	0.349	S	S	*	.	H	α-helix	trans	-68.5	-43.2	178.7	178.4	61.8	0	0	0	110.9	N257 F262 Q263	N257-L259 PolarHBondContact O-N 2.83Å; N257-L259 WeakPolarHBondContact OD1-CA 3.45Å; N257-L259 VanDerWaalsContact OD1-CB 3.3Å; N257-L259 WeakPolarHBondContact OD1-CB 3.47Å; N257-L259 PolarHBondContact OD1-N 2.79Å; L259-F262 PolarHBondContact O-N 3.05Å; L259-Q263 VanDerWaalsContact O-CG 3.31Å; L259-Q263 WeakPolarHBondContact O-CG 3.5Å; L259-Q263 PolarHBondContact O-N 2.97Å
260	E	92.5	Very high	93	Very high	60 Å²	60	71.2 Å²	71.2	28%	0.28	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-43.3	177.2	-171	174	-173.1	0	0	111.4	L255 N257 F262 Q263 I264	L255-E260 HydrophobicContact CD2-CB 4.47Å; L255-E260 VanDerWaalsContact CD2-CD 3.4Å; L255-E260 HydrophobicContact CD2-CG 3.83Å; N257-E260 HydrophobicContact CB-CB 4.07Å; N257-E260 PolarHBondContact O-N 2.8Å; N257-E260 PolarHBondContact OD1-N 2.85Å; N257-E260 VanDerWaalsContact OD1-N 3.12Å; E260-F262 VanDerWaalsContact C-N 3.32Å; E260-F262 PolarHBondContact O-N 3.14Å; E260-Q263 PolarHBondContact O-N 2.86Å; E260-I264 HydrophobicContact CG-CD1 4.03Å; E260-I264 WeakPolarHBondContact O-CG1 3.43Å; E260-I264 PolarHBondContact O-N 2.95Å
261	M	90.6	Very high	93.3	Very high	34 Å²	34	72.8 Å²	72.8	17%	0.167	34%	0.339	C	S	.	.	H	α-helix	trans	-55.4	-47.3	171.4	-72.9	-169.1	-71.2	0	0	111.6	I242 I244 L255 N257 Q258 Q263 I264 M265	I242-M261 HydrophobicContact CB-SD 3.54Å; I242-M261 VanDerWaalsContact CB-SD 3.54Å; I242-M261 HydrophobicContact CG1-CE 4.22Å; I242-M261 HydrophobicContact CG1-SD 3.5Å; I242-M261 WeakPolarHBondContact CG1-SD 3.44Å; I242-M261 HydrophobicContact CG2-SD 3.74Å; I244-M261 HydrophobicContact CD1-CB 4.29Å; I244-M261 HydrophobicContact CD1-CG 4.19Å; L255-M261 HydrophobicContact CB-CG 3.72Å; L255-M261 HydrophobicContact CB-SD 4.39Å; L255-M261 HydrophobicContact CD1-CG 3.69Å; L255-M261 HydrophobicContact CG-CG 4.35Å; N257-M261 WeakPolarHBondContact O-CG 3.34Å; N257-M261 PolarHBondContact O-N 2.76Å; Q258-M261 HydrophobicContact CB-CE 4.23Å; Q258-M261 HydrophobicContact CG-CE 3.83Å; M261-Q263 PolarHBondContact O-N 2.96Å; M261-I264 PolarHBondContact O-N 2.69Å; M261-M265 VanDerWaalsContact O-CB 3.29Å; M261-M265 WeakPolarHBondContact O-CB 3.39Å; M261-M265 WeakPolarHBondContact O-CG 3.22Å; M261-M265 PolarHBondContact O-N 3.14Å
262	F	91.2	Very high	93.4	Very high	145 Å²	145	77.1 Å²	77.1	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-61	-44.8	178.1	-178.2	-95.1	0	0	0	111.9	Q258 L259 E260 I264 M265 T266	Q258-F262 WeakPolarHBondContact O-CB 3.49Å; Q258-F262 PolarHBondContact O-N 3.35Å; L259-F262 PolarHBondContact O-N 3.05Å; E260-F262 VanDerWaalsContact C-N 3.32Å; E260-F262 PolarHBondContact O-N 3.14Å; F262-I264 PolarHBondContact O-N 3.28Å; F262-M265 PolarHBondContact O-N 2.95Å; F262-T266 HydrophobicContact CD1-CG2 4.39Å; F262-T266 HydrophobicContact CE1-CG2 4.16Å; F262-T266 VanDerWaalsContact O-CG2 3.29Å; F262-T266 WeakPolarHBondContact O-CG2 2.86Å; F262-T266 PolarHBondContact O-N 3.3Å
263	Q	93.3	Very high	93.4	Very high	117 Å²	117	80.9 Å²	80.9	55%	0.547	38%	0.378	S	S	.	.	H	α-helix	trans	-59.1	-47.5	177.9	-74	172.9	-4.7	0	0	111.8	L259 E260 M261 M265 T266	L259-Q263 VanDerWaalsContact O-CG 3.31Å; L259-Q263 WeakPolarHBondContact O-CG 3.5Å; L259-Q263 PolarHBondContact O-N 2.97Å; E260-Q263 PolarHBondContact O-N 2.86Å; M261-Q263 PolarHBondContact O-N 2.96Å; Q263-M265 VanDerWaalsContact C-N 3.35Å; Q263-M265 PolarHBondContact O-N 2.75Å; Q263-T266 PolarHBondContact O-N 3.43Å; Q263-T266 PolarHBondContact O-OG1 3.41Å
264	I	92.4	Very high	93.3	Very high	25 Å²	25	79.7 Å²	79.7	13%	0.128	38%	0.378	C	S	.	.	H	α-helix	trans	-65.6	-39.5	178.2	-68.1	165.5	0	0	0	111	I244 Y253 L255 E260 M261 F262 T266 N267 S270	I244-I264 HydrophobicContact CD1-CG2 4.33Å; I244-I264 HydrophobicContact CG2-CG2 3.81Å; Y253-I264 HydrophobicContact CD1-CD1 3.95Å; Y253-I264 HydrophobicContact CD2-CD1 4.06Å; Y253-I264 HydrophobicContact CD2-CG2 4.04Å; Y253-I264 HydrophobicContact CE1-CD1 4.19Å; Y253-I264 HydrophobicContact CE2-CD1 4.27Å; Y253-I264 HydrophobicContact CE2-CG2 4.05Å; Y253-I264 HydrophobicContact CG-CD1 3.88Å; L255-I264 HydrophobicContact CD1-CD1 3.62Å; L255-I264 HydrophobicContact CD2-CD1 4.26Å; E260-I264 HydrophobicContact CG-CD1 4.03Å; E260-I264 WeakPolarHBondContact O-CG1 3.43Å; E260-I264 PolarHBondContact O-N 2.95Å; M261-I264 PolarHBondContact O-N 2.69Å; F262-I264 PolarHBondContact O-N 3.28Å; I264-T266 VanDerWaalsContact C-N 3.27Å; I264-T266 PolarHBondContact O-N 2.74Å; I264-N267 WeakPolarHBondContact O-CB 3.19Å; I264-N267 PolarHBondContact O-N 2.76Å; I264-S270 WeakPolarHBondContact O-CB 3.29Å; I264-S270 PolarHBondContact O-OG 2.93Å
265	M	91.1	Very high	93.2	Very high	74 Å²	74	82.2 Å²	82.2	37%	0.365	40%	0.395	S	S	.	.	H	α-helix	trans	-73.3	-11.9	180	-69.9	-57.7	-59.9	0	0	114.2	I244 M261 F262 Q263 N267 N272	I244-M265 HydrophobicContact CD1-CG 3.87Å; I244-M265 HydrophobicContact CD1-SD 3.9Å; I244-M265 HydrophobicContact CG1-SD 4.44Å; I244-M265 HydrophobicContact CG2-SD 4.01Å; M261-M265 VanDerWaalsContact O-CB 3.29Å; M261-M265 WeakPolarHBondContact O-CB 3.39Å; M261-M265 WeakPolarHBondContact O-CG 3.22Å; M261-M265 PolarHBondContact O-N 3.14Å; F262-M265 PolarHBondContact O-N 2.95Å; Q263-M265 VanDerWaalsContact C-N 3.35Å; Q263-M265 PolarHBondContact O-N 2.75Å; M265-N267 PolarHBondContact O-N 3.08Å; M265-N272 HydrophobicContact CE-CB 3.95Å; M265-N272 HydrophobicContact SD-CB 4.01Å
266	T	93.9	Very high	93.1	Very high	100 Å²	100	82.6 Å²	82.6	61%	0.613	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.2	168.8	66.9	0	0	0	0	112.2	F262 Q263 I264 R268	F262-T266 HydrophobicContact CD1-CG2 4.39Å; F262-T266 HydrophobicContact CE1-CG2 4.16Å; F262-T266 VanDerWaalsContact O-CG2 3.29Å; F262-T266 WeakPolarHBondContact O-CG2 2.86Å; F262-T266 PolarHBondContact O-N 3.3Å; Q263-T266 PolarHBondContact O-N 3.43Å; Q263-T266 PolarHBondContact O-OG1 3.41Å; I264-T266 VanDerWaalsContact C-N 3.27Å; I264-T266 PolarHBondContact O-N 2.74Å; T266-R268 PolarHBondContact O-N 3.13Å
267	N	92	Very high	93.1	Very high	57 Å²	57	81.6 Å²	81.6	31%	0.305	39%	0.391	S	S	.	.	S	Bend	trans	-79.4	115	172.7	-168.8	-36.3	0	0	0	110.1	Y246 I264 M265 R269 S270	Y246-N267 HydrophobicContact CE2-CB 4.32Å; Y246-N267 WeakPolarHBondContact CE2-ND2 3.44Å; Y246-N267 WeakPolarHBondContact CE2-OD1 3.28Å; Y246-N267 PolarHBondContact OH-ND2 3.36Å; I264-N267 WeakPolarHBondContact O-CB 3.19Å; I264-N267 PolarHBondContact O-N 2.76Å; M265-N267 PolarHBondContact O-N 3.08Å; N267-R269 PolarHBondContact O-N 3.34Å; N267-R269 PolarHBondContact OD1-N 3.3Å; N267-R269 VanDerWaalsContact OD1-N 3.13Å; N267-S270 VanDerWaalsContact O-CB 3.27Å; N267-S270 WeakPolarHBondContact O-CB 3.1Å; N267-S270 PolarHBondContact O-N 2.81Å; N267-S270 PolarHBondContact O-OG 2.91Å
268	R	90.7	Very high	93.4	Very high	247 Å²	247	80.8 Å²	80.8	93%	0.932	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.6	-176.3	-63.7	-173	-178.9	-169.9	0.2	115	T266	T266-R268 PolarHBondContact O-N 3.13Å
269	R	95.4	Very high	93.8	Very high	150 Å²	150	73.2 Å²	73.2	57%	0.566	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.4	175.8	-64.2	-172.4	-67.9	-178	3.8	112.9	Y246 P247 P248 N267	Y246-R269 HydrophobicContact CE2-CB 4.09Å; Y246-R269 PolarHBondContact OH-NH2 2.86Å; P247-R269 WeakPolarHBondContact CD-O 3.5Å; P248-R269 HydrophobicContact CG-CB 4.07Å; N267-R269 PolarHBondContact O-N 3.34Å; N267-R269 PolarHBondContact OD1-N 3.3Å; N267-R269 VanDerWaalsContact OD1-N 3.13Å
270	S	96.1	Very high	94	Very high	13 Å²	13	68 Å²	68	9%	0.091	32%	0.319	C	S	.	.			trans	-68.6	129.8	175	-61	0	0	0	0	110.5	I264 N267	I264-S270 WeakPolarHBondContact O-CB 3.29Å; I264-S270 PolarHBondContact O-OG 2.93Å; N267-S270 VanDerWaalsContact O-CB 3.27Å; N267-S270 WeakPolarHBondContact O-CB 3.1Å; N267-S270 PolarHBondContact O-N 2.81Å; N267-S270 PolarHBondContact O-OG 2.91Å
271	E	95.3	Very high	94.2	Very high	81 Å²	81	68.6 Å²	68.6	38%	0.379	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	110.3	179.2	-63.8	175.9	-161.5	0	0	109.4	I244 W245 P247 K273	I244-E271 WeakPolarHBondContact CA-O 3.23Å; W245-E271 HydrophobicContact CB-CB 4.31Å; W245-E271 PolarHBondContact N-O 3Å; W245-E271 PolarHBondContact O-N 2.87Å; P247-E271 HydrophobicContact CG-CG 4.39Å; P247-E271 WeakPolarHBondContact CG-OE1 3.31Å; E271-K273 PolarHBondContact O-N 3.05Å; E271-K273 WeakPolarHBondContact OE2-CE 3.49Å; E271-K273 IonicContact OE2-NZ 2.78Å; E271-K273 PolarHBondContact OE2-NZ 3.43Å
272	N	94.5	Very high	94.3	Very high	96 Å²	96	68.1 Å²	68.1	51%	0.513	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	112.7	171.8	-173.5	-3.8	0	0	0	109.5	M265 G274	M265-N272 HydrophobicContact CE-CB 3.95Å; M265-N272 HydrophobicContact SD-CB 4.01Å; N272-G274 VanDerWaalsContact C-N 3.31Å; N272-G274 WeakPolarHBondContact OD1-CA 3.42Å; N272-G274 PolarHBondContact OD1-N 3.31Å
273	K	94.4	Very high	94.2	Very high	87 Å²	87	67.5 Å²	67.5	38%	0.378	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-5.9	176.8	-57.4	-58.7	-162.5	-172.7	0	112.5	R243 W245 E271	R243-K273 HydrophobicContact CB-CB 4.1Å; R243-K273 HydrophobicContact CG-CB 4.1Å; R243-K273 HydrophobicContact CG-CG 4.26Å; R243-K273 WeakPolarHBondContact O-CA 3.23Å; R243-K273 WeakPolarHBondContact O-CB 3.39Å; R243-K273 PolarHBondContact O-N 2.05Å; W245-K273 HydrophobicContact CB-CG 4.24Å; E271-K273 PolarHBondContact O-N 3.05Å; E271-K273 WeakPolarHBondContact OE2-CE 3.49Å; E271-K273 IonicContact OE2-NZ 2.78Å; E271-K273 PolarHBondContact OE2-NZ 3.43Å
274	G	94	Very high	93.5	Very high	15 Å²	15	62.8 Å²	62.8	16%	0.155	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	82.3	-169.8	176.8	0	0	0	0	0	113.8	R243 N272 I276	R243-G274 PolarHBondContact N-O 2.94Å; N272-G274 VanDerWaalsContact C-N 3.31Å; N272-G274 WeakPolarHBondContact OD1-CA 3.42Å; N272-G274 PolarHBondContact OD1-N 3.31Å; G274-I276 PolarHBondContact O-N 2.72Å
275	P	95.4	Very high	92.7	Very high	54 Å²	54	67.4 Å²	67.4	35%	0.351	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	129.6	178.1	-16.8	30	0	0	0	111.5	Q240 L241 I242 V385	Q240-P275 HydrophobicContact CB-CB 4.46Å; Q240-P275 HydrophobicContact CG-CB 4.46Å; L241-P275 WeakPolarHBondContact O-CA 3.29Å; I242-P275 HydrophobicContact CD1-CB 3.86Å; I242-P275 HydrophobicContact CD1-CG 3.65Å; P275-V385 HydrophobicContact CB-CG1 3.93Å; P275-V385 HydrophobicContact CB-CG2 3.88Å
276	I	95.6	Very high	91.9	Very high	7 Å²	7	67.4 Å²	67.4	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-16.6	176.9	66.1	160.6	0	0	0	112.9	L241 R243 L254 G274 Q357 M382	L241-I276 HydrophobicContact CB-CG1 4.24Å; L241-I276 HydrophobicContact CD2-CD1 3.9Å; L241-I276 HydrophobicContact CD2-CG1 4.08Å; L241-I276 HydrophobicContact CG-CD1 4.22Å; L241-I276 HydrophobicContact CG-CG1 4.03Å; L241-I276 WeakPolarHBondContact O-CG1 3.25Å; L241-I276 PolarHBondContact O-N 2.92Å; R243-I276 HydrophobicContact CB-CD1 4.46Å; R243-I276 HydrophobicContact CB-CG2 3.41Å; R243-I276 VanDerWaalsContact CB-CG2 3.41Å; R243-I276 HydrophobicContact CG-CG2 4.44Å; L254-I276 HydrophobicContact CD2-CD1 3.65Å; G274-I276 PolarHBondContact O-N 2.72Å; I276-Q357 HydrophobicContact CB-CB 4.08Å; I276-Q357 VanDerWaalsContact CB-CD 3.41Å; I276-Q357 HydrophobicContact CB-CG 3.9Å; I276-Q357 HydrophobicContact CD1-CB 4.47Å; I276-Q357 VanDerWaalsContact CG2-CD 3.42Å; I276-Q357 HydrophobicContact CG2-CG 4.43Å; I276-Q357 VanDerWaalsContact CG2-NE2 3.32Å; I276-Q357 VanDerWaalsContact CG2-OE1 3.25Å; I276-M382 HydrophobicContact CB-CE 4.34Å; I276-M382 HydrophobicContact CD1-CE 4.09Å; I276-M382 HydrophobicContact CG1-CE 3.98Å; I276-M382 WeakPolarHBondContact O-CE 3.43Å
277	G	96.1	Very high	91	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-166.8	179.3	0	0	0	0	0	110.1	L241 W383	L241-G277 PolarHBondContact N-O 3.46Å; G277-W383 CarbonylContact C-O 3.59Å; G277-W383 VanDerWaalsContact CA-O 3.3Å; G277-W383 WeakPolarHBondContact CA-O 3.45Å
278	R	96.6	Very high	90.1	Very high	65 Å²	65	62.6 Å²	62.6	25%	0.245	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	148.3	170.1	-64.6	178.6	-71.4	-165.7	-14.8	110.8	L238 E239 M382 W383 S384 S386	L238-R278 HydrophobicContact CB-CB 4.03Å; L238-R278 HydrophobicContact CD1-CB 4.4Å; E239-R278 CarbonylContact O-C 3.51Å; E239-R278 WeakPolarHBondContact O-CA 3.48Å; E239-R278 WeakPolarHBondContact O-CB 3.45Å; R278-M382 WeakPolarHBondContact O-CB 3Å; R278-W383 HydrophobicContact CB-CB 4.22Å; R278-W383 PolarHBondContact N-O 3.13Å; R278-W383 PolarHBondContact O-N 2.95Å; R278-S384 PolarHBondContact NE-O 2.9Å; R278-S384 PolarHBondContact NH2-O 2.83Å; R278-S386 PolarHBondContact NH2-OXT 2.98Å; R278-S386 VanDerWaalsContact NH2-OXT 3.08Å
279	V	97.2	Very high	89.4	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.9	174.6	-65.1	0	0	0	0	109.3	L238 E239 L241 T256 I293 M382	L238-V279 CarbonylContact C-O 3.54Å; L238-V279 WeakPolarHBondContact CA-O 3.47Å; E239-V279 HydrophobicContact CG-CG2 4.21Å; E239-V279 PolarHBondContact N-O 3.28Å; E239-V279 PolarHBondContact O-N 2.69Å; L241-V279 HydrophobicContact CB-CG1 4.22Å; L241-V279 HydrophobicContact CB-CG2 4.48Å; L241-V279 HydrophobicContact CD2-CG1 4.08Å; T256-V279 HydrophobicContact CG2-CG2 3.61Å; V279-I293 HydrophobicContact CB-CD1 4.12Å; V279-I293 HydrophobicContact CG1-CD1 3.53Å; V279-M382 HydrophobicContact CG1-CB 4.23Å
280	A	95.9	Very high	88.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	140.4	175.8	0	0	0	0	0	110.3	A235 L238 G282 L290 G328 Y329 W383	A235-A280 HydrophobicContact CB-CB 4.2Å; L238-A280 HydrophobicContact CD2-CB 4.04Å; A280-G282 VanDerWaalsContact C-N 3.25Å; A280-G282 PolarHBondContact O-N 2.86Å; A280-L290 HydrophobicContact CB-CD1 4.1Å; A280-L290 HydrophobicContact CB-CD2 3.77Å; A280-G328 CarbonylContact O-C 3.26Å; A280-G328 WeakPolarHBondContact O-CA 3.44Å; A280-Y329 PolarHBondContact N-O 3.49Å; A280-Y329 PolarHBondContact O-N 3.41Å; A280-W383 HydrophobicContact CB-CH2 4.47Å; A280-W383 HydrophobicContact CB-CZ3 4.28Å
281	T	95.4	Very high	88.3	Confident	73 Å²	73	46 Å²	46	45%	0.448	25%	0.251	S	S	.	.	S	Bend	trans	-73.9	-15.6	179.2	48.5	0	0	0	0	113.4	N237 E239	N237-T281 VanDerWaalsContact CB-OG1 3.29Å; N237-T281 WeakPolarHBondContact CB-OG1 3.34Å; N237-T281 WeakPolarHBondContact O-CB 3.35Å; N237-T281 VanDerWaalsContact O-CG2 3.24Å; N237-T281 WeakPolarHBondContact O-CG2 3.25Å; N237-T281 PolarHBondContact O-N 3.06Å; N237-T281 PolarHBondContact O-OG1 2.89Å; E239-T281 HydrophobicContact CB-CG2 3.95Å; E239-T281 VanDerWaalsContact CD-CG2 3.48Å; E239-T281 HydrophobicContact CG-CG2 3.75Å
282	G	94.1	Very high	88.3	Confident	24 Å²	24	42.9 Å²	42.9	25%	0.247	24%	0.239	C	C	.	.	S	Bend	trans	-163.1	178.3	-175.1	0	0	0	0	0	111.9	A280 L290 Y329	A280-G282 VanDerWaalsContact C-N 3.25Å; A280-G282 PolarHBondContact O-N 2.86Å; G282-L290 WeakPolarHBondContact O-CD1 3.5Å; G282-Y329 VanDerWaalsContact CA-CD2 3.43Å; G282-Y329 VanDerWaalsContact CA-CE2 3.48Å
283	L	88.5	Confident	88.4	Confident	131 Å²	131	38.3 Å²	38.3	69%	0.686	22%	0.215	S	C	*	.			trans	-66.7	142.9	166.3	-61.9	176.2	0	0	0	109.9	L290 Y329	L283-L290 HydrophobicContact CD2-CB 4.04Å; L283-Y329 HydrophobicContact CD2-CD1 3.6Å; L283-Y329 HydrophobicContact CD2-CE1 3.61Å; L283-Y329 HydrophobicContact CG-CD1 4.23Å; L283-Y329 HydrophobicContact CG-CE1 3.85Å
284	D	78.9	Confident	88.6	Confident	19 Å²	19	37.6 Å²	37.6	10%	0.102	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-131.4	129	-180	-171	-27.4	0	0	0	108.7	E236 R286 C287 L290	E236-D284 PolarHBondContact N-OD2 3.14Å; D284-R286 PolarHBondContact O-N 2.88Å; D284-R286 WeakPolarHBondContact OD1-CB 3.34Å; D284-R286 IonicContact OD1-CZ 2.72Å; D284-R286 PolarHBondContact OD1-N 3.45Å; D284-R286 IonicContact OD1-NE 3.79Å; D284-R286 PolarHBondContact OD1-NE 2.84Å; D284-R286 VanDerWaalsContact OD1-NE 3.1Å; D284-R286 IonicContact OD1-NH2 3.92Å; D284-R286 IonicContact OD2-CZ 3.11Å; D284-R286 IonicContact OD2-NE 3.36Å; D284-R286 PolarHBondContact OD2-NE 2.99Å; D284-R286 VanDerWaalsContact OD2-NE 3.11Å; D284-R286 IonicContact OD2-NH2 3.59Å; D284-R286 PolarHBondContact OD2-NH2 2.86Å; D284-C287 CarbonylContact O-C 3.59Å; D284-C287 PolarHBondContact O-N 3.15Å; D284-C287 VanDerWaalsContact O-O 3.11Å; D284-L290 HydrophobicContact CB-CD1 3.66Å
285	T	75.3	Confident	88.8	Confident	121 Å²	121	37.1 Å²	37.1	74%	0.742	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.7	178.6	52.3	0	0	0	0	113.8
286	R	74	Confident	88.9	Confident	74 Å²	74	34.6 Å²	34.6	28%	0.279	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-32.9	171.3	-69.4	170.7	-69.7	-148.7	-1.6	112.2	D233 E236 D284 P288	D233-R286 HydrophobicContact CB-CB 4.46Å; D233-R286 VanDerWaalsContact CB-O 3.23Å; D233-R286 WeakPolarHBondContact CB-O 3.24Å; E236-R286 VanDerWaalsContact CG-CZ 3.41Å; E236-R286 IonicContact OE1-CZ 3.39Å; E236-R286 IonicContact OE1-NH1 2.77Å; E236-R286 PolarHBondContact OE1-NH1 3.12Å; E236-R286 IonicContact OE1-NH2 3.25Å; E236-R286 IonicContact OE2-CZ 2.78Å; E236-R286 IonicContact OE2-NH1 2.77Å; E236-R286 PolarHBondContact OE2-NH1 2.88Å; E236-R286 IonicContact OE2-NH2 2.71Å; E236-R286 PolarHBondContact OE2-NH2 3.02Å; D284-R286 PolarHBondContact O-N 2.88Å; D284-R286 WeakPolarHBondContact OD1-CB 3.34Å; D284-R286 IonicContact OD1-CZ 2.72Å; D284-R286 PolarHBondContact OD1-N 3.45Å; D284-R286 IonicContact OD1-NE 3.79Å; D284-R286 PolarHBondContact OD1-NE 2.84Å; D284-R286 VanDerWaalsContact OD1-NE 3.1Å; D284-R286 IonicContact OD1-NH2 3.92Å; D284-R286 IonicContact OD2-CZ 3.11Å; D284-R286 IonicContact OD2-NE 3.36Å; D284-R286 PolarHBondContact OD2-NE 2.99Å; D284-R286 VanDerWaalsContact OD2-NE 3.11Å; D284-R286 IonicContact OD2-NH2 3.59Å; D284-R286 PolarHBondContact OD2-NH2 2.86Å; R286-P288 WeakPolarHBondContact O-CD 3.4Å
287	C	74.7	Confident	88.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-116.1	73.5	176.6	-172	0	0	0	0	111.2	A235 D284 Q289 L290 C337	A235-C287 HydrophobicContact CB-CB 4.21Å; D284-C287 CarbonylContact O-C 3.59Å; D284-C287 PolarHBondContact O-N 3.15Å; D284-C287 VanDerWaalsContact O-O 3.11Å; C287-Q289 PolarHBondContact O-N 3.5Å; C287-L290 HydrophobicContact CB-CD1 3.87Å; C287-L290 HydrophobicContact CB-CG 3.88Å; C287-L290 WeakPolarHBondContact O-CB 3.12Å; C287-L290 WeakPolarHBondContact O-CD1 3.41Å; C287-L290 VanDerWaalsContact O-CG 3.25Å; C287-L290 WeakPolarHBondContact O-CG 3.43Å; C287-L290 PolarHBondContact O-N 3.47Å; C287-L290 VanDerWaalsContact O-N 3.08Å; C287-C337 WeakPolarHBondContact CA-SG 3.34Å; C287-C337 HydrophobicContact CB-CB 3.67Å; C287-C337 WeakPolarHBondContact CB-SG 3.01Å; C287-C337 WeakPolarHBondContact SG-CB 3.2Å; C287-C337 CovalentContact SG-SG 2Å; C287-C337 PolarHBondContact SG-SG 3.19Å
288	P	73.8	Confident	88.9	Confident	57 Å²	57	38.3 Å²	38.3	37%	0.37	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.5	-179.2	26.9	-35.3	0	0	0	113.8	R286 L290	R286-P288 WeakPolarHBondContact O-CD 3.4Å; P288-L290 VanDerWaalsContact C-N 3.26Å; P288-L290 PolarHBondContact O-N 2.71Å
289	Q	75	Confident	88.6	Confident	23 Å²	23	37.8 Å²	37.8	11%	0.107	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-0.8	176.4	-57.6	82.1	-3.7	0	0	113.1	C287 V291 V336 C337	C287-Q289 PolarHBondContact O-N 3.5Å; Q289-V291 PolarHBondContact O-N 2.78Å; Q289-V336 HydrophobicContact CB-CG1 3.43Å; Q289-V336 VanDerWaalsContact CB-CG1 3.43Å; Q289-V336 HydrophobicContact CG-CG1 3.73Å; Q289-C337 PolarHBondContact OE1-SG 2.94Å; Q289-C337 VanDerWaalsContact OE1-SG 3.37Å
290	L	82.9	Confident	88.1	Confident	11 Å²	11	42.1 Å²	42.1	6%	0.058	25%	0.246	C	C	.	.			trans	-59.4	131.8	175.7	-77.7	167.8	0	0	0	111.4	A235 A280 G282 L283 D284 C287 P288 A330 V331 W383	A235-L290 HydrophobicContact CB-CD1 4.49Å; A280-L290 HydrophobicContact CB-CD1 4.1Å; A280-L290 HydrophobicContact CB-CD2 3.77Å; G282-L290 WeakPolarHBondContact O-CD1 3.5Å; L283-L290 HydrophobicContact CD2-CB 4.04Å; D284-L290 HydrophobicContact CB-CD1 3.66Å; C287-L290 HydrophobicContact CB-CD1 3.87Å; C287-L290 HydrophobicContact CB-CG 3.88Å; C287-L290 WeakPolarHBondContact O-CB 3.12Å; C287-L290 WeakPolarHBondContact O-CD1 3.41Å; C287-L290 VanDerWaalsContact O-CG 3.25Å; C287-L290 WeakPolarHBondContact O-CG 3.43Å; C287-L290 PolarHBondContact O-N 3.47Å; C287-L290 VanDerWaalsContact O-N 3.08Å; P288-L290 VanDerWaalsContact C-N 3.26Å; P288-L290 PolarHBondContact O-N 2.71Å; L290-A330 WeakPolarHBondContact CA-O 3.39Å; L290-V331 HydrophobicContact CD2-CG1 4.23Å; L290-W383 HydrophobicContact CD2-CH2 3.57Å; L290-W383 HydrophobicContact CD2-CZ2 4.44Å; L290-W383 HydrophobicContact CD2-CZ3 4.35Å
291	V	85.9	Confident	87.5	Confident	26 Å²	26	46 Å²	46	16%	0.158	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.2	177.3	-71	0	0	0	0	109.6	Q289 I293 V308 Y329 A330 R332	Q289-V291 PolarHBondContact O-N 2.78Å; V291-I293 PolarHBondContact O-N 3.49Å; V291-V308 HydrophobicContact CB-CB 4.41Å; V291-V308 HydrophobicContact CG2-CB 3.69Å; V291-V308 HydrophobicContact CG2-CG1 4.07Å; V291-V308 HydrophobicContact CG2-CG2 4.3Å; V291-Y329 CarbonylContact O-C 3.57Å; V291-Y329 VanDerWaalsContact O-CA 3.27Å; V291-Y329 WeakPolarHBondContact O-CA 3.39Å; V291-A330 VanDerWaalsContact CG2-O 3.26Å; V291-A330 WeakPolarHBondContact CG2-O 3.29Å; V291-A330 PolarHBondContact N-O 2.79Å; V291-A330 PolarHBondContact O-N 3.18Å; V291-R332 HydrophobicContact CG1-CG 4.43Å; V291-R332 HydrophobicContact CG2-CG 3.88Å
292	A	95.9	Very high	87.3	Confident	17 Å²	17	45.2 Å²	45.2	14%	0.14	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	133.9	-180	0	0	0	0	0	111.1	R294 I326 Y329	A292-R294 HydrophobicContact CB-CG 4.43Å; A292-R294 PolarHBondContact O-N 3.25Å; A292-I326 HydrophobicContact CB-CD1 3.77Å; A292-I326 HydrophobicContact CB-CG1 4.03Å; A292-I326 HydrophobicContact CB-CG2 4.04Å; A292-Y329 HydrophobicContact CB-CD1 4.04Å; A292-Y329 HydrophobicContact CB-CE1 3.77Å
293	I	97.5	Very high	87.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	103.2	168.9	-49.2	169.9	0	0	0	107.1	V279 V291 V308 I326 I327 G328 A330 F380	V279-I293 HydrophobicContact CB-CD1 4.12Å; V279-I293 HydrophobicContact CG1-CD1 3.53Å; V291-I293 PolarHBondContact O-N 3.49Å; I293-V308 HydrophobicContact CB-CG1 4.36Å; I293-V308 HydrophobicContact CG1-CG1 3.91Å; I293-I326 WeakPolarHBondContact O-CA 3.44Å; I293-I327 HydrophobicContact CB-CD1 4.46Å; I293-I327 HydrophobicContact CB-CG1 3.85Å; I293-I327 HydrophobicContact CG2-CD1 3.85Å; I293-I327 HydrophobicContact CG2-CG1 3.7Å; I293-I327 PolarHBondContact O-N 3.29Å; I293-I327 VanDerWaalsContact O-N 3.08Å; I293-G328 PolarHBondContact N-O 3.34Å; I293-A330 HydrophobicContact CD1-CB 3.58Å; I293-A330 HydrophobicContact CG1-CB 3.64Å; I293-F380 HydrophobicContact CD1-CD2 4.35Å; I293-F380 HydrophobicContact CD1-CE2 3.96Å; I293-F380 HydrophobicContact CD1-CZ 4.1Å; I293-F380 HydrophobicContact CG2-CD1 4.43Å; I293-F380 HydrophobicContact CG2-CE1 3.87Å; I293-F380 HydrophobicContact CG2-CZ 4.16Å
294	R	97.7	Very high	87.5	Confident	72 Å²	72	38.5 Å²	38.5	27%	0.272	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124	-177.5	-59.9	-179.5	176.1	-87.4	-3.4	109.6	A292 Y306 V307 Y313 G325	A292-R294 HydrophobicContact CB-CG 4.43Å; A292-R294 PolarHBondContact O-N 3.25Å; R294-Y306 CarbonylContact O-C 3.54Å; R294-Y306 VanDerWaalsContact O-CA 3.31Å; R294-Y306 WeakPolarHBondContact O-CA 3.4Å; R294-V307 HydrophobicContact CB-CG2 4.1Å; R294-V307 PolarHBondContact N-O 2.87Å; R294-V307 PolarHBondContact O-N 2.79Å; R294-Y313 HydrophobicContact CB-CD2 4.01Å; R294-Y313 HydrophobicContact CB-CE2 4.1Å; R294-Y313 HydrophobicContact CG-CD2 4.3Å; R294-Y313 HydrophobicContact CG-CE2 4.33Å; R294-G325 WeakPolarHBondContact CA-O 3.4Å
295	H	97.9	Very high	88.4	Confident	5 Å²	5	38.1 Å²	38.1	2%	0.023	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.2	175.8	175.8	-161.8	0	0	0	109	D304 Y306 R324 G325 I327	H295-D304 IonicContact CD2-OD1 3.72Å; H295-D304 IonicContact CE1-OD1 3.68Å; H295-D304 PolarHBondContact CE1-OD1 3.39Å; H295-D304 IonicContact NE2-OD1 3.8Å; H295-D304 PolarHBondContact NE2-OD1 3.26Å; H295-Y306 HydrophobicContact CB-CD1 3.85Å; H295-Y306 HydrophobicContact CB-CE1 3.72Å; H295-Y306 AromaticContact CD2-CE1 3.47Å; H295-Y306 VanDerWaalsContact CD2-CE1 3.47Å; H295-Y306 WeakPolarHBondContact CD2-CE1 3.12Å; H295-Y306 AromaticContact CD2-CZ 3.77Å; H295-Y306 AromaticContact CG-CE1 3.48Å; H295-Y306 VanDerWaalsContact CG-CE1 3.48Å; H295-R324 HydrophobicContact CB-CB 4.14Å; H295-R324 WeakPolarHBondContact ND1-CB 3.23Å; H295-R324 WeakPolarHBondContact O-CA 3.42Å; H295-R324 WeakPolarHBondContact O-CB 3.48Å; H295-R324 PolarHBondContact O-N 2.8Å; H295-G325 PolarHBondContact N-O 3.2Å; H295-I327 HydrophobicContact CB-CG2 3.91Å
296	L	97.7	Very high	89.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.2	177	-65	179.2	0	0	0	109.7	D304 Y305 V307 Y313 L316 L317 Y321 E322 D323	L296-D304 CarbonylContact O-C 3.58Å; L296-D304 WeakPolarHBondContact O-CA 3.48Å; L296-Y305 WeakPolarHBondContact CB-O 3.33Å; L296-Y305 PolarHBondContact N-O 2.81Å; L296-Y305 PolarHBondContact O-N 3.42Å; L296-V307 HydrophobicContact CD1-CG2 3.79Å; L296-V307 HydrophobicContact CG-CG2 4.31Å; L296-Y313 HydrophobicContact CD1-CD2 4.01Å; L296-Y313 HydrophobicContact CD2-CD2 3.97Å; L296-Y313 HydrophobicContact CD2-CE2 3.65Å; L296-Y313 HydrophobicContact CG-CD2 4.29Å; L296-Y313 HydrophobicContact CG-CE2 4.42Å; L296-L316 HydrophobicContact CD1-CB 3.64Å; L296-L316 HydrophobicContact CD1-CD1 3.48Å; L296-L316 VanDerWaalsContact CD1-CD1 3.48Å; L296-L316 HydrophobicContact CD1-CG 4.21Å; L296-L317 HydrophobicContact CD2-CD2 3.87Å; L296-Y321 HydrophobicContact CB-CD1 3.96Å; L296-Y321 HydrophobicContact CB-CG 4.5Å; L296-E322 CarbonylContact C-O 3.51Å; L296-E322 VanDerWaalsContact CA-O 3.29Å; L296-E322 WeakPolarHBondContact CA-O 3.26Å; L296-D323 HydrophobicContact CD2-CB 4.13Å
297	Y	96.4	Very high	90.4	Very high	49 Å²	49	29 Å²	29	19%	0.192	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	140	177.3	175.1	-104.4	0	0	0	111.3	A299 T303 Y321 E322	Y297-A299 HydrophobicContact CE1-CB 3.85Å; Y297-T303 WeakPolarHBondContact CD2-O 3.4Å; Y297-Y321 WeakPolarHBondContact O-CA 3.48Å; Y297-E322 PolarHBondContact N-O 3.04Å; Y297-E322 PolarHBondContact O-N 3.41Å
298	R	94.6	Very high	91	Very high	36 Å²	36	29.6 Å²	29.6	14%	0.136	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	107.6	173.2	-171.6	177.5	-167.5	163.1	14.4	111.4	A300 R301 T302 T303 D319 Y321	R298-A300 VanDerWaalsContact C-N 3.29Å; R298-A300 HydrophobicContact CG-CB 4.32Å; R298-A300 PolarHBondContact O-N 2.92Å; R298-R301 PolarHBondContact O-N 2.93Å; R298-R301 VanDerWaalsContact O-N 3.17Å; R298-T302 PolarHBondContact O-N 3.39Å; R298-T303 HydrophobicContact CB-CG2 4.08Å; R298-T303 PolarHBondContact N-O 3.45Å; R298-T303 PolarHBondContact O-N 3.23Å; R298-D319 IonicContact CZ-OD1 3.75Å; R298-D319 IonicContact CZ-OD2 2.7Å; R298-D319 IonicContact NH1-OD2 3.14Å; R298-D319 PolarHBondContact NH1-OD2 2.88Å; R298-D319 VanDerWaalsContact NH2-CG 3.35Å; R298-D319 PolarHBondContact NH2-O 2.6Å; R298-D319 IonicContact NH2-OD1 3.16Å; R298-D319 PolarHBondContact NH2-OD1 3.49Å; R298-D319 VanDerWaalsContact NH2-OD1 3.14Å; R298-D319 IonicContact NH2-OD2 4Å; R298-D319 PolarHBondContact NH2-OD2 3.4Å; R298-Y321 HydrophobicContact CB-CD1 3.79Å; R298-Y321 HydrophobicContact CB-CD2 4.46Å; R298-Y321 HydrophobicContact CB-CE1 3.71Å; R298-Y321 HydrophobicContact CB-CE2 4.39Å; R298-Y321 HydrophobicContact CB-CG 4.18Å; R298-Y321 HydrophobicContact CG-CE2 4.45Å
299	A	90.6	Very high	91.4	Very high	55 Å²	55	30 Å²	30	46%	0.455	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-57.1	-39.1	-179.7	0	0	0	0	0	113.5	Y297 R301 T302	Y297-A299 HydrophobicContact CE1-CB 3.85Å; A299-R301 PolarHBondContact O-N 3.04Å; A299-T302 PolarHBondContact O-N 3.09Å
300	A	87	Confident	91.7	Very high	90 Å²	90	32.1 Å²	32.1	74%	0.744	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-60.3	-20.3	-178.5	0	0	0	0	0	114.4	R298	R298-A300 VanDerWaalsContact C-N 3.29Å; R298-A300 HydrophobicContact CG-CB 4.32Å; R298-A300 PolarHBondContact O-N 2.92Å
301	R	84.6	Confident	91.6	Very high	82 Å²	82	35.5 Å²	35.5	31%	0.309	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-127.2	5.2	177.2	-57.4	-174.1	-141.9	-117.6	3.7	113.4	R298 A299 T303 Y347	R298-R301 PolarHBondContact O-N 2.93Å; R298-R301 VanDerWaalsContact O-N 3.17Å; A299-R301 PolarHBondContact O-N 3.04Å; R301-T303 HydrophobicContact CB-CG2 3.91Å; R301-T303 PolarHBondContact O-N 3.38Å; R301-T303 VanDerWaalsContact O-N 3.14Å; R301-Y347 PolarHBondContact NH1-OH 2.9Å
302	T	89.5	Confident	91.4	Very high	57 Å²	57	37.4 Å²	37.4	35%	0.35	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	42.9	-175	55.7	0	0	0	0	113.3	T251 R298 A299	T251-T302 PolarHBondContact OG1-O 2.68Å; R298-T302 PolarHBondContact O-N 3.39Å; A299-T302 PolarHBondContact O-N 3.09Å
303	T	92.8	Very high	91.1	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.5	-175	-173.3	0	0	0	0	110.9	Y297 R298 R301 H353	Y297-T303 WeakPolarHBondContact CD2-O 3.4Å; R298-T303 HydrophobicContact CB-CG2 4.08Å; R298-T303 PolarHBondContact N-O 3.45Å; R298-T303 PolarHBondContact O-N 3.23Å; R301-T303 HydrophobicContact CB-CG2 3.91Å; R301-T303 PolarHBondContact O-N 3.38Å; R301-T303 VanDerWaalsContact O-N 3.14Å; T303-H353 PolarHBondContact OG1-N 3.47Å
304	D	95.6	Very high	90.7	Very high	10 Å²	10	43.1 Å²	43.1	5%	0.053	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	144.5	168.6	-61.5	-92.3	0	0	0	109.1	T251 Y253 H295 L296 Y306	T251-D304 WeakPolarHBondContact CG2-OD2 3.19Å; Y253-D304 WeakPolarHBondContact CE1-OD2 3.44Å; H295-D304 IonicContact CD2-OD1 3.72Å; H295-D304 IonicContact CE1-OD1 3.68Å; H295-D304 PolarHBondContact CE1-OD1 3.39Å; H295-D304 IonicContact NE2-OD1 3.8Å; H295-D304 PolarHBondContact NE2-OD1 3.26Å; L296-D304 CarbonylContact O-C 3.58Å; L296-D304 WeakPolarHBondContact O-CA 3.48Å; D304-Y306 HydrophobicContact CB-CE2 4.11Å
305	Y	96.7	Very high	90.3	Very high	11 Å²	11	43.3 Å²	43.3	4%	0.043	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	128.9	179.6	-172.1	-157.2	0	0	0	110.6	L296 V307 L312 L316 Y321 E345 H353	L296-Y305 WeakPolarHBondContact CB-O 3.33Å; L296-Y305 PolarHBondContact N-O 2.81Å; L296-Y305 PolarHBondContact O-N 3.42Å; Y305-V307 HydrophobicContact CD1-CG1 3.74Å; Y305-V307 HydrophobicContact CD2-CG1 4.06Å; Y305-V307 HydrophobicContact CE1-CG1 3.47Å; Y305-V307 VanDerWaalsContact CE1-CG1 3.47Å; Y305-V307 HydrophobicContact CE2-CG1 3.78Å; Y305-V307 HydrophobicContact CG-CG1 4.03Å; Y305-V307 VanDerWaalsContact CZ-CG1 3.47Å; Y305-L312 HydrophobicContact CE1-CD2 4.48Å; Y305-L316 HydrophobicContact CD1-CD1 3.59Å; Y305-L316 HydrophobicContact CD1-CD2 4.17Å; Y305-L316 HydrophobicContact CE1-CD1 3.47Å; Y305-L316 VanDerWaalsContact CE1-CD1 3.47Å; Y305-L316 HydrophobicContact CE1-CD2 4.11Å; Y305-L316 HydrophobicContact CE1-CG 4.44Å; Y305-Y321 HydrophobicContact CD1-CE1 4.29Å; Y305-E345 VanDerWaalsContact CE2-CD 3.41Å; Y305-E345 HydrophobicContact CE2-CG 4.34Å; Y305-E345 WeakPolarHBondContact CE2-OE1 3.42Å; Y305-E345 VanDerWaalsContact CE2-OE2 3.29Å; Y305-E345 WeakPolarHBondContact CE2-OE2 3.41Å; Y305-E345 PolarHBondContact OH-OE1 2.95Å; Y305-E345 PolarHBondContact OH-OE2 2.76Å; Y305-H353 AromaticContact CD1-CE1 3.6Å; Y305-H353 AromaticContact CD1-ND1 3.85Å; Y305-H353 AromaticContact CD1-NE2 3.78Å; Y305-H353 HydrophobicContact CD2-CB 3.97Å; Y305-H353 AromaticContact CD2-CG 3.77Å; Y305-H353 AromaticContact CD2-ND1 3.69Å; Y305-H353 AromaticContact CE1-CE1 3.52Å; Y305-H353 AromaticContact CE1-ND1 3.8Å; Y305-H353 AromaticContact CE2-ND1 3.67Å; Y305-H353 HydrophobicContact CG-CB 4.28Å; Y305-H353 AromaticContact CG-CD2 3.92Å; Y305-H353 AromaticContact CG-CE1 3.99Å; Y305-H353 AromaticContact CG-CG 3.76Å; Y305-H353 AromaticContact CG-ND1 3.81Å; Y305-H353 AromaticContact CZ-CE1 3.88Å; Y305-H353 AromaticContact CZ-ND1 3.73Å
306	Y	97.8	Very high	90.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118	-175.1	-57.6	-84.8	0	0	0	109.3	L254 R294 H295 D304 I327 Q355 T379	L254-Y306 HydrophobicContact CB-CD1 4.3Å; L254-Y306 HydrophobicContact CB-CD2 3.99Å; L254-Y306 HydrophobicContact CB-CE1 4Å; L254-Y306 HydrophobicContact CB-CE2 3.69Å; L254-Y306 HydrophobicContact CB-CG 4.3Å; L254-Y306 HydrophobicContact CD1-CD2 3.64Å; L254-Y306 HydrophobicContact CD1-CE2 4.07Å; L254-Y306 HydrophobicContact CD1-CG 4.06Å; L254-Y306 HydrophobicContact CG-CD2 3.75Å; L254-Y306 HydrophobicContact CG-CE2 3.62Å; L254-Y306 HydrophobicContact CG-CG 4.41Å; L254-Y306 VanDerWaalsContact N-CZ 3.35Å; L254-Y306 PolarHBondContact N-OH 2.86Å; L254-Y306 VanDerWaalsContact O-CE1 3.3Å; L254-Y306 WeakPolarHBondContact O-CE1 3.24Å; L254-Y306 PolarHBondContact O-OH 2.87Å; R294-Y306 CarbonylContact O-C 3.54Å; R294-Y306 VanDerWaalsContact O-CA 3.31Å; R294-Y306 WeakPolarHBondContact O-CA 3.4Å; H295-Y306 HydrophobicContact CB-CD1 3.85Å; H295-Y306 HydrophobicContact CB-CE1 3.72Å; H295-Y306 AromaticContact CD2-CE1 3.47Å; H295-Y306 VanDerWaalsContact CD2-CE1 3.47Å; H295-Y306 WeakPolarHBondContact CD2-CE1 3.12Å; H295-Y306 AromaticContact CD2-CZ 3.77Å; H295-Y306 AromaticContact CG-CE1 3.48Å; H295-Y306 VanDerWaalsContact CG-CE1 3.48Å; D304-Y306 HydrophobicContact CB-CE2 4.11Å; Y306-I327 HydrophobicContact CD1-CD1 3.46Å; Y306-I327 VanDerWaalsContact CD1-CD1 3.46Å; Y306-I327 HydrophobicContact CD1-CG1 4.16Å; Y306-I327 HydrophobicContact CE1-CD1 3.75Å; Y306-I327 HydrophobicContact CE1-CG2 4.27Å; Y306-I327 HydrophobicContact CG-CD1 4.33Å; Y306-Q355 VanDerWaalsContact CD2-OE1 3.27Å; Y306-Q355 PolarHBondContact O-NE2 2.89Å; Y306-T379 WeakPolarHBondContact O-CG2 3.31Å
307	V	93.3	Very high	90.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143	-171.8	-63.2	0	0	0	0	112.9	R294 L296 Y305 L312 Y313 L316	R294-V307 HydrophobicContact CB-CG2 4.1Å; R294-V307 PolarHBondContact N-O 2.87Å; R294-V307 PolarHBondContact O-N 2.79Å; L296-V307 HydrophobicContact CD1-CG2 3.79Å; L296-V307 HydrophobicContact CG-CG2 4.31Å; Y305-V307 HydrophobicContact CD1-CG1 3.74Å; Y305-V307 HydrophobicContact CD2-CG1 4.06Å; Y305-V307 HydrophobicContact CE1-CG1 3.47Å; Y305-V307 VanDerWaalsContact CE1-CG1 3.47Å; Y305-V307 HydrophobicContact CE2-CG1 3.78Å; Y305-V307 HydrophobicContact CG-CG1 4.03Å; Y305-V307 VanDerWaalsContact CZ-CG1 3.47Å; V307-L312 HydrophobicContact CG1-CD2 4.21Å; V307-Y313 HydrophobicContact CG2-CD2 4.11Å; V307-L316 HydrophobicContact CG1-CD1 3.81Å; V307-L316 HydrophobicContact CG2-CD1 4.41Å
308	V	87.8	Confident	90	Very high	13 Å²	13	48.6 Å²	48.6	8%	0.079	30%	0.298	C	S	.	.			trans	-115.2	-9.9	175.4	-60.9	0	0	0	0	113.5	V291 I293 A330 R332 T379 F380	V291-V308 HydrophobicContact CB-CB 4.41Å; V291-V308 HydrophobicContact CG2-CB 3.69Å; V291-V308 HydrophobicContact CG2-CG1 4.07Å; V291-V308 HydrophobicContact CG2-CG2 4.3Å; I293-V308 HydrophobicContact CB-CG1 4.36Å; I293-V308 HydrophobicContact CG1-CG1 3.91Å; V308-A330 HydrophobicContact CG1-CB 4.48Å; V308-R332 HydrophobicContact CG2-CG 4.46Å; V308-T379 VanDerWaalsContact CG2-O 3.28Å; V308-T379 WeakPolarHBondContact CG2-O 3.47Å; V308-F380 HydrophobicContact CB-CB 4.5Å; V308-F380 HydrophobicContact CG1-CB 3.78Å; V308-F380 HydrophobicContact CG1-CD1 3.93Å; V308-F380 HydrophobicContact CG1-CG 4.06Å; V308-F380 HydrophobicContact CG2-CB 3.9Å
309	D	81.7	Confident	89.9	Confident	65 Å²	65	51 Å²	51	35%	0.348	31%	0.313	S	S	.	.			trans	-85.4	117.3	177.2	-173.8	-64.3	0	0	0	110	S311 L312 Y313	D309-S311 VanDerWaalsContact C-N 3.31Å; D309-S311 PolarHBondContact O-N 3.05Å; D309-S311 WeakPolarHBondContact OD1-CA 3.09Å; D309-S311 WeakPolarHBondContact OD1-CB 3.35Å; D309-S311 PolarHBondContact OD1-N 2.76Å; D309-S311 PolarHBondContact OD1-OG 3.39Å; D309-L312 HydrophobicContact CB-CB 3.94Å; D309-L312 PolarHBondContact O-N 3.01Å; D309-L312 PolarHBondContact OD1-N 3.02Å; D309-Y313 VanDerWaalsContact O-CB 3.29Å; D309-Y313 WeakPolarHBondContact O-CB 3.43Å; D309-Y313 PolarHBondContact O-N 2.78Å
310	S	81.3	Confident	90.1	Very high	69 Å²	69	50.8 Å²	50.8	48%	0.483	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-30.7	-176.5	-55.8	0	0	0	0	113.4	Q314	S310-Q314 WeakPolarHBondContact O-CG 3.4Å; S310-Q314 PolarHBondContact O-N 2.94Å
311	S	80.5	Confident	90.6	Very high	82 Å²	82	47.1 Å²	47.1	57%	0.573	28%	0.284	S	S	*	.	H	α-helix	trans	-76.8	-41	-179.6	70.7	0	0	0	0	111.6	D309 Q314 S315	D309-S311 VanDerWaalsContact C-N 3.31Å; D309-S311 PolarHBondContact O-N 3.05Å; D309-S311 WeakPolarHBondContact OD1-CA 3.09Å; D309-S311 WeakPolarHBondContact OD1-CB 3.35Å; D309-S311 PolarHBondContact OD1-N 2.76Å; D309-S311 PolarHBondContact OD1-OG 3.39Å; S311-Q314 PolarHBondContact O-N 2.97Å; S311-S315 PolarHBondContact O-N 3.22Å; S311-S315 PolarHBondContact O-OG 3.17Å; S311-S315 VanDerWaalsContact O-OG 3.13Å
312	L	83.1	Confident	91.2	Very high	66 Å²	66	47.2 Å²	47.2	35%	0.346	29%	0.288	S	S	.	.	H	α-helix	trans	-63.9	-44	172.5	178.1	58.3	0	0	0	110.7	Y305 V307 D309 Q314 S315 L316	Y305-L312 HydrophobicContact CE1-CD2 4.48Å; V307-L312 HydrophobicContact CG1-CD2 4.21Å; D309-L312 HydrophobicContact CB-CB 3.94Å; D309-L312 PolarHBondContact O-N 3.01Å; D309-L312 PolarHBondContact OD1-N 3.02Å; L312-Q314 PolarHBondContact O-N 3.31Å; L312-S315 WeakPolarHBondContact O-CB 3.19Å; L312-S315 PolarHBondContact O-N 3.35Å; L312-S315 VanDerWaalsContact O-N 3.13Å; L312-L316 HydrophobicContact CD1-CD1 4.1Å; L312-L316 HydrophobicContact CD1-CG 4.09Å; L312-L316 HydrophobicContact CG-CD1 3.83Å; L312-L316 HydrophobicContact CG-CG 4.31Å; L312-L316 VanDerWaalsContact O-CG 3.3Å; L312-L316 WeakPolarHBondContact O-CG 3.44Å; L312-L316 PolarHBondContact O-N 2.92Å
313	Y	88.5	Confident	91.6	Very high	19 Å²	19	48 Å²	48	8%	0.075	29%	0.29	C	S	.	.	H	α-helix	trans	-52.8	-50.2	175.7	169.3	-104.8	0	0	0	112.4	R294 L296 V307 D309 S315 L316 L317 D323	R294-Y313 HydrophobicContact CB-CD2 4.01Å; R294-Y313 HydrophobicContact CB-CE2 4.1Å; R294-Y313 HydrophobicContact CG-CD2 4.3Å; R294-Y313 HydrophobicContact CG-CE2 4.33Å; L296-Y313 HydrophobicContact CD1-CD2 4.01Å; L296-Y313 HydrophobicContact CD2-CD2 3.97Å; L296-Y313 HydrophobicContact CD2-CE2 3.65Å; L296-Y313 HydrophobicContact CG-CD2 4.29Å; L296-Y313 HydrophobicContact CG-CE2 4.42Å; V307-Y313 HydrophobicContact CG2-CD2 4.11Å; D309-Y313 VanDerWaalsContact O-CB 3.29Å; D309-Y313 WeakPolarHBondContact O-CB 3.43Å; D309-Y313 PolarHBondContact O-N 2.78Å; Y313-S315 VanDerWaalsContact C-N 3.3Å; Y313-S315 PolarHBondContact O-N 3.06Å; Y313-L316 PolarHBondContact O-N 3.27Å; Y313-L317 HydrophobicContact CD1-CD1 4.45Å; Y313-L317 HydrophobicContact CE1-CD1 3.75Å; Y313-L317 HydrophobicContact CE1-CG 4.47Å; Y313-L317 HydrophobicContact CE2-CD1 4.18Å; Y313-L317 HydrophobicContact CE2-CD2 4.21Å; Y313-L317 HydrophobicContact CE2-CG 4.21Å; Y313-L317 WeakPolarHBondContact O-CG 3.49Å; Y313-L317 PolarHBondContact O-N 3.4Å; Y313-L317 VanDerWaalsContact O-N 3.09Å; Y313-D323 PolarHBondContact OH-OD2 3.45Å
314	Q	89.2	Confident	91.8	Very high	117 Å²	117	54.5 Å²	54.5	55%	0.547	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-37.9	178.7	-67.9	-61.9	-23.3	0	0	112.4	S310 S311 L312 L317 A318	S310-Q314 WeakPolarHBondContact O-CG 3.4Å; S310-Q314 PolarHBondContact O-N 2.94Å; S311-Q314 PolarHBondContact O-N 2.97Å; L312-Q314 PolarHBondContact O-N 3.31Å; Q314-L317 PolarHBondContact O-N 2.91Å; Q314-A318 PolarHBondContact O-N 3.49Å; Q314-A318 VanDerWaalsContact O-N 3.15Å
315	S	89.5	Confident	91.8	Very high	77 Å²	77	55.3 Å²	55.3	54%	0.538	32%	0.324	S	S	.	.	H	α-helix	trans	-67.4	-35.8	177.4	-62.2	0	0	0	0	112.4	S311 L312 Y313 A318 D319	S311-S315 PolarHBondContact O-N 3.22Å; S311-S315 PolarHBondContact O-OG 3.17Å; S311-S315 VanDerWaalsContact O-OG 3.13Å; L312-S315 WeakPolarHBondContact O-CB 3.19Å; L312-S315 PolarHBondContact O-N 3.35Å; L312-S315 VanDerWaalsContact O-N 3.13Å; Y313-S315 VanDerWaalsContact C-N 3.3Å; Y313-S315 PolarHBondContact O-N 3.06Å; S315-A318 PolarHBondContact O-N 2.97Å; S315-D319 PolarHBondContact O-N 3.08Å
316	L	94.6	Very high	91.9	Very high	16 Å²	16	58.4 Å²	58.4	8%	0.084	34%	0.341	C	S	.	.	H	α-helix	trans	-69.9	-39.1	176.6	-68.8	165.1	0	0	0	112	L296 Y305 V307 L312 Y313 A318 D319 G320 Y321	L296-L316 HydrophobicContact CD1-CB 3.64Å; L296-L316 HydrophobicContact CD1-CD1 3.48Å; L296-L316 VanDerWaalsContact CD1-CD1 3.48Å; L296-L316 HydrophobicContact CD1-CG 4.21Å; Y305-L316 HydrophobicContact CD1-CD1 3.59Å; Y305-L316 HydrophobicContact CD1-CD2 4.17Å; Y305-L316 HydrophobicContact CE1-CD1 3.47Å; Y305-L316 VanDerWaalsContact CE1-CD1 3.47Å; Y305-L316 HydrophobicContact CE1-CD2 4.11Å; Y305-L316 HydrophobicContact CE1-CG 4.44Å; V307-L316 HydrophobicContact CG1-CD1 3.81Å; V307-L316 HydrophobicContact CG2-CD1 4.41Å; L312-L316 HydrophobicContact CD1-CD1 4.1Å; L312-L316 HydrophobicContact CD1-CG 4.09Å; L312-L316 HydrophobicContact CG-CD1 3.83Å; L312-L316 HydrophobicContact CG-CG 4.31Å; L312-L316 VanDerWaalsContact O-CG 3.3Å; L312-L316 WeakPolarHBondContact O-CG 3.44Å; L312-L316 PolarHBondContact O-N 2.92Å; Y313-L316 PolarHBondContact O-N 3.27Å; L316-A318 VanDerWaalsContact C-N 3.28Å; L316-A318 PolarHBondContact O-N 2.87Å; L316-D319 CarbonylContact O-C 3.52Å; L316-D319 PolarHBondContact O-N 3.33Å; L316-D319 VanDerWaalsContact O-N 3.12Å; L316-G320 PolarHBondContact O-N 3.39Å; L316-Y321 HydrophobicContact CB-CD2 3.98Å; L316-Y321 HydrophobicContact CB-CG 4.09Å; L316-Y321 HydrophobicContact CD2-CD2 3.86Å; L316-Y321 HydrophobicContact CD2-CE1 4.37Å; L316-Y321 HydrophobicContact CD2-CE2 3.58Å; L316-Y321 HydrophobicContact CD2-CG 4.38Å; L316-Y321 WeakPolarHBondContact O-CB 3.49Å; L316-Y321 VanDerWaalsContact O-CD2 3.3Å; L316-Y321 WeakPolarHBondContact O-CD2 3.46Å; L316-Y321 PolarHBondContact O-N 3.03Å
317	L	96.6	Very high	91.9	Very high	56 Å²	56	59 Å²	59	29%	0.293	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-42	171.9	-65.3	-175.2	0	0	0	111.3	L296 Y313 Q314 D319 G320 Y321 D323	L296-L317 HydrophobicContact CD2-CD2 3.87Å; Y313-L317 HydrophobicContact CD1-CD1 4.45Å; Y313-L317 HydrophobicContact CE1-CD1 3.75Å; Y313-L317 HydrophobicContact CE1-CG 4.47Å; Y313-L317 HydrophobicContact CE2-CD1 4.18Å; Y313-L317 HydrophobicContact CE2-CD2 4.21Å; Y313-L317 HydrophobicContact CE2-CG 4.21Å; Y313-L317 WeakPolarHBondContact O-CG 3.49Å; Y313-L317 PolarHBondContact O-N 3.4Å; Y313-L317 VanDerWaalsContact O-N 3.09Å; Q314-L317 PolarHBondContact O-N 2.91Å; L317-D319 VanDerWaalsContact C-N 3.29Å; L317-D319 PolarHBondContact O-N 2.81Å; L317-G320 PolarHBondContact O-N 3.2Å; L317-G320 VanDerWaalsContact O-N 3.09Å; L317-Y321 WeakPolarHBondContact CD2-O 3.47Å; L317-D323 HydrophobicContact CD2-CB 4.21Å
318	A	94.6	Very high	92.1	Very high	92 Å²	92	59.1 Å²	59.1	76%	0.76	35%	0.346	S	S	*	.	H	α-helix	trans	-65.2	-29.3	175.2	0	0	0	0	0	113.3	Q314 S315 L316 G320	Q314-A318 PolarHBondContact O-N 3.49Å; Q314-A318 VanDerWaalsContact O-N 3.15Å; S315-A318 PolarHBondContact O-N 2.97Å; L316-A318 VanDerWaalsContact C-N 3.28Å; L316-A318 PolarHBondContact O-N 2.87Å; A318-G320 PolarHBondContact O-N 3.41Å
319	D	92.6	Very high	92.5	Very high	86 Å²	86	60.8 Å²	60.8	46%	0.46	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	6.9	173.3	-170.6	43.3	0	0	0	113.4	R298 S315 L316 L317 Y321	R298-D319 IonicContact CZ-OD1 3.75Å; R298-D319 IonicContact CZ-OD2 2.7Å; R298-D319 IonicContact NH1-OD2 3.14Å; R298-D319 PolarHBondContact NH1-OD2 2.88Å; R298-D319 VanDerWaalsContact NH2-CG 3.35Å; R298-D319 PolarHBondContact NH2-O 2.6Å; R298-D319 IonicContact NH2-OD1 3.16Å; R298-D319 PolarHBondContact NH2-OD1 3.49Å; R298-D319 VanDerWaalsContact NH2-OD1 3.14Å; R298-D319 IonicContact NH2-OD2 4Å; R298-D319 PolarHBondContact NH2-OD2 3.4Å; S315-D319 PolarHBondContact O-N 3.08Å; L316-D319 CarbonylContact O-C 3.52Å; L316-D319 PolarHBondContact O-N 3.33Å; L316-D319 VanDerWaalsContact O-N 3.12Å; L317-D319 VanDerWaalsContact C-N 3.29Å; L317-D319 PolarHBondContact O-N 2.81Å; D319-Y321 HydrophobicContact CB-CD2 4.4Å
320	G	95	Very high	93	Very high	51 Å²	51	57.7 Å²	57.7	53%	0.526	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	22.8	174.1	0	0	0	0	0	114.9	L316 L317 A318	L316-G320 PolarHBondContact O-N 3.39Å; L317-G320 PolarHBondContact O-N 3.2Å; L317-G320 VanDerWaalsContact O-N 3.09Å; A318-G320 PolarHBondContact O-N 3.41Å
321	Y	97.6	Very high	93.1	Very high	14 Å²	14	54.4 Å²	54.4	6%	0.055	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-73.2	139.8	164.8	-73.8	-111.8	0	0	0	110.2	L296 Y297 R298 Y305 L316 L317 D319 H353	L296-Y321 HydrophobicContact CB-CD1 3.96Å; L296-Y321 HydrophobicContact CB-CG 4.5Å; Y297-Y321 WeakPolarHBondContact O-CA 3.48Å; R298-Y321 HydrophobicContact CB-CD1 3.79Å; R298-Y321 HydrophobicContact CB-CD2 4.46Å; R298-Y321 HydrophobicContact CB-CE1 3.71Å; R298-Y321 HydrophobicContact CB-CE2 4.39Å; R298-Y321 HydrophobicContact CB-CG 4.18Å; R298-Y321 HydrophobicContact CG-CE2 4.45Å; Y305-Y321 HydrophobicContact CD1-CE1 4.29Å; L316-Y321 HydrophobicContact CB-CD2 3.98Å; L316-Y321 HydrophobicContact CB-CG 4.09Å; L316-Y321 HydrophobicContact CD2-CD2 3.86Å; L316-Y321 HydrophobicContact CD2-CE1 4.37Å; L316-Y321 HydrophobicContact CD2-CE2 3.58Å; L316-Y321 HydrophobicContact CD2-CG 4.38Å; L316-Y321 WeakPolarHBondContact O-CB 3.49Å; L316-Y321 VanDerWaalsContact O-CD2 3.3Å; L316-Y321 WeakPolarHBondContact O-CD2 3.46Å; L316-Y321 PolarHBondContact O-N 3.03Å; L317-Y321 WeakPolarHBondContact CD2-O 3.47Å; D319-Y321 HydrophobicContact CB-CD2 4.4Å; Y321-H353 AromaticContact CZ-NE2 3.83Å; Y321-H353 PolarHBondContact OH-NE2 2.79Å
322	E	97.7	Very high	93	Very high	84 Å²	84	55.5 Å²	55.5	39%	0.393	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.7	174.9	-63.5	168.8	-162	0	0	109.8	L296 Y297 R324	L296-E322 CarbonylContact C-O 3.51Å; L296-E322 VanDerWaalsContact CA-O 3.29Å; L296-E322 WeakPolarHBondContact CA-O 3.26Å; Y297-E322 PolarHBondContact N-O 3.04Å; Y297-E322 PolarHBondContact O-N 3.41Å; E322-R324 IonicContact OE2-CZ 3.98Å; E322-R324 IonicContact OE2-NE 3.59Å; E322-R324 IonicContact OE2-NH2 2.65Å; E322-R324 PolarHBondContact OE2-NH2 2.96Å
323	D	97.8	Very high	92.2	Very high	73 Å²	73	52.4 Å²	52.4	39%	0.39	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	123.4	171.7	-171.7	8.7	0	0	0	110.7	L296 Y313 L317 G325	L296-D323 HydrophobicContact CD2-CB 4.13Å; Y313-D323 PolarHBondContact OH-OD2 3.45Å; L317-D323 HydrophobicContact CD2-CB 4.21Å; D323-G325 PolarHBondContact OD1-N 2.94Å
324	R	96.5	Very high	91.4	Very high	141 Å²	141	53.7 Å²	53.7	53%	0.532	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	1.3	176.9	-60.2	-63	-178.5	146.3	-6.7	112.3	H295 E322	H295-R324 HydrophobicContact CB-CB 4.14Å; H295-R324 WeakPolarHBondContact ND1-CB 3.23Å; H295-R324 WeakPolarHBondContact O-CA 3.42Å; H295-R324 WeakPolarHBondContact O-CB 3.48Å; H295-R324 PolarHBondContact O-N 2.8Å; E322-R324 IonicContact OE2-CZ 3.98Å; E322-R324 IonicContact OE2-NE 3.59Å; E322-R324 IonicContact OE2-NH2 2.65Å; E322-R324 PolarHBondContact OE2-NH2 2.96Å
325	G	96.4	Very high	90.4	Very high	27 Å²	27	50.6 Å²	50.6	28%	0.278	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	105.5	-162.1	172.6	0	0	0	0	0	113.7	R294 H295 D323	R294-G325 WeakPolarHBondContact CA-O 3.4Å; H295-G325 PolarHBondContact N-O 3.2Å; D323-G325 PolarHBondContact OD1-N 2.94Å
326	I	97.5	Very high	89.4	Confident	77 Å²	77	47 Å²	47	40%	0.395	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.5	-176.6	-62.9	171.1	0	0	0	108.5	A292 I293 G328 Y329	A292-I326 HydrophobicContact CB-CD1 3.77Å; A292-I326 HydrophobicContact CB-CG1 4.03Å; A292-I326 HydrophobicContact CB-CG2 4.04Å; I293-I326 WeakPolarHBondContact O-CA 3.44Å; I326-G328 VanDerWaalsContact CG2-O 3.27Å; I326-G328 WeakPolarHBondContact CG2-O 3.38Å; I326-Y329 HydrophobicContact CG2-CE2 4.02Å
327	I	97.5	Very high	88.5	Confident	12 Å²	12	46.6 Å²	46.6	6%	0.062	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-5.8	176.8	62.5	159.4	0	0	0	113	L241 L254 T256 I293 H295 Y306	L241-I327 HydrophobicContact CD1-CD1 3.81Å; L254-I327 HydrophobicContact CB-CD1 4.15Å; T256-I327 WeakPolarHBondContact CB-O 3.36Å; T256-I327 WeakPolarHBondContact CG2-O 3.49Å; T256-I327 PolarHBondContact OG1-O 2.83Å; I293-I327 HydrophobicContact CB-CD1 4.46Å; I293-I327 HydrophobicContact CB-CG1 3.85Å; I293-I327 HydrophobicContact CG2-CD1 3.85Å; I293-I327 HydrophobicContact CG2-CG1 3.7Å; I293-I327 PolarHBondContact O-N 3.29Å; I293-I327 VanDerWaalsContact O-N 3.08Å; H295-I327 HydrophobicContact CB-CG2 3.91Å; Y306-I327 HydrophobicContact CD1-CD1 3.46Å; Y306-I327 VanDerWaalsContact CD1-CD1 3.46Å; Y306-I327 HydrophobicContact CD1-CG1 4.16Å; Y306-I327 HydrophobicContact CE1-CD1 3.75Å; Y306-I327 HydrophobicContact CE1-CG2 4.27Å; Y306-I327 HydrophobicContact CG-CD1 4.33Å
328	G	97.4	Very high	87.6	Confident	4 Å²	4	45.2 Å²	45.2	4%	0.041	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.6	-170.1	-178.4	0	0	0	0	0	110.9	A280 I293 I326	A280-G328 CarbonylContact O-C 3.26Å; A280-G328 WeakPolarHBondContact O-CA 3.44Å; I293-G328 PolarHBondContact N-O 3.34Å; I326-G328 VanDerWaalsContact CG2-O 3.27Å; I326-G328 WeakPolarHBondContact CG2-O 3.38Å
329	Y	96.3	Very high	87	Confident	48 Å²	48	40.9 Å²	40.9	19%	0.188	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.3	-179.4	-62	-104.8	0	0	0	110	A280 G282 L283 V291 A292 I326	A280-Y329 PolarHBondContact N-O 3.49Å; A280-Y329 PolarHBondContact O-N 3.41Å; G282-Y329 VanDerWaalsContact CA-CD2 3.43Å; G282-Y329 VanDerWaalsContact CA-CE2 3.48Å; L283-Y329 HydrophobicContact CD2-CD1 3.6Å; L283-Y329 HydrophobicContact CD2-CE1 3.61Å; L283-Y329 HydrophobicContact CG-CD1 4.23Å; L283-Y329 HydrophobicContact CG-CE1 3.85Å; V291-Y329 CarbonylContact O-C 3.57Å; V291-Y329 VanDerWaalsContact O-CA 3.27Å; V291-Y329 WeakPolarHBondContact O-CA 3.39Å; A292-Y329 HydrophobicContact CB-CD1 4.04Å; A292-Y329 HydrophobicContact CB-CE1 3.77Å; I326-Y329 HydrophobicContact CG2-CE2 4.02Å
330	A	93.6	Very high	86.5	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	-174.7	-179.7	0	0	0	0	0	109.5	L290 V291 I293 V308 F380 W381	L290-A330 WeakPolarHBondContact CA-O 3.39Å; V291-A330 VanDerWaalsContact CG2-O 3.26Å; V291-A330 WeakPolarHBondContact CG2-O 3.29Å; V291-A330 PolarHBondContact N-O 2.79Å; V291-A330 PolarHBondContact O-N 3.18Å; I293-A330 HydrophobicContact CD1-CB 3.58Å; I293-A330 HydrophobicContact CG1-CB 3.64Å; V308-A330 HydrophobicContact CG1-CB 4.48Å; A330-F380 HydrophobicContact CB-CB 3.99Å; A330-F380 HydrophobicContact CB-CD2 3.6Å; A330-F380 HydrophobicContact CB-CE2 4.34Å; A330-F380 HydrophobicContact CB-CG 3.97Å; A330-W381 WeakPolarHBondContact CB-O 3.48Å
331	V	83.8	Confident	86.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-122.4	153.9	176.8	-62.7	0	0	0	0	110.6	L290 G333 V336 A339 W381 W383	L290-V331 HydrophobicContact CD2-CG1 4.23Å; V331-G333 VanDerWaalsContact C-N 3.29Å; V331-G333 WeakPolarHBondContact CG2-O 3.49Å; V331-G333 PolarHBondContact O-N 2.89Å; V331-V336 HydrophobicContact CB-CB 3.77Å; V331-V336 HydrophobicContact CB-CG1 3.68Å; V331-V336 HydrophobicContact CG1-CB 4.18Å; V331-V336 HydrophobicContact CG1-CG1 3.68Å; V331-V336 HydrophobicContact CG2-CB 3.72Å; V331-V336 HydrophobicContact CG2-CG1 4.17Å; V331-A339 HydrophobicContact CG2-CB 3.32Å; V331-W381 HydrophobicContact CG2-CB 3.92Å; V331-W381 PolarHBondContact N-O 3.02Å; V331-W381 VanDerWaalsContact N-O 3.17Å; V331-W381 PolarHBondContact O-N 2.03Å; V331-W383 HydrophobicContact CG1-CH2 4.1Å; V331-W383 HydrophobicContact CG1-CZ2 4.26Å
332	R	77.1	Confident	85.5	Confident	106 Å²	106	38.3 Å²	38.3	40%	0.4	20%	0.196	S	C	.	.	S	Bend	trans	-81.3	-6.5	-176	-65.8	-174.1	179.8	170.2	2.6	114.1	L34 V291 V308	L34-R332 WeakPolarHBondContact CD1-O 3.44Å; V291-R332 HydrophobicContact CG1-CG 4.43Å; V291-R332 HydrophobicContact CG2-CG 3.88Å; V308-R332 HydrophobicContact CG2-CG 4.46Å
333	G	66.7	Low	85.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-139	150.7	-169.6	0	0	0	0	0	112.9	V331 V336 W381	V331-G333 VanDerWaalsContact C-N 3.29Å; V331-G333 WeakPolarHBondContact CG2-O 3.49Å; V331-G333 PolarHBondContact O-N 2.89Å; G333-V336 WeakPolarHBondContact O-CB 3.36Å; G333-V336 WeakPolarHBondContact O-CG2 3.4Å; G333-V336 PolarHBondContact O-N 2.81Å; G333-W381 WeakPolarHBondContact O-CB 3.3Å
334	E	70.7	Confident	84.8	Confident	47 Å²	47	33.6 Å²	33.6	22%	0.22	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	141.9	169.7	-170	171.1	-171	0	0	110.1	T38 V336 W381	T38-E334 HydrophobicContact CG2-CB 3.94Å; E334-V336 PolarHBondContact O-N 3.18Å; E334-W381 HydrophobicContact CB-CD2 3.84Å; E334-W381 HydrophobicContact CB-CE3 3.86Å; E334-W381 HydrophobicContact CB-CH2 3.58Å; E334-W381 HydrophobicContact CB-CZ2 3.58Å; E334-W381 HydrophobicContact CB-CZ3 3.74Å; E334-W381 HydrophobicContact CG-CD2 4.31Å; E334-W381 HydrophobicContact CG-CE3 3.8Å; E334-W381 HydrophobicContact CG-CH2 3.49Å; E334-W381 VanDerWaalsContact CG-CH2 3.49Å; E334-W381 HydrophobicContact CG-CZ2 4.06Å; E334-W381 HydrophobicContact CG-CZ3 3.36Å; E334-W381 WeakPolarHBondContact OE2-CH2 3.37Å
335	N	68.2	Low	84.5	Confident	52 Å²	52	27.8 Å²	27.8	28%	0.278	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	0.5	-179.7	-56.1	-42.2	0	0	0	115.7	C337 G338 A339	N335-C337 PolarHBondContact O-N 3.39Å; N335-G338 PolarHBondContact O-N 2.88Å; N335-A339 VanDerWaalsContact CA-O 3.29Å; N335-A339 WeakPolarHBondContact CA-O 3.47Å; N335-A339 PolarHBondContact N-O 3.1Å
336	V	69.2	Low	84.2	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-63.5	120.8	172.3	-178.7	0	0	0	0	108.3	Y37 M41 Q289 V331 G333 E334 G338 A339	Y37-V336 HydrophobicContact CD1-CG2 4.23Å; Y37-V336 HydrophobicContact CE1-CG2 3.76Å; M41-V336 HydrophobicContact CE-CG2 4.12Å; M41-V336 HydrophobicContact CG-CG2 3.66Å; M41-V336 HydrophobicContact SD-CG2 4.12Å; Q289-V336 HydrophobicContact CB-CG1 3.43Å; Q289-V336 VanDerWaalsContact CB-CG1 3.43Å; Q289-V336 HydrophobicContact CG-CG1 3.73Å; V331-V336 HydrophobicContact CB-CB 3.77Å; V331-V336 HydrophobicContact CB-CG1 3.68Å; V331-V336 HydrophobicContact CG1-CB 4.18Å; V331-V336 HydrophobicContact CG1-CG1 3.68Å; V331-V336 HydrophobicContact CG2-CB 3.72Å; V331-V336 HydrophobicContact CG2-CG1 4.17Å; G333-V336 WeakPolarHBondContact O-CB 3.36Å; G333-V336 WeakPolarHBondContact O-CG2 3.4Å; G333-V336 PolarHBondContact O-N 2.81Å; E334-V336 PolarHBondContact O-N 3.18Å; V336-G338 PolarHBondContact O-N 3.33Å; V336-G338 VanDerWaalsContact O-N 3.08Å; V336-A339 WeakPolarHBondContact O-CB 3.34Å; V336-A339 PolarHBondContact O-N 3.19Å
337	C	75.4	Confident	83.9	Confident	8 Å²	8	24.3 Å²	24.3	5%	0.054	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	52.8	29.3	-177.8	-47.9	0	0	0	0	114.6	D233 C287 Q289 N335 W383	D233-C337 WeakPolarHBondContact O-CA 3.33Å; D233-C337 WeakPolarHBondContact O-CB 3.2Å; C287-C337 WeakPolarHBondContact CA-SG 3.34Å; C287-C337 HydrophobicContact CB-CB 3.67Å; C287-C337 WeakPolarHBondContact CB-SG 3.01Å; C287-C337 WeakPolarHBondContact SG-CB 3.2Å; C287-C337 CovalentContact SG-SG 2Å; C287-C337 PolarHBondContact SG-SG 3.19Å; Q289-C337 PolarHBondContact OE1-SG 2.94Å; Q289-C337 VanDerWaalsContact OE1-SG 3.37Å; N335-C337 PolarHBondContact O-N 3.39Å; C337-W383 HydrophobicContact CB-CZ2 4.09Å; C337-W383 PolarHBondContact O-NE1 2.81Å
338	G	77.9	Confident	83.5	Confident	28 Å²	28	26 Å²	26	29%	0.289	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	77.7	11.8	-177.5	0	0	0	0	0	115.5	N335 V336	N335-G338 PolarHBondContact O-N 2.88Å; V336-G338 PolarHBondContact O-N 3.33Å; V336-G338 VanDerWaalsContact O-N 3.08Å
339	A	81.5	Confident	83	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.			trans	-75.3	122.3	173.4	0	0	0	0	0	111	V331 N335 V336 W381 M382 W383	V331-A339 HydrophobicContact CG2-CB 3.32Å; N335-A339 VanDerWaalsContact CA-O 3.29Å; N335-A339 WeakPolarHBondContact CA-O 3.47Å; N335-A339 PolarHBondContact N-O 3.1Å; V336-A339 WeakPolarHBondContact O-CB 3.34Å; V336-A339 PolarHBondContact O-N 3.19Å; A339-W381 HydrophobicContact CB-CB 4.06Å; A339-M382 CarbonylContact C-O 3.59Å; A339-M382 WeakPolarHBondContact CA-O 3.45Å; A339-W383 HydrophobicContact CB-CD2 4.33Å; A339-W383 HydrophobicContact CB-CZ2 4.21Å
340	T	82.4	Confident	82.6	Confident	68 Å²	68	33.2 Å²	33.2	42%	0.417	18%	0.183	S	C	.	.			trans	-125.7	-6.4	-172.5	54.4	0	0	0	0	113.6	W381 M382	T340-W381 WeakPolarHBondContact O-CZ3 3.44Å; T340-M382 PolarHBondContact N-O 3.13Å; T340-M382 VanDerWaalsContact N-O 3.08Å
341	V	88.4	Confident	82.3	Confident	27 Å²	27	34.3 Å²	34.3	16%	0.164	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.4	-177.2	-174.4	0	0	0	0	109.7	Q357 W381 M382	V341-Q357 HydrophobicContact CG1-CB 4.05Å; V341-W381 WeakPolarHBondContact O-CA 3.42Å; V341-M382 HydrophobicContact CB-CE 4.22Å; V341-M382 HydrophobicContact CB-CG 3.91Å; V341-M382 HydrophobicContact CG1-CE 3.53Å; V341-M382 HydrophobicContact CG1-CG 4.25Å; V341-M382 PolarHBondContact N-O 3.4Å; V341-M382 PolarHBondContact O-N 3.21Å
342	A	84.3	Confident	82.6	Confident	2 Å²	2	34.3 Å²	34.3	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	139.3	173.8	0	0	0	0	0	111.4	Y344 Q357 A358 V378 W381	A342-Y344 HydrophobicContact CB-CE1 4.28Å; A342-Q357 CarbonylContact O-C 3.5Å; A342-Q357 WeakPolarHBondContact O-CA 3.25Å; A342-A358 PolarHBondContact O-N 3.42Å; A342-V378 HydrophobicContact CB-CG1 3.99Å; A342-V378 HydrophobicContact CB-CG2 4.1Å; A342-W381 HydrophobicContact CB-CD2 4.15Å; A342-W381 HydrophobicContact CB-CE3 3.93Å; A342-W381 HydrophobicContact CB-CH2 3.75Å; A342-W381 HydrophobicContact CB-CZ2 3.94Å; A342-W381 HydrophobicContact CB-CZ3 3.73Å
343	V	93.2	Very high	83.4	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.3	162.4	178	0	0	0	0	108.6	Q355 L356 V378 T379 F380 M382	V343-Q355 HydrophobicContact CG1-CB 3.9Å; V343-L356 CarbonylContact C-O 3.52Å; V343-L356 WeakPolarHBondContact CA-O 3.35Å; V343-V378 CarbonylContact O-C 3.46Å; V343-V378 WeakPolarHBondContact O-CA 3.49Å; V343-V378 WeakPolarHBondContact O-CG1 3.46Å; V343-T379 PolarHBondContact O-N 3.19Å; V343-F380 HydrophobicContact CB-CD2 4.25Å; V343-F380 HydrophobicContact CB-CE1 4.35Å; V343-F380 HydrophobicContact CB-CE2 3.97Å; V343-F380 HydrophobicContact CB-CZ 4.01Å; V343-F380 HydrophobicContact CG1-CE1 4.28Å; V343-F380 HydrophobicContact CG1-CZ 4.08Å; V343-F380 HydrophobicContact CG2-CD2 4.01Å; V343-F380 HydrophobicContact CG2-CE2 3.44Å; V343-F380 VanDerWaalsContact CG2-CE2 3.44Å; V343-F380 HydrophobicContact CG2-CZ 3.77Å; V343-F380 PolarHBondContact N-O 2.66Å; V343-M382 HydrophobicContact CG2-CE 3.6Å; V343-M382 HydrophobicContact CG2-CG 4.4Å; V343-M382 HydrophobicContact CG2-SD 3.8Å
344	Y	88	Confident	84.7	Confident	59 Å²	59	30.6 Å²	30.6	23%	0.231	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	146.9	176.3	-63.6	-62.5	0	0	0	111.5	A342 Q355 L356 A358 T362 W375 G377 V378	A342-Y344 HydrophobicContact CB-CE1 4.28Å; Y344-Q355 CarbonylContact O-C 3.54Å; Y344-Q355 WeakPolarHBondContact O-CA 3.34Å; Y344-L356 PolarHBondContact N-O 3.46Å; Y344-L356 PolarHBondContact O-N 3.09Å; Y344-A358 HydrophobicContact CD2-CB 4.34Å; Y344-A358 HydrophobicContact CE2-CB 3.57Å; Y344-T362 HydrophobicContact CD2-CG2 3.3Å; Y344-T362 HydrophobicContact CE2-CG2 3.78Å; Y344-T362 HydrophobicContact CG-CG2 4.15Å; Y344-W375 AromaticContact CD1-NE1 3.96Å; Y344-G377 CarbonylContact C-O 3.57Å; Y344-G377 WeakPolarHBondContact CA-O 3.24Å; Y344-V378 HydrophobicContact CD1-CB 4.5Å; Y344-V378 HydrophobicContact CD1-CG2 3.46Å; Y344-V378 VanDerWaalsContact CD1-CG2 3.46Å; Y344-V378 HydrophobicContact CE1-CG2 3.42Å; Y344-V378 VanDerWaalsContact CE1-CG2 3.42Å
345	E	89.8	Confident	85.9	Confident	19 Å²	19	28.5 Å²	28.5	9%	0.089	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.9	171.1	-173.7	179	162.2	0	0	111	Y305 H353 Q355 R376 G377 T379	Y305-E345 VanDerWaalsContact CE2-CD 3.41Å; Y305-E345 HydrophobicContact CE2-CG 4.34Å; Y305-E345 WeakPolarHBondContact CE2-OE1 3.42Å; Y305-E345 VanDerWaalsContact CE2-OE2 3.29Å; Y305-E345 WeakPolarHBondContact CE2-OE2 3.41Å; Y305-E345 PolarHBondContact OH-OE1 2.95Å; Y305-E345 PolarHBondContact OH-OE2 2.76Å; E345-H353 IonicContact OE1-CE1 3.12Å; E345-H353 IonicContact OE1-ND1 3.02Å; E345-H353 PolarHBondContact OE1-ND1 2.73Å; E345-Q355 HydrophobicContact CB-CG 4.34Å; E345-Q355 HydrophobicContact CG-CG 4.25Å; E345-R376 HydrophobicContact CB-CB 3.96Å; E345-R376 HydrophobicContact CG-CB 3.82Å; E345-R376 HydrophobicContact CG-CG 4.31Å; E345-R376 PolarHBondContact O-N 2.94Å; E345-G377 PolarHBondContact N-O 3.34Å; E345-T379 WeakPolarHBondContact CB-OG1 3.47Å
346	F	90	Very high	87.2	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.009	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.2	170.1	-59	-87.3	0	0	0	109.7	H353 L354 L356 T362 V365 F366 W373 D374 W375	F346-H353 WeakPolarHBondContact O-CA 3.24Å; F346-L354 HydrophobicContact CB-CB 4.2Å; F346-L354 PolarHBondContact N-O 2.72Å; F346-L354 PolarHBondContact O-N 2.72Å; F346-L356 HydrophobicContact CE2-CD1 4.33Å; F346-T362 HydrophobicContact CE2-CG2 4.02Å; F346-T362 HydrophobicContact CZ-CG2 3.8Å; F346-V365 HydrophobicContact CB-CG1 4.47Å; F346-V365 HydrophobicContact CD1-CG1 3.49Å; F346-V365 VanDerWaalsContact CD1-CG1 3.49Å; F346-V365 HydrophobicContact CD2-CG1 4.18Å; F346-V365 HydrophobicContact CE1-CB 4.26Å; F346-V365 HydrophobicContact CE1-CG1 3.58Å; F346-V365 HydrophobicContact CE2-CB 4.44Å; F346-V365 HydrophobicContact CE2-CG1 4.26Å; F346-V365 HydrophobicContact CG-CG1 3.8Å; F346-V365 HydrophobicContact CZ-CB 4.2Å; F346-V365 HydrophobicContact CZ-CG1 3.97Å; F346-F366 AromaticContact CE1-CD1 3.85Å; F346-F366 HydrophobicContact CE1-CD1 3.85Å; F346-F366 AromaticContact CE1-CE1 3.53Å; F346-F366 HydrophobicContact CE1-CE1 3.53Å; F346-F366 HydrophobicContact CE1-CE2 4.46Å; F346-F366 HydrophobicContact CE1-CG 4.43Å; F346-F366 AromaticContact CE1-CZ 3.86Å; F346-F366 HydrophobicContact CE1-CZ 3.86Å; F346-F366 HydrophobicContact CZ-CD1 4.25Å; F346-F366 HydrophobicContact CZ-CD2 4.34Å; F346-F366 AromaticContact CZ-CE1 3.84Å; F346-F366 HydrophobicContact CZ-CE1 3.84Å; F346-F366 AromaticContact CZ-CE2 3.95Å; F346-F366 HydrophobicContact CZ-CE2 3.95Å; F346-F366 HydrophobicContact CZ-CG 4.47Å; F346-F366 AromaticContact CZ-CZ 3.67Å; F346-F366 HydrophobicContact CZ-CZ 3.67Å; F346-W373 HydrophobicContact CB-CB 4.17Å; F346-W373 HydrophobicContact CB-CD2 4.32Å; F346-W373 HydrophobicContact CB-CE3 3.73Å; F346-W373 HydrophobicContact CD1-CB 4.28Å; F346-D374 CarbonylContact C-O 3.59Å; F346-D374 VanDerWaalsContact CA-O 3.23Å; F346-D374 WeakPolarHBondContact CA-O 3.28Å; F346-W375 HydrophobicContact CD1-CB 4.24Å; F346-W375 HydrophobicContact CE1-CB 4.22Å; F346-W375 AromaticContact CE1-CD1 3.82Å; F346-W375 HydrophobicContact CE1-CG 4.4Å
347	Y	90.7	Very high	88.3	Confident	29 Å²	29	28 Å²	28	11%	0.114	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137	178.1	-174.9	-92.7	0	0	0	111.6	R301 G352 H353 D374	R301-Y347 PolarHBondContact NH1-OH 2.9Å; Y347-G352 WeakPolarHBondContact CA-O 3.03Å; Y347-H353 AromaticContact CD2-CE1 3.91Å; Y347-H353 AromaticContact CD2-ND1 3.92Å; Y347-H353 AromaticContact CE2-NE2 3.97Å; Y347-D374 PolarHBondContact N-O 3.33Å; Y347-D374 WeakPolarHBondContact O-CB 3.25Å; Y347-D374 PolarHBondContact O-N 2.89Å
348	Q	89.6	Confident	88.5	Confident	46 Å²	46	29.8 Å²	29.8	22%	0.215	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.1	170.5	-172.4	-178	17.2	0	0	109	S350 V351 G352 W373	Q348-S350 PolarHBondContact O-N 3.35Å; Q348-V351 HydrophobicContact CB-CB 4.41Å; Q348-V351 PolarHBondContact O-N 3.13Å; Q348-G352 PolarHBondContact N-O 3.15Å; Q348-G352 PolarHBondContact O-N 3.04Å; Q348-W373 HydrophobicContact CB-CD2 3.86Å; Q348-W373 HydrophobicContact CB-CE3 3.64Å; Q348-W373 HydrophobicContact CB-CH2 4.13Å; Q348-W373 HydrophobicContact CB-CZ2 4.31Å; Q348-W373 HydrophobicContact CB-CZ3 3.78Å
349	T	87	Confident	88.8	Confident	104 Å²	104	30.1 Å²	30.1	64%	0.638	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-34.4	-174	-55.8	0	0	0	0	114.1
350	S	86.7	Confident	89.1	Confident	100 Å²	100	40.5 Å²	40.5	70%	0.699	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.4	-179.8	54.1	0	0	0	0	114.8	Q348	Q348-S350 PolarHBondContact O-N 3.35Å
351	V	87.9	Confident	89.4	Confident	24 Å²	24	39.5 Å²	39.5	15%	0.145	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-43.2	-173.7	-176.9	0	0	0	0	111.8	Q348 W373	Q348-V351 HydrophobicContact CB-CB 4.41Å; Q348-V351 PolarHBondContact O-N 3.13Å; V351-W373 HydrophobicContact CB-CH2 3.76Å; V351-W373 HydrophobicContact CB-CZ2 4.26Å; V351-W373 HydrophobicContact CG1-CH2 3.62Å; V351-W373 HydrophobicContact CG1-CZ2 4.22Å; V351-W373 HydrophobicContact CG2-CH2 4.3Å; V351-W373 HydrophobicContact CG2-CZ2 4.3Å
352	G	91	Very high	89.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.1	-141.6	-173.6	0	0	0	0	0	111.9	Y347 Q348	Y347-G352 WeakPolarHBondContact CA-O 3.03Å; Q348-G352 PolarHBondContact N-O 3.15Å; Q348-G352 PolarHBondContact O-N 3.04Å
353	H	93.3	Very high	89.3	Confident	19 Å²	19	41.2 Å²	41.2	9%	0.088	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	140.5	-176.5	-56.1	-98	0	0	0	110.7	T303 Y305 Y321 E345 F346 Y347	T303-H353 PolarHBondContact OG1-N 3.47Å; Y305-H353 AromaticContact CD1-CE1 3.6Å; Y305-H353 AromaticContact CD1-ND1 3.85Å; Y305-H353 AromaticContact CD1-NE2 3.78Å; Y305-H353 HydrophobicContact CD2-CB 3.97Å; Y305-H353 AromaticContact CD2-CG 3.77Å; Y305-H353 AromaticContact CD2-ND1 3.69Å; Y305-H353 AromaticContact CE1-CE1 3.52Å; Y305-H353 AromaticContact CE1-ND1 3.8Å; Y305-H353 AromaticContact CE2-ND1 3.67Å; Y305-H353 HydrophobicContact CG-CB 4.28Å; Y305-H353 AromaticContact CG-CD2 3.92Å; Y305-H353 AromaticContact CG-CE1 3.99Å; Y305-H353 AromaticContact CG-CG 3.76Å; Y305-H353 AromaticContact CG-ND1 3.81Å; Y305-H353 AromaticContact CZ-CE1 3.88Å; Y305-H353 AromaticContact CZ-ND1 3.73Å; Y321-H353 AromaticContact CZ-NE2 3.83Å; Y321-H353 PolarHBondContact OH-NE2 2.79Å; E345-H353 IonicContact OE1-CE1 3.12Å; E345-H353 IonicContact OE1-ND1 3.02Å; E345-H353 PolarHBondContact OE1-ND1 2.73Å; F346-H353 WeakPolarHBondContact O-CA 3.24Å; Y347-H353 AromaticContact CD2-CE1 3.91Å; Y347-H353 AromaticContact CD2-ND1 3.92Å; Y347-H353 AromaticContact CE2-NE2 3.97Å
354	L	94.1	Very high	89.2	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.047	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.1	171.9	172	64.1	0	0	0	108	W245 N252 F346 L356 V365 W373	W245-L354 HydrophobicContact CZ3-CD1 4.34Å; N252-L354 HydrophobicContact CB-CD1 3.88Å; F346-L354 HydrophobicContact CB-CB 4.2Å; F346-L354 PolarHBondContact N-O 2.72Å; F346-L354 PolarHBondContact O-N 2.72Å; L354-L356 HydrophobicContact CD1-CD1 4.43Å; L354-L356 HydrophobicContact CD1-CD2 3.91Å; L354-L356 HydrophobicContact CD1-CG 4.05Å; L354-L356 HydrophobicContact CD2-CD1 4.09Å; L354-L356 HydrophobicContact CD2-CG 4.48Å; L354-L356 HydrophobicContact CG-CD1 4.15Å; L354-L356 HydrophobicContact CG-CD2 4.42Å; L354-L356 HydrophobicContact CG-CG 4Å; L354-V365 HydrophobicContact CD2-CG2 3.92Å; L354-W373 HydrophobicContact CB-CE3 3.92Å; L354-W373 HydrophobicContact CB-CH2 3.62Å; L354-W373 HydrophobicContact CB-CZ2 4.47Å; L354-W373 HydrophobicContact CB-CZ3 3.31Å; L354-W373 HydrophobicContact CD2-CD2 4.16Å; L354-W373 HydrophobicContact CD2-CE3 4.16Å; L354-W373 HydrophobicContact CD2-CH2 3.91Å; L354-W373 HydrophobicContact CD2-CZ2 3.92Å; L354-W373 HydrophobicContact CD2-CZ3 4.05Å; L354-W373 HydrophobicContact CG-CH2 4.36Å; L354-W373 HydrophobicContact CG-CZ3 4.32Å
355	Q	95.2	Very high	89.3	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.009	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122	-179.2	-70	174	-74.7	0	0	110.5	N252 L254 Y306 V343 Y344 E345 T379	N252-Q355 PolarHBondContact ND2-O 3.01Å; L254-Q355 HydrophobicContact CD1-CB 4.18Å; Y306-Q355 VanDerWaalsContact CD2-OE1 3.27Å; Y306-Q355 PolarHBondContact O-NE2 2.89Å; V343-Q355 HydrophobicContact CG1-CB 3.9Å; Y344-Q355 CarbonylContact O-C 3.54Å; Y344-Q355 WeakPolarHBondContact O-CA 3.34Å; E345-Q355 HydrophobicContact CB-CG 4.34Å; E345-Q355 HydrophobicContact CG-CG 4.25Å; Q355-T379 PolarHBondContact NE2-OG1 3.21Å
356	L	94.9	Very high	88.9	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.5	-171.3	-62.7	178.7	0	0	0	111.2	R243 V343 Y344 F346 L354 D361 T362 V365	R243-L356 VanDerWaalsContact NE-CD2 3.28Å; R243-L356 VanDerWaalsContact NH2-CD2 3.31Å; V343-L356 CarbonylContact C-O 3.52Å; V343-L356 WeakPolarHBondContact CA-O 3.35Å; Y344-L356 PolarHBondContact N-O 3.46Å; Y344-L356 PolarHBondContact O-N 3.09Å; F346-L356 HydrophobicContact CE2-CD1 4.33Å; L354-L356 HydrophobicContact CD1-CD1 4.43Å; L354-L356 HydrophobicContact CD1-CD2 3.91Å; L354-L356 HydrophobicContact CD1-CG 4.05Å; L354-L356 HydrophobicContact CD2-CD1 4.09Å; L354-L356 HydrophobicContact CD2-CG 4.48Å; L354-L356 HydrophobicContact CG-CD1 4.15Å; L354-L356 HydrophobicContact CG-CD2 4.42Å; L354-L356 HydrophobicContact CG-CG 4Å; L356-D361 HydrophobicContact CD1-CB 4.28Å; L356-T362 WeakPolarHBondContact CB-OG1 3.49Å; L356-V365 HydrophobicContact CD1-CG2 3.7Å
357	Q	93.7	Very high	88.8	Confident	39 Å²	39	50.3 Å²	50.3	18%	0.182	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	150.8	168.2	78	-76.9	18.5	0	0	111	I276 V341 A342 G359 T362 M382	I276-Q357 HydrophobicContact CB-CB 4.08Å; I276-Q357 VanDerWaalsContact CB-CD 3.41Å; I276-Q357 HydrophobicContact CB-CG 3.9Å; I276-Q357 HydrophobicContact CD1-CB 4.47Å; I276-Q357 VanDerWaalsContact CG2-CD 3.42Å; I276-Q357 HydrophobicContact CG2-CG 4.43Å; I276-Q357 VanDerWaalsContact CG2-NE2 3.32Å; I276-Q357 VanDerWaalsContact CG2-OE1 3.25Å; V341-Q357 HydrophobicContact CG1-CB 4.05Å; A342-Q357 CarbonylContact O-C 3.5Å; A342-Q357 WeakPolarHBondContact O-CA 3.25Å; Q357-G359 PolarHBondContact O-N 3.41Å; Q357-G359 VanDerWaalsContact O-N 3.16Å; Q357-T362 PolarHBondContact O-OG1 3.26Å; Q357-M382 HydrophobicContact CB-CE 3.64Å
358	A	79.7	Confident	88.5	Confident	47 Å²	47	50.9 Å²	50.9	39%	0.388	29%	0.287	S	S	.	.	S	Bend	trans	-52.8	122.6	167.9	0	0	0	0	0	110.6	A342 Y344	A342-A358 PolarHBondContact O-N 3.42Å; Y344-A358 HydrophobicContact CD2-CB 4.34Å; Y344-A358 HydrophobicContact CE2-CB 3.57Å
359	G	83.4	Confident	88.4	Confident	34 Å²	34	56.8 Å²	56.8	35%	0.351	31%	0.307	S	S	.	.	S	Bend	trans	165.5	-165.7	-174.4	0	0	0	0	0	114.2	Q357 T362 T363	Q357-G359 PolarHBondContact O-N 3.41Å; Q357-G359 VanDerWaalsContact O-N 3.16Å; G359-T362 PolarHBondContact O-N 3.12Å; G359-T363 PolarHBondContact O-N 3.02Å; G359-T363 PolarHBondContact O-OG1 3.14Å
360	W	87.1	Confident	88.5	Confident	218 Å²	218	57 Å²	57	83%	0.826	30%	0.297	S	S	*	.	H	α-helix	trans	-61.7	-45.5	-176.5	-62.4	101.4	0	0	0	113.1	T362 T363 D364	W360-T362 VanDerWaalsContact C-N 3.32Å; W360-T362 PolarHBondContact O-N 3.43Å; W360-T363 CarbonylContact O-C 3.5Å; W360-T363 WeakPolarHBondContact O-CA 2.99Å; W360-T363 VanDerWaalsContact O-CB 3.31Å; W360-T363 WeakPolarHBondContact O-CB 3.1Å; W360-T363 PolarHBondContact O-N 2.7Å; W360-D364 PolarHBondContact O-N 3.33Å
361	D	89.7	Confident	88.5	Confident	48 Å²	48	54 Å²	54	26%	0.257	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-41.9	178.5	-75.6	25.4	0	0	0	111.9	R243 L356 T363 D364 V365	R243-D361 IonicContact CZ-OD2 2.87Å; R243-D361 IonicContact NH1-OD2 2.95Å; R243-D361 PolarHBondContact NH1-OD2 3.04Å; R243-D361 IonicContact NH2-OD2 3.66Å; L356-D361 HydrophobicContact CD1-CB 4.28Å; D361-T363 VanDerWaalsContact C-N 3.34Å; D361-D364 WeakPolarHBondContact O-CB 3.28Å; D361-D364 PolarHBondContact O-N 3.43Å; D361-V365 WeakPolarHBondContact O-CG2 3.44Å; D361-V365 PolarHBondContact O-N 2.99Å; D361-V365 VanDerWaalsContact O-N 3.09Å
362	T	86.8	Confident	88.5	Confident	3 Å²	3	57 Å²	57	2%	0.018	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-42.1	173.6	-65.7	0	0	0	0	111.1	Y344 F346 L356 Q357 G359 W360 D364 V365 F366	Y344-T362 HydrophobicContact CD2-CG2 3.3Å; Y344-T362 HydrophobicContact CE2-CG2 3.78Å; Y344-T362 HydrophobicContact CG-CG2 4.15Å; F346-T362 HydrophobicContact CE2-CG2 4.02Å; F346-T362 HydrophobicContact CZ-CG2 3.8Å; L356-T362 WeakPolarHBondContact CB-OG1 3.49Å; Q357-T362 PolarHBondContact O-OG1 3.26Å; G359-T362 PolarHBondContact O-N 3.12Å; W360-T362 VanDerWaalsContact C-N 3.32Å; W360-T362 PolarHBondContact O-N 3.43Å; T362-D364 VanDerWaalsContact C-N 3.28Å; T362-D364 PolarHBondContact O-N 3.4Å; T362-V365 PolarHBondContact O-N 3.09Å; T362-F366 HydrophobicContact CG2-CD2 3.73Å; T362-F366 HydrophobicContact CG2-CE2 3.35Å; T362-F366 HydrophobicContact CG2-CZ 4.26Å; T362-F366 VanDerWaalsContact O-CD2 3.26Å; T362-F366 WeakPolarHBondContact O-CD2 3.5Å; T362-F366 PolarHBondContact O-N 3.39Å
363	T	84.2	Confident	88.4	Confident	62 Å²	62	58.7 Å²	58.7	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-39.6	176.9	-56.6	0	0	0	0	111.2	G359 W360 D361 F366 N367	G359-T363 PolarHBondContact O-N 3.02Å; G359-T363 PolarHBondContact O-OG1 3.14Å; W360-T363 CarbonylContact O-C 3.5Å; W360-T363 WeakPolarHBondContact O-CA 2.99Å; W360-T363 VanDerWaalsContact O-CB 3.31Å; W360-T363 WeakPolarHBondContact O-CB 3.1Å; W360-T363 PolarHBondContact O-N 2.7Å; D361-T363 VanDerWaalsContact C-N 3.34Å; T363-F366 PolarHBondContact O-N 3.35Å; T363-N367 WeakPolarHBondContact O-CB 3.3Å; T363-N367 PolarHBondContact O-N 2.73Å; T363-N367 PolarHBondContact O-ND2 3.34Å
364	D	90.9	Very high	88.1	Confident	32 Å²	32	61.6 Å²	61.6	17%	0.171	33%	0.332	C	S	.	.	H	α-helix	trans	-65.3	-38.9	175.8	-81.5	-16.6	0	0	0	112.8	W360 D361 T362 N367 G368 R369 Y370	W360-D364 PolarHBondContact O-N 3.33Å; D361-D364 WeakPolarHBondContact O-CB 3.28Å; D361-D364 PolarHBondContact O-N 3.43Å; T362-D364 VanDerWaalsContact C-N 3.28Å; T362-D364 PolarHBondContact O-N 3.4Å; D364-N367 PolarHBondContact O-N 2.68Å; D364-G368 PolarHBondContact O-N 3.25Å; D364-R369 HydrophobicContact CB-CB 3.97Å; D364-R369 HydrophobicContact CB-CG 4.47Å; D364-R369 WeakPolarHBondContact O-CB 3.49Å; D364-R369 PolarHBondContact O-N 2.92Å; D364-R369 IonicContact OD1-NH1 3.7Å; D364-R369 VanDerWaalsContact OD2-CD 3.31Å; D364-R369 WeakPolarHBondContact OD2-CD 3.47Å; D364-R369 IonicContact OD2-CZ 2.73Å; D364-R369 IonicContact OD2-NE 2.74Å; D364-R369 IonicContact OD2-NH1 2.78Å; D364-R369 PolarHBondContact OD2-NH1 2.98Å; D364-Y370 HydrophobicContact CB-CD2 4.24Å; D364-Y370 HydrophobicContact CB-CE2 3.52Å
365	V	89.4	Confident	87.6	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-47.9	172.3	178	0	0	0	0	110.5	F346 L354 L356 D361 T362 N367 G368 Y370 W373	F346-V365 HydrophobicContact CB-CG1 4.47Å; F346-V365 HydrophobicContact CD1-CG1 3.49Å; F346-V365 VanDerWaalsContact CD1-CG1 3.49Å; F346-V365 HydrophobicContact CD2-CG1 4.18Å; F346-V365 HydrophobicContact CE1-CB 4.26Å; F346-V365 HydrophobicContact CE1-CG1 3.58Å; F346-V365 HydrophobicContact CE2-CB 4.44Å; F346-V365 HydrophobicContact CE2-CG1 4.26Å; F346-V365 HydrophobicContact CG-CG1 3.8Å; F346-V365 HydrophobicContact CZ-CB 4.2Å; F346-V365 HydrophobicContact CZ-CG1 3.97Å; L354-V365 HydrophobicContact CD2-CG2 3.92Å; L356-V365 HydrophobicContact CD1-CG2 3.7Å; D361-V365 WeakPolarHBondContact O-CG2 3.44Å; D361-V365 PolarHBondContact O-N 2.99Å; D361-V365 VanDerWaalsContact O-N 3.09Å; T362-V365 PolarHBondContact O-N 3.09Å; V365-N367 VanDerWaalsContact C-N 3.25Å; V365-N367 PolarHBondContact O-N 2.78Å; V365-G368 PolarHBondContact O-N 3.45Å; V365-Y370 HydrophobicContact CG2-CD2 3.78Å; V365-Y370 HydrophobicContact CG2-CE2 4.37Å; V365-W373 HydrophobicContact CG1-CB 3.73Å; V365-W373 HydrophobicContact CG1-CG 3.85Å
366	F	82	Confident	87	Confident	109 Å²	109	74.1 Å²	74.1	48%	0.478	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-35	177.4	-76.4	-53.1	0	0	0	113	F346 T362 T363 G368 W375	F346-F366 AromaticContact CE1-CD1 3.85Å; F346-F366 HydrophobicContact CE1-CD1 3.85Å; F346-F366 AromaticContact CE1-CE1 3.53Å; F346-F366 HydrophobicContact CE1-CE1 3.53Å; F346-F366 HydrophobicContact CE1-CE2 4.46Å; F346-F366 HydrophobicContact CE1-CG 4.43Å; F346-F366 AromaticContact CE1-CZ 3.86Å; F346-F366 HydrophobicContact CE1-CZ 3.86Å; F346-F366 HydrophobicContact CZ-CD1 4.25Å; F346-F366 HydrophobicContact CZ-CD2 4.34Å; F346-F366 AromaticContact CZ-CE1 3.84Å; F346-F366 HydrophobicContact CZ-CE1 3.84Å; F346-F366 AromaticContact CZ-CE2 3.95Å; F346-F366 HydrophobicContact CZ-CE2 3.95Å; F346-F366 HydrophobicContact CZ-CG 4.47Å; F346-F366 AromaticContact CZ-CZ 3.67Å; F346-F366 HydrophobicContact CZ-CZ 3.67Å; T362-F366 HydrophobicContact CG2-CD2 3.73Å; T362-F366 HydrophobicContact CG2-CE2 3.35Å; T362-F366 HydrophobicContact CG2-CZ 4.26Å; T362-F366 VanDerWaalsContact O-CD2 3.26Å; T362-F366 WeakPolarHBondContact O-CD2 3.5Å; T362-F366 PolarHBondContact O-N 3.39Å; T363-F366 PolarHBondContact O-N 3.35Å; F366-G368 PolarHBondContact O-N 3.39Å; F366-W375 HydrophobicContact CE1-CB 4.14Å; F366-W375 AromaticContact CE1-CD1 3.66Å; F366-W375 HydrophobicContact CE1-CD2 4.49Å; F366-W375 AromaticContact CE1-CG 3.84Å; F366-W375 HydrophobicContact CE1-CG 3.84Å; F366-W375 AromaticContact CZ-CD1 3.74Å; F366-W375 HydrophobicContact CZ-CG 4.32Å; F366-W375 AromaticContact CZ-NE1 3.88Å
367	N	86.9	Confident	86.2	Confident	122 Å²	122	74.5 Å²	74.5	65%	0.652	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	2.3	176.4	-68.9	-25.9	0	0	0	113.5	T363 D364 V365 R369	T363-N367 WeakPolarHBondContact O-CB 3.3Å; T363-N367 PolarHBondContact O-N 2.73Å; T363-N367 PolarHBondContact O-ND2 3.34Å; D364-N367 PolarHBondContact O-N 2.68Å; V365-N367 VanDerWaalsContact C-N 3.25Å; V365-N367 PolarHBondContact O-N 2.78Å; N367-R369 VanDerWaalsContact C-N 3.31Å; N367-R369 PolarHBondContact O-N 3.28Å
368	G	85.4	Confident	85.5	Confident	41 Å²	41	74.3 Å²	74.3	42%	0.423	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	15.1	177.5	0	0	0	0	0	114.6	D364 V365 F366 Y370 G371	D364-G368 PolarHBondContact O-N 3.25Å; V365-G368 PolarHBondContact O-N 3.45Å; F366-G368 PolarHBondContact O-N 3.39Å; G368-Y370 PolarHBondContact O-N 3.45Å; G368-Y370 VanDerWaalsContact O-N 3.17Å; G368-G371 PolarHBondContact O-N 3Å; G368-G371 VanDerWaalsContact O-N 3.14Å
369	R	88.1	Confident	85.9	Confident	170 Å²	170	73.2 Å²	73.2	64%	0.642	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.5	-179	-172.4	179.9	-179.3	172.4	0.9	112.5	D364 N367	D364-R369 HydrophobicContact CB-CB 3.97Å; D364-R369 HydrophobicContact CB-CG 4.47Å; D364-R369 WeakPolarHBondContact O-CB 3.49Å; D364-R369 PolarHBondContact O-N 2.92Å; D364-R369 IonicContact OD1-NH1 3.7Å; D364-R369 VanDerWaalsContact OD2-CD 3.31Å; D364-R369 WeakPolarHBondContact OD2-CD 3.47Å; D364-R369 IonicContact OD2-CZ 2.73Å; D364-R369 IonicContact OD2-NE 2.74Å; D364-R369 IonicContact OD2-NH1 2.78Å; D364-R369 PolarHBondContact OD2-NH1 2.98Å; N367-R369 VanDerWaalsContact C-N 3.31Å; N367-R369 PolarHBondContact O-N 3.28Å
370	Y	87.3	Confident	86.1	Confident	109 Å²	109	71.6 Å²	71.6	43%	0.427	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	23.4	-177.9	-53.2	-61.5	0	0	0	113.1	D364 V365 G368 W373	D364-Y370 HydrophobicContact CB-CD2 4.24Å; D364-Y370 HydrophobicContact CB-CE2 3.52Å; V365-Y370 HydrophobicContact CG2-CD2 3.78Å; V365-Y370 HydrophobicContact CG2-CE2 4.37Å; G368-Y370 PolarHBondContact O-N 3.45Å; G368-Y370 VanDerWaalsContact O-N 3.17Å; Y370-W373 PolarHBondContact O-NE1 2.83Å
371	G	87.6	Confident	86.1	Confident	36 Å²	36	62.2 Å²	62.2	37%	0.371	32%	0.32	S	S	.	.	S	Bend	trans	88.9	-171.5	-176.1	0	0	0	0	0	113.3	G368 W373	G368-G371 PolarHBondContact O-N 3Å; G368-G371 VanDerWaalsContact O-N 3.14Å; G371-W373 PolarHBondContact O-N 2.82Å
372	A	87.8	Confident	86.2	Confident	87 Å²	87	59.9 Å²	59.9	72%	0.719	31%	0.308	S	S	*	.			trans	-83.1	108.8	-177.9	0	0	0	0	0	110.8
373	W	89.9	Confident	86.5	Confident	37 Å²	37	60 Å²	60	14%	0.14	31%	0.308	C	S	.	.			trans	-110.1	133.6	173.9	-73.4	82.4	0	0	0	110.2	F346 Q348 V351 L354 V365 Y370 G371 W375	F346-W373 HydrophobicContact CB-CB 4.17Å; F346-W373 HydrophobicContact CB-CD2 4.32Å; F346-W373 HydrophobicContact CB-CE3 3.73Å; F346-W373 HydrophobicContact CD1-CB 4.28Å; Q348-W373 HydrophobicContact CB-CD2 3.86Å; Q348-W373 HydrophobicContact CB-CE3 3.64Å; Q348-W373 HydrophobicContact CB-CH2 4.13Å; Q348-W373 HydrophobicContact CB-CZ2 4.31Å; Q348-W373 HydrophobicContact CB-CZ3 3.78Å; V351-W373 HydrophobicContact CB-CH2 3.76Å; V351-W373 HydrophobicContact CB-CZ2 4.26Å; V351-W373 HydrophobicContact CG1-CH2 3.62Å; V351-W373 HydrophobicContact CG1-CZ2 4.22Å; V351-W373 HydrophobicContact CG2-CH2 4.3Å; V351-W373 HydrophobicContact CG2-CZ2 4.3Å; L354-W373 HydrophobicContact CB-CE3 3.92Å; L354-W373 HydrophobicContact CB-CH2 3.62Å; L354-W373 HydrophobicContact CB-CZ2 4.47Å; L354-W373 HydrophobicContact CB-CZ3 3.31Å; L354-W373 HydrophobicContact CD2-CD2 4.16Å; L354-W373 HydrophobicContact CD2-CE3 4.16Å; L354-W373 HydrophobicContact CD2-CH2 3.91Å; L354-W373 HydrophobicContact CD2-CZ2 3.92Å; L354-W373 HydrophobicContact CD2-CZ3 4.05Å; L354-W373 HydrophobicContact CG-CH2 4.36Å; L354-W373 HydrophobicContact CG-CZ3 4.32Å; V365-W373 HydrophobicContact CG1-CB 3.73Å; V365-W373 HydrophobicContact CG1-CG 3.85Å; Y370-W373 PolarHBondContact O-NE1 2.83Å; G371-W373 PolarHBondContact O-N 2.82Å; W373-W375 PolarHBondContact O-N 2.99Å
374	D	86.3	Confident	86.8	Confident	80 Å²	80	59 Å²	59	43%	0.428	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	118.1	170.8	-63.5	-25.4	0	0	0	108.8	F346 Y347 R376	F346-D374 CarbonylContact C-O 3.59Å; F346-D374 VanDerWaalsContact CA-O 3.23Å; F346-D374 WeakPolarHBondContact CA-O 3.28Å; Y347-D374 PolarHBondContact N-O 3.33Å; Y347-D374 WeakPolarHBondContact O-CB 3.25Å; Y347-D374 PolarHBondContact O-N 2.89Å; D374-R376 PolarHBondContact O-N 3.08Å; D374-R376 IonicContact OD2-CZ 2.95Å; D374-R376 IonicContact OD2-NH2 3.12Å; D374-R376 PolarHBondContact OD2-NH2 3.17Å
375	W	83.8	Confident	86.6	Confident	136 Å²	136	60.4 Å²	60.4	52%	0.515	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	127.4	168.7	177	64.4	0	0	0	110.6	Y344 F346 F366 W373 G377	Y344-W375 AromaticContact CD1-NE1 3.96Å; F346-W375 HydrophobicContact CD1-CB 4.24Å; F346-W375 HydrophobicContact CE1-CB 4.22Å; F346-W375 AromaticContact CE1-CD1 3.82Å; F346-W375 HydrophobicContact CE1-CG 4.4Å; F366-W375 HydrophobicContact CE1-CB 4.14Å; F366-W375 AromaticContact CE1-CD1 3.66Å; F366-W375 HydrophobicContact CE1-CD2 4.49Å; F366-W375 AromaticContact CE1-CG 3.84Å; F366-W375 HydrophobicContact CE1-CG 3.84Å; F366-W375 AromaticContact CZ-CD1 3.74Å; F366-W375 HydrophobicContact CZ-CG 4.32Å; F366-W375 AromaticContact CZ-NE1 3.88Å; W373-W375 PolarHBondContact O-N 2.99Å; W375-G377 PolarHBondContact NE1-O 3.31Å
376	R	81.4	Confident	85.5	Confident	138 Å²	138	66.9 Å²	66.9	52%	0.521	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-1.4	-177.1	-61.8	-65	176.6	148.4	-6.5	113.7	E345 D374	E345-R376 HydrophobicContact CB-CB 3.96Å; E345-R376 HydrophobicContact CG-CB 3.82Å; E345-R376 HydrophobicContact CG-CG 4.31Å; E345-R376 PolarHBondContact O-N 2.94Å; D374-R376 PolarHBondContact O-N 3.08Å; D374-R376 IonicContact OD2-CZ 2.95Å; D374-R376 IonicContact OD2-NH2 3.12Å; D374-R376 PolarHBondContact OD2-NH2 3.17Å
377	G	78.4	Confident	85.6	Confident	9 Å²	9	64.8 Å²	64.8	9%	0.093	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	110.7	-149.4	177.7	0	0	0	0	0	112.6	Y344 E345 W375	Y344-G377 CarbonylContact C-O 3.57Å; Y344-G377 WeakPolarHBondContact CA-O 3.24Å; E345-G377 PolarHBondContact N-O 3.34Å; W375-G377 PolarHBondContact NE1-O 3.31Å
378	V	80	Confident	85.6	Confident	36 Å²	36	61.7 Å²	61.7	22%	0.218	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.1	175.8	172.1	0	0	0	0	107.3	L34 A342 V343 Y344	L34-V378 HydrophobicContact CD2-CB 3.27Å; L34-V378 HydrophobicContact CD2-CG1 3.46Å; L34-V378 VanDerWaalsContact CD2-CG1 3.46Å; L34-V378 HydrophobicContact CD2-CG2 3.77Å; A342-V378 HydrophobicContact CB-CG1 3.99Å; A342-V378 HydrophobicContact CB-CG2 4.1Å; V343-V378 CarbonylContact O-C 3.46Å; V343-V378 WeakPolarHBondContact O-CA 3.49Å; V343-V378 WeakPolarHBondContact O-CG1 3.46Å; Y344-V378 HydrophobicContact CD1-CB 4.5Å; Y344-V378 HydrophobicContact CD1-CG2 3.46Å; Y344-V378 VanDerWaalsContact CD1-CG2 3.46Å; Y344-V378 HydrophobicContact CE1-CG2 3.42Å; Y344-V378 VanDerWaalsContact CE1-CG2 3.42Å
379	T	87.2	Confident	85.6	Confident	23 Å²	23	62.9 Å²	62.9	14%	0.141	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-48	179.5	-47.3	0	0	0	0	111.5	Y306 V308 V343 E345 Q355	Y306-T379 WeakPolarHBondContact O-CG2 3.31Å; V308-T379 VanDerWaalsContact CG2-O 3.28Å; V308-T379 WeakPolarHBondContact CG2-O 3.47Å; V343-T379 PolarHBondContact O-N 3.19Å; E345-T379 WeakPolarHBondContact CB-OG1 3.47Å; Q355-T379 PolarHBondContact NE2-OG1 3.21Å
380	F	88.4	Confident	85.4	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	169.8	179.9	57.1	-96.9	0	0	0	111	L241 I293 V308 A330 V343 M382	L241-F380 HydrophobicContact CD2-CE2 4.48Å; L241-F380 HydrophobicContact CD2-CZ 4.45Å; I293-F380 HydrophobicContact CD1-CD2 4.35Å; I293-F380 HydrophobicContact CD1-CE2 3.96Å; I293-F380 HydrophobicContact CD1-CZ 4.1Å; I293-F380 HydrophobicContact CG2-CD1 4.43Å; I293-F380 HydrophobicContact CG2-CE1 3.87Å; I293-F380 HydrophobicContact CG2-CZ 4.16Å; V308-F380 HydrophobicContact CB-CB 4.5Å; V308-F380 HydrophobicContact CG1-CB 3.78Å; V308-F380 HydrophobicContact CG1-CD1 3.93Å; V308-F380 HydrophobicContact CG1-CG 4.06Å; V308-F380 HydrophobicContact CG2-CB 3.9Å; A330-F380 HydrophobicContact CB-CB 3.99Å; A330-F380 HydrophobicContact CB-CD2 3.6Å; A330-F380 HydrophobicContact CB-CE2 4.34Å; A330-F380 HydrophobicContact CB-CG 3.97Å; V343-F380 HydrophobicContact CB-CD2 4.25Å; V343-F380 HydrophobicContact CB-CE1 4.35Å; V343-F380 HydrophobicContact CB-CE2 3.97Å; V343-F380 HydrophobicContact CB-CZ 4.01Å; V343-F380 HydrophobicContact CG1-CE1 4.28Å; V343-F380 HydrophobicContact CG1-CZ 4.08Å; V343-F380 HydrophobicContact CG2-CD2 4.01Å; V343-F380 HydrophobicContact CG2-CE2 3.44Å; V343-F380 VanDerWaalsContact CG2-CE2 3.44Å; V343-F380 HydrophobicContact CG2-CZ 3.77Å; V343-F380 PolarHBondContact N-O 2.66Å; F380-M382 HydrophobicContact CE2-CB 4.45Å; F380-M382 HydrophobicContact CE2-SD 4.43Å
381	W	85.9	Confident	85.3	Confident	20 Å²	20	53.3 Å²	53.3	8%	0.076	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143	174.2	-64.3	78.2	0	0	0	110.7	L34 A330 V331 G333 E334 A339 T340 V341 A342	L34-W381 HydrophobicContact CD2-CZ2 4.12Å; A330-W381 WeakPolarHBondContact CB-O 3.48Å; V331-W381 HydrophobicContact CG2-CB 3.92Å; V331-W381 PolarHBondContact N-O 3.02Å; V331-W381 VanDerWaalsContact N-O 3.17Å; V331-W381 PolarHBondContact O-N 2.03Å; G333-W381 WeakPolarHBondContact O-CB 3.3Å; E334-W381 HydrophobicContact CB-CD2 3.84Å; E334-W381 HydrophobicContact CB-CE3 3.86Å; E334-W381 HydrophobicContact CB-CH2 3.58Å; E334-W381 HydrophobicContact CB-CZ2 3.58Å; E334-W381 HydrophobicContact CB-CZ3 3.74Å; E334-W381 HydrophobicContact CG-CD2 4.31Å; E334-W381 HydrophobicContact CG-CE3 3.8Å; E334-W381 HydrophobicContact CG-CH2 3.49Å; E334-W381 VanDerWaalsContact CG-CH2 3.49Å; E334-W381 HydrophobicContact CG-CZ2 4.06Å; E334-W381 HydrophobicContact CG-CZ3 3.36Å; E334-W381 WeakPolarHBondContact OE2-CH2 3.37Å; A339-W381 HydrophobicContact CB-CB 4.06Å; T340-W381 WeakPolarHBondContact O-CZ3 3.44Å; V341-W381 WeakPolarHBondContact O-CA 3.42Å; A342-W381 HydrophobicContact CB-CD2 4.15Å; A342-W381 HydrophobicContact CB-CE3 3.93Å; A342-W381 HydrophobicContact CB-CH2 3.75Å; A342-W381 HydrophobicContact CB-CZ2 3.94Å; A342-W381 HydrophobicContact CB-CZ3 3.73Å
382	M	93.4	Very high	85.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	173.6	-177.2	71.7	-179.8	169.9	0	0	110.4	L241 I276 R278 V279 A339 T340 V341 V343 Q357 F380	L241-M382 HydrophobicContact CD2-SD 3.79Å; I276-M382 HydrophobicContact CB-CE 4.34Å; I276-M382 HydrophobicContact CD1-CE 4.09Å; I276-M382 HydrophobicContact CG1-CE 3.98Å; I276-M382 WeakPolarHBondContact O-CE 3.43Å; R278-M382 WeakPolarHBondContact O-CB 3Å; V279-M382 HydrophobicContact CG1-CB 4.23Å; A339-M382 CarbonylContact C-O 3.59Å; A339-M382 WeakPolarHBondContact CA-O 3.45Å; T340-M382 PolarHBondContact N-O 3.13Å; T340-M382 VanDerWaalsContact N-O 3.08Å; V341-M382 HydrophobicContact CB-CE 4.22Å; V341-M382 HydrophobicContact CB-CG 3.91Å; V341-M382 HydrophobicContact CG1-CE 3.53Å; V341-M382 HydrophobicContact CG1-CG 4.25Å; V341-M382 PolarHBondContact N-O 3.4Å; V341-M382 PolarHBondContact O-N 3.21Å; V343-M382 HydrophobicContact CG2-CE 3.6Å; V343-M382 HydrophobicContact CG2-CG 4.4Å; V343-M382 HydrophobicContact CG2-SD 3.8Å; Q357-M382 HydrophobicContact CB-CE 3.64Å; F380-M382 HydrophobicContact CE2-CB 4.45Å; F380-M382 HydrophobicContact CE2-SD 4.43Å
383	W	92.7	Very high	85	Confident	6 Å²	6	52.1 Å²	52.1	2%	0.023	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-86.7	151.4	-178.5	-62.6	-92.2	0	0	0	111	A235 L238 G277 R278 A280 L290 V331 C337 A339	A235-W383 HydrophobicContact CB-CH2 3.7Å; A235-W383 HydrophobicContact CB-CZ2 3.32Å; A235-W383 HydrophobicContact CB-CZ3 4.4Å; L238-W383 HydrophobicContact CD1-CB 3.85Å; L238-W383 HydrophobicContact CD1-CD2 4.04Å; L238-W383 HydrophobicContact CD1-CE3 4.48Å; L238-W383 HydrophobicContact CD1-CG 3.71Å; L238-W383 HydrophobicContact CD2-CD2 3.76Å; L238-W383 HydrophobicContact CD2-CE3 3.51Å; L238-W383 HydrophobicContact CD2-CG 4.33Å; L238-W383 HydrophobicContact CD2-CZ3 3.96Å; G277-W383 CarbonylContact C-O 3.59Å; G277-W383 VanDerWaalsContact CA-O 3.3Å; G277-W383 WeakPolarHBondContact CA-O 3.45Å; R278-W383 HydrophobicContact CB-CB 4.22Å; R278-W383 PolarHBondContact N-O 3.13Å; R278-W383 PolarHBondContact O-N 2.95Å; A280-W383 HydrophobicContact CB-CH2 4.47Å; A280-W383 HydrophobicContact CB-CZ3 4.28Å; L290-W383 HydrophobicContact CD2-CH2 3.57Å; L290-W383 HydrophobicContact CD2-CZ2 4.44Å; L290-W383 HydrophobicContact CD2-CZ3 4.35Å; V331-W383 HydrophobicContact CG1-CH2 4.1Å; V331-W383 HydrophobicContact CG1-CZ2 4.26Å; C337-W383 HydrophobicContact CB-CZ2 4.09Å; C337-W383 PolarHBondContact O-NE1 2.81Å; A339-W383 HydrophobicContact CB-CD2 4.33Å; A339-W383 HydrophobicContact CB-CZ2 4.21Å
384	S	90.3	Very high	84.6	Confident	40 Å²	40	53.3 Å²	53.3	28%	0.28	28%	0.282	S	S	.	.			trans	-57.8	153.5	172.6	58	0	0	0	0	111	R278 S386	R278-S384 PolarHBondContact NE-O 2.9Å; R278-S384 PolarHBondContact NH2-O 2.83Å; S384-S386 WeakPolarHBondContact CB-O 3.32Å; S384-S386 PolarHBondContact O-N 3.38Å; S384-S386 PolarHBondContact OG-O 3.28Å
385	V	86.3	Confident	84.5	Confident	61 Å²	61	51.1 Å²	51.1	37%	0.37	27%	0.27	S	S	.	.			trans	-65.8	-29.3	174.8	180	0	0	0	0	111.6	P275	P275-V385 HydrophobicContact CB-CG1 3.93Å; P275-V385 HydrophobicContact CB-CG2 3.88Å
386	S	65.9	Low	84.5	Confident	143 Å²	143	43.4 Å²	43.4	100%	1	25%	0.248	S	C	*	.			trans	-119	0	176	58.7	0	0	0	0	110.5	R278 S384	R278-S386 PolarHBondContact NH2-OXT 2.98Å; R278-S386 VanDerWaalsContact NH2-OXT 3.08Å; S384-S386 WeakPolarHBondContact CB-O 3.32Å; S384-S386 PolarHBondContact O-N 3.38Å; S384-S386 PolarHBondContact OG-O 3.28Å

Retrieved 386 of 386 residues in 264.5 ms (Link to these results)

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