A0A077Z430_TRITR Loading...

DUF5648 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z430, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 551 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	30.3	Very low	36.3	Very low	237 Å²	237	135.2 Å²	135.2	100%	1.167	73%	0.733	S	S	*	*				0	119.3	0	-106.7	171.9	-170.1	0	0	107.8	S3	M1-S3 PolarHBondContact O-N 3.16Å
2	F	26.3	Very low	36.9	Very low	222 Å²	222	134.5 Å²	134.5	97%	0.974	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.6	119	-169.5	-67.6	-92.8	0	0	0	110.9
3	S	30.9	Very low	37.2	Very low	115 Å²	115	138 Å²	138	80%	0.804	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-85.5	128.9	167.6	-61.8	0	0	0	0	107.9	M1	M1-S3 PolarHBondContact O-N 3.16Å
4	A	33.2	Very low	37.8	Very low	64 Å²	64	136.1 Å²	136.1	53%	0.529	73%	0.73	S	S	.	*	P	Polyproline II helix	trans	-62.6	136.8	171.7	0	0	0	0	0	109.2	T6	A4-T6 PolarHBondContact O-N 3.21Å
5	P	36.8	Very low	38.7	Very low	69 Å²	69	131.8 Å²	131.8	45%	0.448	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-55.4	137.4	174.5	-20.5	31.3	0	0	0	110.5	D7 K8	P5-D7 WeakPolarHBondContact CB-OD1 3.44Å; P5-D7 PolarHBondContact O-N 3.28Å; P5-K8 HydrophobicContact CB-CG 4.43Å; P5-K8 HydrophobicContact CG-CD 4.47Å; P5-K8 PolarHBondContact O-N 2.68Å
6	T	44.7	Very low	39.6	Very low	157 Å²	157	131.8 Å²	131.8	96%	0.963	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-10.6	-176.5	32	0	0	0	0	114.1	A4	A4-T6 PolarHBondContact O-N 3.21Å
7	D	45.2	Very low	41	Very low	132 Å²	132	133.1 Å²	133.1	71%	0.706	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	2.7	179.7	53.9	-44.8	0	0	0	113.5	P5	P5-D7 WeakPolarHBondContact CB-OD1 3.44Å; P5-D7 PolarHBondContact O-N 3.28Å
8	K	39.1	Very low	41.9	Very low	140 Å²	140	129.6 Å²	129.6	61%	0.609	71%	0.707	S	S	*	*	S	Bend	trans	-122.1	145.5	176	-66.7	-165.3	178.5	-173.4	0	111.6	P5	P5-K8 HydrophobicContact CB-CG 4.43Å; P5-K8 HydrophobicContact CG-CD 4.47Å; P5-K8 PolarHBondContact O-N 2.68Å
9	P	35.2	Very low	42.9	Very low	73 Å²	73	126.4 Å²	126.4	47%	0.474	70%	0.7	S	S	.	*			trans	-53.6	146	173.1	3.3	-4.3	0	0	0	110.2	Y11	P9-Y11 HydrophobicContact CB-CD1 4.46Å; P9-Y11 HydrophobicContact CB-CD2 3.58Å; P9-Y11 HydrophobicContact CB-CE1 4.23Å; P9-Y11 HydrophobicContact CB-CE2 3.31Å; P9-Y11 HydrophobicContact CB-CG 4.15Å; P9-Y11 HydrophobicContact CG-CD2 4.38Å; P9-Y11 HydrophobicContact CG-CE2 4.18Å; P9-Y11 PolarHBondContact O-N 3.37Å
10	P	37.5	Very low	43.6	Very low	116 Å²	116	124.5 Å²	124.5	75%	0.753	69%	0.688	S	S	*	*	S	Bend	trans	-66.5	6	178.8	26.7	-32.2	0	0	0	113.5
11	Y	39.8	Very low	44.6	Very low	162 Å²	162	120.6 Å²	120.6	64%	0.635	67%	0.669	S	S	*	*	S	Bend	trans	-128.3	129.2	176.3	32.4	-88.1	0	0	0	107.4	P9	P9-Y11 HydrophobicContact CB-CD1 4.46Å; P9-Y11 HydrophobicContact CB-CD2 3.58Å; P9-Y11 HydrophobicContact CB-CE1 4.23Å; P9-Y11 HydrophobicContact CB-CE2 3.31Å; P9-Y11 HydrophobicContact CB-CG 4.15Å; P9-Y11 HydrophobicContact CG-CD2 4.38Å; P9-Y11 HydrophobicContact CG-CE2 4.18Å; P9-Y11 PolarHBondContact O-N 3.37Å
12	V	43.3	Very low	46.4	Very low	127 Å²	127	112.8 Å²	112.8	77%	0.77	64%	0.638	S	S	*	*			trans	-78.4	122.2	163.3	179.7	0	0	0	0	105.3	M14	V12-M14 PolarHBondContact O-N 2.83Å
13	E	41.5	Very low	48.3	Very low	180 Å²	180	108.7 Å²	108.7	84%	0.841	63%	0.626	S	S	*	*			trans	-56.6	111.1	162.9	-86.8	-174.4	161.5	0	0	106.9
14	M	45.1	Very low	50	Low	111 Å²	111	105 Å²	105	55%	0.547	60%	0.599	S	S	.	*			trans	-60.2	131.9	177.8	-71.7	-170.6	-68.4	0	0	107.8	V12 L18	V12-M14 PolarHBondContact O-N 2.83Å; M14-L18 HydrophobicContact CB-CB 4.47Å
15	P	52.1	Low	51.8	Low	72 Å²	72	104.4 Å²	104.4	47%	0.468	59%	0.592	S	S	.	*			trans	-49.7	139.3	166.9	-21.8	30.6	0	0	0	108.2	N17 L18	P15-N17 PolarHBondContact O-N 3.01Å; P15-L18 HydrophobicContact CG-CD1 4.37Å; P15-L18 PolarHBondContact O-N 3.41Å
16	P	53.2	Low	53.5	Low	131 Å²	131	107 Å²	107	85%	0.851	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-4.9	-174.5	21.6	-32.3	0	0	0	114.4
17	N	62.6	Low	54.3	Low	155 Å²	155	103.4 Å²	103.4	83%	0.829	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	8.2	-178.1	-57	-23.9	0	0	0	113.3	P15	P15-N17 PolarHBondContact O-N 3.01Å
18	L	57.9	Low	55.5	Low	70 Å²	70	101.8 Å²	101.8	37%	0.366	58%	0.579	S	S	.	*			trans	-83.4	117	176.3	-143.1	89.5	0	0	0	109	M14 P15 D20 L23	M14-L18 HydrophobicContact CB-CB 4.47Å; P15-L18 HydrophobicContact CG-CD1 4.37Å; P15-L18 PolarHBondContact O-N 3.41Å; L18-D20 PolarHBondContact O-N 3.11Å; L18-L23 HydrophobicContact CD2-CD1 3.83Å; L18-L23 HydrophobicContact CD2-CG 4.33Å
19	A	60.9	Low	57	Low	68 Å²	68	99.8 Å²	99.8	56%	0.562	58%	0.58	S	S	*	*			trans	-64.6	134.5	176.8	0	0	0	0	0	110.2	C21 S22	A19-C21 PolarHBondContact O-N 3.32Å; A19-S22 VanDerWaalsContact O-CB 3.3Å; A19-S22 WeakPolarHBondContact O-CB 3.33Å; A19-S22 PolarHBondContact O-N 2.96Å; A19-S22 PolarHBondContact O-OG 3.18Å
20	D	56.5	Low	58.6	Low	88 Å²	88	98.5 Å²	98.5	47%	0.471	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-44.9	141	164.4	-74.8	-12.3	0	0	0	109.2	L18 S22 N37	L18-D20 PolarHBondContact O-N 3.11Å; D20-S22 VanDerWaalsContact C-N 3.27Å; D20-S22 PolarHBondContact O-N 3.4Å; D20-N37 HydrophobicContact CB-CB 3.9Å; D20-N37 PolarHBondContact OD2-ND2 2.8Å
21	C	65.6	Low	59.9	Low	43 Å²	43	94 Å²	94	29%	0.291	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	-5.1	177.1	-47.6	0	0	0	0	117.8	A19 L23 C24 C31	A19-C21 PolarHBondContact O-N 3.32Å; C21-L23 PolarHBondContact O-N 2.81Å; C21-C24 PolarHBondContact O-N 3.47Å; C21-C31 WeakPolarHBondContact CA-SG 3.5Å; C21-C31 HydrophobicContact CB-CB 3.39Å; C21-C31 WeakPolarHBondContact CB-SG 3.38Å; C21-C31 WeakPolarHBondContact SG-CB 3.4Å; C21-C31 PolarHBondContact SG-O 2.75Å; C21-C31 CovalentContact SG-SG 2.02Å; C21-C31 PolarHBondContact SG-SG 3.42Å
22	S	68.1	Low	61.3	Low	73 Å²	73	89.4 Å²	89.4	51%	0.51	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-12	175.7	56.8	0	0	0	0	115	A19 D20	A19-S22 VanDerWaalsContact O-CB 3.3Å; A19-S22 WeakPolarHBondContact O-CB 3.33Å; A19-S22 PolarHBondContact O-N 2.96Å; A19-S22 PolarHBondContact O-OG 3.18Å; D20-S22 VanDerWaalsContact C-N 3.27Å; D20-S22 PolarHBondContact O-N 3.4Å
23	L	66	Low	62.2	Low	137 Å²	137	85.6 Å²	85.6	72%	0.717	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	9.2	-176.1	-68.5	168.7	0	0	0	113.9	L18 C21	L18-L23 HydrophobicContact CD2-CD1 3.83Å; L18-L23 HydrophobicContact CD2-CG 4.33Å; C21-L23 PolarHBondContact O-N 2.81Å
24	C	65.9	Low	62.5	Low	36 Å²	36	80.1 Å²	80.1	24%	0.243	49%	0.488	C	S	.	.			trans	-71.2	134.4	-177.9	-63.9	0	0	0	0	112.9	C21 C31 C39	C21-C24 PolarHBondContact O-N 3.47Å; C24-C31 HydrophobicContact CB-CB 4.45Å; C24-C31 WeakPolarHBondContact SG-CB 3.4Å; C24-C31 PolarHBondContact SG-SG 2.8Å; C24-C39 WeakPolarHBondContact CA-SG 3.49Å; C24-C39 HydrophobicContact CB-CB 3.68Å; C24-C39 WeakPolarHBondContact CB-SG 3.17Å; C24-C39 WeakPolarHBondContact SG-CB 3.32Å; C24-C39 CovalentContact SG-SG 2.04Å; C24-C39 PolarHBondContact SG-SG 3.1Å
25	S	71.7	Confident	63	Low	53 Å²	53	74.9 Å²	74.9	37%	0.371	46%	0.462	S	S	.	.			trans	-73	155.9	173.5	66.9	0	0	0	0	110.3	S27 K28	S25-S27 PolarHBondContact O-N 2.78Å; S25-S27 PolarHBondContact OG-OG 2.97Å; S25-K28 CarbonylContact O-C 3.4Å; S25-K28 PolarHBondContact O-N 2.9Å
26	S	72	Confident	63.4	Low	123 Å²	123	76.1 Å²	76.1	86%	0.86	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-22.8	172.5	51.7	0	0	0	0	113.9
27	S	60.5	Low	63.8	Low	82 Å²	82	73.1 Å²	73.1	57%	0.573	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.2	176.2	55.8	0	0	0	0	114.8	S25	S25-S27 PolarHBondContact O-N 2.78Å; S25-S27 PolarHBondContact OG-OG 2.97Å
28	K	71.1	Confident	63.5	Low	98 Å²	98	70.9 Å²	70.9	43%	0.426	43%	0.428	S	S	.	.			trans	-137.1	62.1	179.9	-65.4	-168.1	173.2	-162	0	109.7	S25 I30 C39 C40	S25-K28 CarbonylContact O-C 3.4Å; S25-K28 PolarHBondContact O-N 2.9Å; K28-I30 PolarHBondContact O-N 3.01Å; K28-C39 HydrophobicContact CB-CB 3.73Å; K28-C39 HydrophobicContact CD-CB 4.44Å; K28-C39 VanDerWaalsContact CD-O 3.3Å; K28-C39 WeakPolarHBondContact CD-O 3.48Å; K28-C40 CarbonylContact C-O 3.51Å; K28-C40 VanDerWaalsContact CA-O 3.27Å; K28-C40 WeakPolarHBondContact CA-O 3.36Å
29	P	70.2	Confident	63.8	Low	97 Å²	97	69.4 Å²	69.4	63%	0.63	42%	0.424	S	S	*	.			trans	-73.4	-17.3	-168	31.9	-36.4	0	0	0	112.8	C31	P29-C31 PolarHBondContact O-N 3.48Å
30	I	69	Low	63.9	Low	47 Å²	47	67.5 Å²	67.5	24%	0.241	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-84.8	101.5	-177.4	-44	-178.3	0	0	0	107.4	K28 D32 T35 C39 C40	K28-I30 PolarHBondContact O-N 3.01Å; I30-D32 WeakPolarHBondContact CG2-OD2 3.49Å; I30-T35 HydrophobicContact CB-CG2 3.82Å; I30-T35 HydrophobicContact CG2-CG2 3.31Å; I30-T35 PolarHBondContact O-OG1 3.2Å; I30-C39 CarbonylContact O-C 3.13Å; I30-C40 WeakPolarHBondContact CB-O 3.5Å; I30-C40 PolarHBondContact N-O 3.45Å; I30-C40 PolarHBondContact O-N 3.44Å
31	C	65.7	Low	64.4	Low	21 Å²	21	69.4 Å²	69.4	14%	0.142	42%	0.416	C	S	.	.			trans	-136.8	91.7	171.7	-174.1	0	0	0	0	107.3	C21 C24 P29 T35 N37	C21-C31 WeakPolarHBondContact CA-SG 3.5Å; C21-C31 HydrophobicContact CB-CB 3.39Å; C21-C31 WeakPolarHBondContact CB-SG 3.38Å; C21-C31 WeakPolarHBondContact SG-CB 3.4Å; C21-C31 PolarHBondContact SG-O 2.75Å; C21-C31 CovalentContact SG-SG 2.02Å; C21-C31 PolarHBondContact SG-SG 3.42Å; C24-C31 HydrophobicContact CB-CB 4.45Å; C24-C31 WeakPolarHBondContact SG-CB 3.4Å; C24-C31 PolarHBondContact SG-SG 2.8Å; P29-C31 PolarHBondContact O-N 3.48Å; C31-T35 WeakPolarHBondContact CA-OG1 3.32Å; C31-N37 PolarHBondContact SG-O 2.83Å
32	D	69.4	Low	63.7	Low	65 Å²	65	69.4 Å²	69.4	35%	0.348	42%	0.419	S	S	.	.	S	Bend	trans	-152.9	-173.4	-176.2	59.2	38.9	0	0	0	108.2	I30 T34 T35 N36 N37	I30-D32 WeakPolarHBondContact CG2-OD2 3.49Å; D32-T34 PolarHBondContact O-N 2.8Å; D32-T34 VanDerWaalsContact O-N 3.15Å; D32-T34 VanDerWaalsContact OD1-CA 3.31Å; D32-T34 WeakPolarHBondContact OD1-CA 3.43Å; D32-T34 WeakPolarHBondContact OD1-CB 3.37Å; D32-T34 WeakPolarHBondContact OD1-CG2 3.42Å; D32-T34 PolarHBondContact OD1-N 2.81Å; D32-T34 PolarHBondContact OD1-OG1 3.13Å; D32-T35 PolarHBondContact N-OG1 2.85Å; D32-T35 VanDerWaalsContact N-OG1 3.13Å; D32-T35 CarbonylContact O-C 3.57Å; D32-T35 PolarHBondContact O-N 3.3Å; D32-T35 VanDerWaalsContact O-N 3.07Å; D32-T35 PolarHBondContact O-OG1 3.43Å; D32-T35 VanDerWaalsContact O-OG1 3.11Å; D32-T35 PolarHBondContact OD1-N 2.95Å; D32-N36 PolarHBondContact O-N 3.06Å; D32-N37 PolarHBondContact O-N 2.78Å
33	A	61.5	Low	62.9	Low	47 Å²	47	67.9 Å²	67.9	39%	0.388	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.5	179.7	0	0	0	0	0	113.6	T35 N36	A33-T35 VanDerWaalsContact C-N 3.26Å; A33-T35 PolarHBondContact O-N 2.77Å; A33-N36 PolarHBondContact O-N 2.89Å
34	T	48.3	Very low	61.8	Low	66 Å²	66	64.7 Å²	64.7	41%	0.405	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-20.7	178.3	77.4	0	0	0	0	112.6	D32 V44	D32-T34 PolarHBondContact O-N 2.8Å; D32-T34 VanDerWaalsContact O-N 3.15Å; D32-T34 VanDerWaalsContact OD1-CA 3.31Å; D32-T34 WeakPolarHBondContact OD1-CA 3.43Å; D32-T34 WeakPolarHBondContact OD1-CB 3.37Å; D32-T34 WeakPolarHBondContact OD1-CG2 3.42Å; D32-T34 PolarHBondContact OD1-N 2.81Å; D32-T34 PolarHBondContact OD1-OG1 3.13Å; T34-V44 WeakPolarHBondContact O-CG2 2.99Å; T34-V44 PolarHBondContact O-N 2.94Å
35	T	54.8	Low	60.5	Low	0 Å²	0	68 Å²	68	0%	0	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	6.8	175.6	64.2	0	0	0	0	112.3	I30 C31 D32 A33 N37 L38 C40	I30-T35 HydrophobicContact CB-CG2 3.82Å; I30-T35 HydrophobicContact CG2-CG2 3.31Å; I30-T35 PolarHBondContact O-OG1 3.2Å; C31-T35 WeakPolarHBondContact CA-OG1 3.32Å; D32-T35 PolarHBondContact N-OG1 2.85Å; D32-T35 VanDerWaalsContact N-OG1 3.13Å; D32-T35 CarbonylContact O-C 3.57Å; D32-T35 PolarHBondContact O-N 3.3Å; D32-T35 VanDerWaalsContact O-N 3.07Å; D32-T35 PolarHBondContact O-OG1 3.43Å; D32-T35 VanDerWaalsContact O-OG1 3.11Å; D32-T35 PolarHBondContact OD1-N 2.95Å; A33-T35 VanDerWaalsContact C-N 3.26Å; A33-T35 PolarHBondContact O-N 2.77Å; T35-N37 VanDerWaalsContact C-N 3.31Å; T35-N37 PolarHBondContact O-N 3.19Å; T35-L38 WeakPolarHBondContact CB-O 3.35Å; T35-L38 WeakPolarHBondContact O-CB 3.36Å; T35-L38 WeakPolarHBondContact O-CD1 3.2Å; T35-L38 VanDerWaalsContact O-CG 3.32Å; T35-L38 WeakPolarHBondContact O-CG 3.19Å; T35-L38 PolarHBondContact O-N 3.13Å; T35-L38 VanDerWaalsContact O-N 3.14Å; T35-L38 PolarHBondContact OG1-O 3.04Å; T35-C40 HydrophobicContact CG2-CB 3.52Å
36	N	59.8	Low	59	Low	98 Å²	98	71.3 Å²	71.3	52%	0.524	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	39.4	-177.1	-146.4	24.5	0	0	0	112.7	D32 A33 L38 R298	D32-N36 PolarHBondContact O-N 3.06Å; A33-N36 PolarHBondContact O-N 2.89Å; N36-L38 HydrophobicContact CB-CD1 4.44Å; N36-L38 PolarHBondContact O-N 2.73Å; N36-L38 VanDerWaalsContact O-N 3.14Å; N36-R298 PolarHBondContact OD1-NH1 3.34Å
37	N	61.5	Low	57.1	Low	69 Å²	69	69.5 Å²	69.5	37%	0.369	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	25.5	-174	-62.8	-20	0	0	0	113.2	D20 C31 D32 T35	D20-N37 HydrophobicContact CB-CB 3.9Å; D20-N37 PolarHBondContact OD2-ND2 2.8Å; C31-N37 PolarHBondContact SG-O 2.83Å; D32-N37 PolarHBondContact O-N 2.78Å; T35-N37 VanDerWaalsContact C-N 3.31Å; T35-N37 PolarHBondContact O-N 3.19Å
38	L	57.4	Low	55.6	Low	107 Å²	107	71.4 Å²	71.4	56%	0.56	41%	0.405	S	S	*	.			trans	-94.7	137.7	168.8	-57	166.6	0	0	0	107.7	T35 N36 C40	T35-L38 WeakPolarHBondContact CB-O 3.35Å; T35-L38 WeakPolarHBondContact O-CB 3.36Å; T35-L38 WeakPolarHBondContact O-CD1 3.2Å; T35-L38 VanDerWaalsContact O-CG 3.32Å; T35-L38 WeakPolarHBondContact O-CG 3.19Å; T35-L38 PolarHBondContact O-N 3.13Å; T35-L38 VanDerWaalsContact O-N 3.14Å; T35-L38 PolarHBondContact OG1-O 3.04Å; N36-L38 HydrophobicContact CB-CD1 4.44Å; N36-L38 PolarHBondContact O-N 2.73Å; N36-L38 VanDerWaalsContact O-N 3.14Å; L38-C40 PolarHBondContact O-N 3.32Å; L38-C40 VanDerWaalsContact O-N 3.12Å
39	C	64.1	Low	53.8	Low	40 Å²	40	71.7 Å²	71.7	27%	0.27	41%	0.414	S	S	.	.			trans	-66.2	112.7	170	-44.9	0	0	0	0	108.5	C24 K28 I30	C24-C39 WeakPolarHBondContact CA-SG 3.49Å; C24-C39 HydrophobicContact CB-CB 3.68Å; C24-C39 WeakPolarHBondContact CB-SG 3.17Å; C24-C39 WeakPolarHBondContact SG-CB 3.32Å; C24-C39 CovalentContact SG-SG 2.04Å; C24-C39 PolarHBondContact SG-SG 3.1Å; K28-C39 HydrophobicContact CB-CB 3.73Å; K28-C39 HydrophobicContact CD-CB 4.44Å; K28-C39 VanDerWaalsContact CD-O 3.3Å; K28-C39 WeakPolarHBondContact CD-O 3.48Å; I30-C39 CarbonylContact O-C 3.13Å
40	C	62.8	Low	51.8	Low	28 Å²	28	75.3 Å²	75.3	19%	0.189	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-130	165.9	178.2	-60.6	0	0	0	0	111.3	K28 I30 T35 L38 A42	K28-C40 CarbonylContact C-O 3.51Å; K28-C40 VanDerWaalsContact CA-O 3.27Å; K28-C40 WeakPolarHBondContact CA-O 3.36Å; I30-C40 WeakPolarHBondContact CB-O 3.5Å; I30-C40 PolarHBondContact N-O 3.45Å; I30-C40 PolarHBondContact O-N 3.44Å; T35-C40 HydrophobicContact CG2-CB 3.52Å; L38-C40 PolarHBondContact O-N 3.32Å; L38-C40 VanDerWaalsContact O-N 3.12Å; C40-A42 WeakPolarHBondContact CB-O 3.48Å
41	D	66.5	Low	50	Low	127 Å²	127	75.1 Å²	75.1	68%	0.679	43%	0.425	S	S	*	.	S	Bend	trans	-103.4	-10.4	174.7	53.6	-13	0	0	0	113
42	A	52.3	Low	48.4	Very low	43 Å²	43	79.3 Å²	79.3	36%	0.355	45%	0.45	S	S	.	.	S	Bend	trans	-150.7	166.3	174.3	0	0	0	0	0	112.3	C40	C40-A42 WeakPolarHBondContact CB-O 3.48Å
43	S	50.8	Low	46.7	Very low	41 Å²	41	79 Å²	79	29%	0.287	46%	0.463	S	S	.	.			trans	-75.6	151.9	178	86.1	0	0	0	0	111.9	Y45 D46	S43-Y45 PolarHBondContact O-N 3.49Å; S43-D46 PolarHBondContact O-N 3.11Å
44	V	42.1	Very low	45.6	Very low	71 Å²	71	78.5 Å²	78.5	43%	0.43	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.4	-179.4	173.8	0	0	0	0	113.2	T34	T34-V44 WeakPolarHBondContact O-CG2 2.99Å; T34-V44 PolarHBondContact O-N 2.94Å
45	Y	39.2	Very low	45.3	Very low	105 Å²	105	79.6 Å²	79.6	41%	0.412	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-2.4	-175	-63.5	-73	0	0	0	115.4	S43 L47 T248 F296	S43-Y45 PolarHBondContact O-N 3.49Å; Y45-L47 PolarHBondContact O-N 2.77Å; Y45-L47 VanDerWaalsContact O-N 3.09Å; Y45-T248 HydrophobicContact CE1-CG2 4.4Å; Y45-T248 WeakPolarHBondContact OH-CG2 3.47Å; Y45-F296 HydrophobicContact CE1-CD1 4.45Å
46	D	40.6	Very low	45.3	Very low	122 Å²	122	84 Å²	84	65%	0.652	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	13.3	171.8	-78.4	-42.6	0	0	0	113.6	S43	S43-D46 PolarHBondContact O-N 3.11Å
47	L	31.4	Very low	45.3	Very low	85 Å²	85	79.5 Å²	79.5	45%	0.445	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-3	-178.3	-81.1	163.7	0	0	0	115	Y45 V49 K468	Y45-L47 PolarHBondContact O-N 2.77Å; Y45-L47 VanDerWaalsContact O-N 3.09Å; L47-V49 PolarHBondContact O-N 3.43Å; L47-K468 HydrophobicContact CD2-CD 3.99Å
48	V	29.7	Very low	45.5	Very low	123 Å²	123	77 Å²	77	75%	0.745	47%	0.468	S	S	*	.	S	Bend	trans	-78.8	108.3	170.2	-173.7	0	0	0	0	109.4	Q50	V48-Q50 PolarHBondContact O-N 3.37Å
49	V	32.4	Very low	46.2	Very low	103 Å²	103	76 Å²	76	62%	0.624	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-64.4	121.6	175	-177.8	0	0	0	0	108.8	L47 K468	L47-V49 PolarHBondContact O-N 3.43Å; V49-K468 HydrophobicContact CG2-CD 4.42Å; V49-K468 VanDerWaalsContact CG2-NZ 3.32Å
50	Q	28.1	Very low	46.9	Very low	174 Å²	174	76 Å²	76	81%	0.813	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-55.2	134.1	176.6	-68	177.2	-14.1	0	0	111.1	V48 V52	V48-Q50 PolarHBondContact O-N 3.37Å; Q50-V52 PolarHBondContact O-N 2.93Å
51	S	30.8	Very low	48	Very low	42 Å²	42	75.2 Å²	75.2	29%	0.294	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-73.2	121.8	173.7	61.6	0	0	0	0	110.6	R211	S51-R211 PolarHBondContact OG-NH2 3.07Å
52	V	33.7	Very low	48.7	Very low	109 Å²	109	72.3 Å²	72.3	66%	0.661	45%	0.445	S	S	*	.			trans	-118.4	96.9	154.4	-169.8	0	0	0	0	105.4	Q50 G54	Q50-V52 PolarHBondContact O-N 2.93Å; V52-G54 PolarHBondContact O-N 3.25Å
53	G	33	Very low	50	Low	60 Å²	60	73 Å²	73	62%	0.619	45%	0.446	S	S	*	.			trans	-65.4	97.4	174.5	0	0	0	0	0	109.9	A55	G53-A55 PolarHBondContact O-N 2.85Å
54	G	37.9	Very low	51.6	Low	35 Å²	35	73.6 Å²	73.6	36%	0.361	46%	0.459	S	S	.	.			trans	-81.9	107.1	-174.5	0	0	0	0	0	112.6	V52 D56 C57	V52-G54 PolarHBondContact O-N 3.25Å; G54-D56 PolarHBondContact O-N 2.86Å; G54-C57 PolarHBondContact O-N 2.85Å
55	A	42.4	Very low	53.8	Low	90 Å²	90	72.8 Å²	72.8	74%	0.744	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	25.8	-177.9	0	0	0	0	0	116.4	G53	G53-A55 PolarHBondContact O-N 2.85Å
56	D	54.4	Low	56.2	Low	91 Å²	91	69.4 Å²	69.4	49%	0.487	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.8	4.6	177.1	-144.6	7.6	0	0	0	114.2	G54 G58 L380 A381	G54-D56 PolarHBondContact O-N 2.86Å; D56-G58 PolarHBondContact O-N 2.8Å; D56-L380 VanDerWaalsContact CB-O 3.22Å; D56-L380 WeakPolarHBondContact CB-O 3.43Å; D56-A381 WeakPolarHBondContact OD2-CA 2.88Å
57	C	61	Low	58.5	Low	4 Å²	4	64.4 Å²	64.4	3%	0.027	41%	0.411	C	S	.	.	S	Bend	trans	-85.2	23.7	168	-74.1	0	0	0	0	112.8	G54 C171 C382 F447	G54-C57 PolarHBondContact O-N 2.85Å; C57-C171 PolarHBondContact O-N 2.64Å; C57-C382 WeakPolarHBondContact CA-SG 3.31Å; C57-C382 HydrophobicContact CB-CB 4.2Å; C57-C382 WeakPolarHBondContact CB-SG 3.39Å; C57-C382 WeakPolarHBondContact SG-CA 3.48Å; C57-C382 WeakPolarHBondContact SG-CB 3.38Å; C57-C382 CovalentContact SG-SG 2.05Å; C57-C382 PolarHBondContact SG-SG 2.88Å; C57-F447 WeakPolarHBondContact SG-CE2 3.48Å; C57-F447 WeakPolarHBondContact SG-CZ 3.13Å
58	G	64.2	Low	61.1	Low	17 Å²	17	61.7 Å²	61.7	18%	0.175	40%	0.397	C	S	.	.			trans	82.8	154.3	-170.1	0	0	0	0	0	113.5	D56 G120 C171	D56-G58 PolarHBondContact O-N 2.8Å; G58-G120 CarbonylContact C-O 3.36Å; G58-G120 VanDerWaalsContact C-O 3.28Å; G58-G120 WeakPolarHBondContact CA-O 3.44Å; G58-C171 WeakPolarHBondContact O-CA 3.08Å
59	T	73	Confident	63.7	Low	85 Å²	85	56.1 Å²	56.1	52%	0.521	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-88.3	148.2	178.3	64.1	0	0	0	0	110.4	P61 G120	T59-P61 WeakPolarHBondContact O-CD 3.45Å; T59-G120 PolarHBondContact N-O 2.93Å; T59-G120 VanDerWaalsContact OG1-CA 3.31Å; T59-G120 WeakPolarHBondContact OG1-CA 3.47Å
60	E	79.4	Confident	66.1	Low	42 Å²	42	52.7 Å²	52.7	20%	0.196	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-54.7	124.7	171.8	-160.6	-174.8	152.8	0	0	110.3	R66 C171 N172 N368	E60-R66 VanDerWaalsContact CD-NH2 3.26Å; E60-R66 VanDerWaalsContact CG-NH2 3.29Å; E60-R66 IonicContact OE1-CZ 2.78Å; E60-R66 IonicContact OE1-NH1 3.99Å; E60-R66 PolarHBondContact OE1-NH1 3.06Å; E60-R66 IonicContact OE1-NH2 3.86Å; E60-R66 PolarHBondContact OE1-NH2 2.54Å; E60-C171 WeakPolarHBondContact CA-O 3.32Å; E60-N172 HydrophobicContact CB-CB 3.79Å; E60-N172 HydrophobicContact CG-CB 3.97Å; E60-N172 PolarHBondContact OE2-ND2 2.93Å; E60-N368 PolarHBondContact OE1-ND2 2.98Å; E60-N368 PolarHBondContact OE1-OD1 2.91Å
61	P	84.3	Confident	68.4	Low	10 Å²	10	45.4 Å²	45.4	7%	0.065	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-54	142.3	176	-28.1	35.5	0	0	0	111.5	T59 R66 V112 V118	T59-P61 WeakPolarHBondContact O-CD 3.45Å; P61-R66 HydrophobicContact CB-CG 4.24Å; P61-R66 PolarHBondContact O-NE 2.79Å; P61-R66 PolarHBondContact O-NH2 3.22Å; P61-V112 HydrophobicContact CB-CG2 3.6Å; P61-V112 HydrophobicContact CG-CG2 3.38Å; P61-V118 HydrophobicContact CB-CG1 4.06Å; P61-V118 HydrophobicContact CB-CG2 4Å; P61-V118 HydrophobicContact CG-CG1 4.19Å; P61-V118 HydrophobicContact CG-CG2 4.38Å
62	P	82.1	Confident	70.7	Confident	66 Å²	66	44.9 Å²	44.9	43%	0.429	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-55.8	145.3	174.9	-24.7	33.5	0	0	0	112	G64 D65	P62-G64 PolarHBondContact O-N 3.01Å; P62-G64 VanDerWaalsContact O-N 3.13Å; P62-D65 WeakPolarHBondContact CD-OD2 3.38Å; P62-D65 WeakPolarHBondContact CG-OD2 3.45Å; P62-D65 PolarHBondContact O-N 3.26Å
63	P	80.2	Confident	72.7	Confident	59 Å²	59	42.6 Å²	42.6	38%	0.383	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-54.6	-32.9	177.9	-27.2	34.9	0	0	0	113.7	D65 R66	P63-D65 PolarHBondContact O-N 2.95Å; P63-R66 PolarHBondContact O-N 2.87Å; P63-R66 VanDerWaalsContact O-N 3.13Å
64	G	84	Confident	74.9	Confident	53 Å²	53	40 Å²	40	55%	0.546	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-65.1	-21	176.7	0	0	0	0	0	114.5	P62 K113	P62-G64 PolarHBondContact O-N 3.01Å; P62-G64 VanDerWaalsContact O-N 3.13Å; G64-K113 WeakPolarHBondContact O-CE 3.41Å; G64-K113 PolarHBondContact O-NZ 3.33Å
65	D	88.4	Confident	76.8	Confident	54 Å²	54	41.5 Å²	41.5	29%	0.289	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-92.9	-0.7	176.7	-66.1	-35.7	0	0	0	112.7	P62 P63 V112 K113	P62-D65 WeakPolarHBondContact CD-OD2 3.38Å; P62-D65 WeakPolarHBondContact CG-OD2 3.45Å; P62-D65 PolarHBondContact O-N 3.26Å; P63-D65 PolarHBondContact O-N 2.95Å; D65-V112 CarbonylContact O-C 3.48Å; D65-V112 WeakPolarHBondContact O-CA 3.49Å; D65-K113 WeakPolarHBondContact O-CB 3.29Å; D65-K113 WeakPolarHBondContact O-CG 3.27Å; D65-K113 PolarHBondContact O-N 3.24Å
66	R	89.7	Confident	78.4	Confident	34 Å²	34	40.8 Å²	40.8	13%	0.128	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	157.2	-178.1	-58.8	-173.7	-130.9	169.1	14	112.1	E60 P61 P63 V111 K113 N368	E60-R66 VanDerWaalsContact CD-NH2 3.26Å; E60-R66 VanDerWaalsContact CG-NH2 3.29Å; E60-R66 IonicContact OE1-CZ 2.78Å; E60-R66 IonicContact OE1-NH1 3.99Å; E60-R66 PolarHBondContact OE1-NH1 3.06Å; E60-R66 IonicContact OE1-NH2 3.86Å; E60-R66 PolarHBondContact OE1-NH2 2.54Å; P61-R66 HydrophobicContact CB-CG 4.24Å; P61-R66 PolarHBondContact O-NE 2.79Å; P61-R66 PolarHBondContact O-NH2 3.22Å; P63-R66 PolarHBondContact O-N 2.87Å; P63-R66 VanDerWaalsContact O-N 3.13Å; R66-V111 CarbonylContact C-O 3.58Å; R66-V111 WeakPolarHBondContact CA-O 3.25Å; R66-V111 WeakPolarHBondContact CB-O 3.06Å; R66-K113 WeakPolarHBondContact O-CE 3.46Å; R66-N368 PolarHBondContact NH1-OD1 3.37Å
67	I	89.3	Confident	79.2	Confident	16 Å²	16	38.3 Å²	38.3	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.2	171.3	50.6	175.3	0	0	0	109.2	F84 T85 I87 S110 V111 K113	I67-F84 HydrophobicContact CD1-CB 4.1Å; I67-F84 HydrophobicContact CD1-CD1 4.34Å; I67-T85 WeakPolarHBondContact CG2-O 2.99Å; I67-I87 HydrophobicContact CD1-CG1 4.16Å; I67-S110 CarbonylContact O-C 3.59Å; I67-S110 VanDerWaalsContact O-CA 3.25Å; I67-S110 WeakPolarHBondContact O-CA 3.4Å; I67-S110 WeakPolarHBondContact O-CB 3.49Å; I67-V111 HydrophobicContact CD1-CG2 4.09Å; I67-V111 HydrophobicContact CG1-CG2 3.65Å; I67-V111 PolarHBondContact N-O 2.84Å; I67-V111 PolarHBondContact O-N 3.1Å; I67-K113 HydrophobicContact CB-CG 4.49Å; I67-K113 HydrophobicContact CG1-CG 4.44Å; I67-K113 HydrophobicContact CG2-CD 4.27Å; I67-K113 HydrophobicContact CG2-CG 3.53Å
68	N	84.9	Confident	79.7	Confident	28 Å²	28	45.3 Å²	45.3	15%	0.15	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	148.4	179	-66	-9.8	0	0	0	110.4	T85	N68-T85 PolarHBondContact O-N 2.92Å; N68-T85 PolarHBondContact O-OG1 3.17Å
69	V	85	Confident	80	Confident	6 Å²	6	44.5 Å²	44.5	4%	0.036	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.8	173.8	-173.6	0	0	0	0	108.3	L82 A83 F84 V108 G109 V111	V69-L82 HydrophobicContact CG1-CB 4.01Å; V69-L82 HydrophobicContact CG1-CD1 4.45Å; V69-L82 HydrophobicContact CG1-CD2 4.39Å; V69-A83 WeakPolarHBondContact CA-O 3.06Å; V69-F84 HydrophobicContact CG1-CE1 4.29Å; V69-F84 HydrophobicContact CG1-CE2 4.46Å; V69-F84 HydrophobicContact CG1-CZ 4.23Å; V69-F84 HydrophobicContact CG2-CD1 3.64Å; V69-F84 HydrophobicContact CG2-CE1 3.61Å; V69-F84 HydrophobicContact CG2-CG 4.4Å; V69-F84 HydrophobicContact CG2-CZ 4.35Å; V69-V108 HydrophobicContact CB-CB 4.29Å; V69-V108 HydrophobicContact CG1-CB 4.17Å; V69-V108 HydrophobicContact CG1-CG2 4.44Å; V69-V108 PolarHBondContact O-N 2.9Å; V69-G109 PolarHBondContact N-O 3Å; V69-V111 HydrophobicContact CG2-CB 4.38Å; V69-V111 HydrophobicContact CG2-CG1 3.77Å; V69-V111 HydrophobicContact CG2-CG2 3.85Å
70	S	81.7	Confident	80	Confident	31 Å²	31	41 Å²	41	22%	0.217	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	148.1	175.4	-60.7	0	0	0	0	110	L82 A83 G106	S70-L82 WeakPolarHBondContact O-CA 3.38Å; S70-A83 PolarHBondContact N-O 2.94Å; S70-A83 PolarHBondContact O-N 3.33Å; S70-G106 WeakPolarHBondContact CA-O 3.4Å
71	R	77.7	Confident	80.2	Confident	21 Å²	21	39.8 Å²	39.8	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.3	-179	-175.3	174	161.2	-135.5	0.4	110.7	N80 L82 L105 G106 V108 L190	R71-N80 PolarHBondContact NE-OD1 3.5Å; R71-N80 PolarHBondContact NH2-OD1 3.19Å; R71-L82 HydrophobicContact CB-CD2 3.96Å; R71-L82 HydrophobicContact CG-CD2 4Å; R71-L105 HydrophobicContact CB-CB 4.27Å; R71-L105 HydrophobicContact CG-CB 4.2Å; R71-L105 HydrophobicContact CG-CD1 4Å; R71-L105 WeakPolarHBondContact O-CB 3.26Å; R71-L105 PolarHBondContact O-N 2.98Å; R71-G106 PolarHBondContact N-O 3.23Å; R71-G106 PolarHBondContact O-N 1.97Å; R71-V108 HydrophobicContact CB-CG2 3.53Å; R71-L190 VanDerWaalsContact NH2-CD2 3.31Å
72	Y	79.1	Confident	80.3	Confident	32 Å²	32	39.7 Å²	39.7	13%	0.125	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149	175.3	-63.6	-102.3	0	0	0	108.8	N80 I81 A83 L95 T103 I104	Y72-N80 CarbonylContact O-C 3.59Å; Y72-N80 WeakPolarHBondContact O-CA 3.19Å; Y72-I81 PolarHBondContact N-O 3.23Å; Y72-I81 PolarHBondContact O-N 3Å; Y72-A83 HydrophobicContact CD2-CB 3.75Å; Y72-A83 HydrophobicContact CE2-CB 3.4Å; Y72-A83 VanDerWaalsContact CE2-CB 3.4Å; Y72-L95 HydrophobicContact CD1-CD1 3.87Å; Y72-L95 HydrophobicContact CE1-CD1 3.78Å; Y72-L95 HydrophobicContact CE1-CD2 3.74Å; Y72-L95 HydrophobicContact CE1-CG 4.41Å; Y72-T103 CarbonylContact C-O 3.58Å; Y72-T103 WeakPolarHBondContact CA-O 3.36Å; Y72-I104 HydrophobicContact CD1-CB 4.49Å; Y72-I104 HydrophobicContact CD1-CG1 3.96Å; Y72-I104 HydrophobicContact CE1-CB 4.38Å; Y72-I104 HydrophobicContact CE1-CD1 4.06Å; Y72-I104 HydrophobicContact CE1-CG1 3.66Å; Y72-I104 HydrophobicContact CE1-CG2 4.29Å
73	Y	75.7	Confident	80.5	Confident	60 Å²	60	36.8 Å²	36.8	24%	0.235	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.3	167.8	-173.6	-101.1	0	0	0	108.7	N75 R78 Y102 T103	Y73-N75 VanDerWaalsContact CD1-OD1 3.23Å; Y73-N75 WeakPolarHBondContact CD1-OD1 3.27Å; Y73-N75 WeakPolarHBondContact CE1-OD1 3.25Å; Y73-N75 PolarHBondContact O-N 3.17Å; Y73-R78 VanDerWaalsContact OH-CA 3.29Å; Y73-R78 WeakPolarHBondContact OH-CA 3.26Å; Y73-R78 WeakPolarHBondContact OH-CB 2.79Å; Y73-Y102 CarbonylContact O-C 3.56Å; Y73-Y102 WeakPolarHBondContact O-CA 3.46Å; Y73-T103 PolarHBondContact N-O 2.93Å; Y73-T103 PolarHBondContact O-N 2.79Å
74	D	78.7	Confident	81.1	Confident	7 Å²	7	34.1 Å²	34.1	4%	0.037	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	104.4	172.6	-172.3	-32.6	0	0	0	108.6	S76 I77 R78 S79 I81 Y102	D74-S76 PolarHBondContact O-N 3.1Å; D74-S76 WeakPolarHBondContact OD1-CA 3.46Å; D74-S76 VanDerWaalsContact OD1-CB 3.3Å; D74-S76 WeakPolarHBondContact OD1-CB 3.5Å; D74-S76 PolarHBondContact OD1-N 3.47Å; D74-S76 PolarHBondContact OD1-OG 3.09Å; D74-I77 HydrophobicContact CB-CD1 4.11Å; D74-I77 HydrophobicContact CB-CG1 3.67Å; D74-I77 PolarHBondContact O-N 3.34Å; D74-I77 PolarHBondContact OD1-N 3.34Å; D74-R78 VanDerWaalsContact O-CA 3.3Å; D74-R78 WeakPolarHBondContact O-CA 3.47Å; D74-R78 PolarHBondContact O-N 2.97Å; D74-S79 PolarHBondContact N-O 3.24Å; D74-S79 PolarHBondContact O-N 3.03Å; D74-I81 HydrophobicContact CB-CD1 3.92Å; D74-I81 HydrophobicContact CB-CG1 4.46Å; D74-Y102 HydrophobicContact CB-CD1 3.98Å; D74-Y102 HydrophobicContact CB-CE1 3.67Å; D74-Y102 WeakPolarHBondContact OD2-CE1 3.34Å; D74-Y102 PolarHBondContact OD2-OH 2.71Å
75	N	77.5	Confident	81.1	Confident	66 Å²	66	34.6 Å²	34.6	35%	0.353	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.9	180	-65	-52.7	0	0	0	112.4	Y73 R100 K101 T103	Y73-N75 VanDerWaalsContact CD1-OD1 3.23Å; Y73-N75 WeakPolarHBondContact CD1-OD1 3.27Å; Y73-N75 WeakPolarHBondContact CE1-OD1 3.25Å; Y73-N75 PolarHBondContact O-N 3.17Å; N75-R100 PolarHBondContact ND2-O 2.92Å; N75-K101 VanDerWaalsContact CB-O 3.28Å; N75-K101 WeakPolarHBondContact CB-O 3.38Å; N75-K101 PolarHBondContact N-O 2.03Å; N75-K101 PolarHBondContact ND2-O 3.26Å; N75-T103 PolarHBondContact ND2-OG1 3.38Å; N75-T103 PolarHBondContact OD1-OG1 3.28Å
76	S	75.6	Confident	81	Confident	75 Å²	75	35.5 Å²	35.5	52%	0.524	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-35.5	-177.4	73.4	0	0	0	0	113.3	D74 K101	D74-S76 PolarHBondContact O-N 3.1Å; D74-S76 WeakPolarHBondContact OD1-CA 3.46Å; D74-S76 VanDerWaalsContact OD1-CB 3.3Å; D74-S76 WeakPolarHBondContact OD1-CB 3.5Å; D74-S76 PolarHBondContact OD1-N 3.47Å; D74-S76 PolarHBondContact OD1-OG 3.09Å; S76-K101 WeakPolarHBondContact OG-CE 3.25Å
77	I	72.6	Confident	80.9	Confident	39 Å²	39	35.4 Å²	35.4	20%	0.2	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-0.5	178.4	64.2	175.7	0	0	0	112.8	D74 S79 K136	D74-I77 HydrophobicContact CB-CD1 4.11Å; D74-I77 HydrophobicContact CB-CG1 3.67Å; D74-I77 PolarHBondContact O-N 3.34Å; D74-I77 PolarHBondContact OD1-N 3.34Å; I77-S79 PolarHBondContact O-N 3.36Å; I77-K136 HydrophobicContact CB-CB 4.16Å; I77-K136 HydrophobicContact CB-CD 4.34Å; I77-K136 HydrophobicContact CG2-CB 4.27Å; I77-K136 HydrophobicContact CG2-CD 3.83Å
78	R	69.9	Low	80.3	Confident	150 Å²	150	38.4 Å²	38.4	57%	0.566	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	41	-177.8	-59.5	-170.3	179.5	-175	-4.4	112.8	Y73 D74 F185	Y73-R78 VanDerWaalsContact OH-CA 3.29Å; Y73-R78 WeakPolarHBondContact OH-CA 3.26Å; Y73-R78 WeakPolarHBondContact OH-CB 2.79Å; D74-R78 VanDerWaalsContact O-CA 3.3Å; D74-R78 WeakPolarHBondContact O-CA 3.47Å; D74-R78 PolarHBondContact O-N 2.97Å; R78-F185 HydrophobicContact CB-CD1 4.22Å; R78-F185 HydrophobicContact CB-CE1 4.45Å
79	S	70.4	Confident	79.9	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.6	-176.2	-171.3	0	0	0	0	111.3	D74 I77	D74-S79 PolarHBondContact N-O 3.24Å; D74-S79 PolarHBondContact O-N 3.03Å; I77-S79 PolarHBondContact O-N 3.36Å
80	N	74.1	Confident	79.8	Confident	12 Å²	12	41.2 Å²	41.2	6%	0.064	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	149.1	173.1	-65.4	-90.3	0	0	0	110.8	R71 Y72 L105 N138 V188	R71-N80 PolarHBondContact NE-OD1 3.5Å; R71-N80 PolarHBondContact NH2-OD1 3.19Å; Y72-N80 CarbonylContact O-C 3.59Å; Y72-N80 WeakPolarHBondContact O-CA 3.19Å; N80-L105 WeakPolarHBondContact OD1-CD1 3.45Å; N80-N138 PolarHBondContact O-ND2 3.39Å; N80-V188 WeakPolarHBondContact ND2-CG1 2.86Å; N80-V188 WeakPolarHBondContact ND2-CG2 3.39Å
81	I	82.3	Confident	79.5	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.077	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.1	174.5	-55.1	178.5	0	0	0	106.7	Y72 D74 T90 P92 Y102	Y72-I81 PolarHBondContact N-O 3.23Å; Y72-I81 PolarHBondContact O-N 3Å; D74-I81 HydrophobicContact CB-CD1 3.92Å; D74-I81 HydrophobicContact CB-CG1 4.46Å; I81-T90 WeakPolarHBondContact CG2-O 3.46Å; I81-P92 HydrophobicContact CD1-CG 3.95Å; I81-Y102 HydrophobicContact CD1-CE1 3.99Å
82	L	87.3	Confident	79.2	Confident	8 Å²	8	42.6 Å²	42.6	4%	0.042	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.6	167.2	-59	-176.5	0	0	0	108	V69 S70 R71 F84 V108 Y140 M177	V69-L82 HydrophobicContact CG1-CB 4.01Å; V69-L82 HydrophobicContact CG1-CD1 4.45Å; V69-L82 HydrophobicContact CG1-CD2 4.39Å; S70-L82 WeakPolarHBondContact O-CA 3.38Å; R71-L82 HydrophobicContact CB-CD2 3.96Å; R71-L82 HydrophobicContact CG-CD2 4Å; L82-F84 HydrophobicContact CB-CD2 4.43Å; L82-F84 HydrophobicContact CB-CE2 3.66Å; L82-F84 HydrophobicContact CB-CZ 4.23Å; L82-F84 WeakPolarHBondContact O-CD2 3.23Å; L82-V108 HydrophobicContact CD2-CG2 4.07Å; L82-Y140 HydrophobicContact CB-CD1 4.5Å; L82-Y140 HydrophobicContact CB-CD2 4Å; L82-Y140 HydrophobicContact CB-CE1 4.12Å; L82-Y140 HydrophobicContact CB-CE2 3.6Å; L82-Y140 HydrophobicContact CB-CG 4.43Å; L82-Y140 HydrophobicContact CD1-CD2 3.54Å; L82-Y140 HydrophobicContact CD1-CE2 3.99Å; L82-Y140 HydrophobicContact CD1-CG 3.94Å; L82-Y140 HydrophobicContact CG-CD2 3.73Å; L82-Y140 HydrophobicContact CG-CE2 3.61Å; L82-Y140 HydrophobicContact CG-CG 4.44Å; L82-Y140 PolarHBondContact N-OH 2.89Å; L82-Y140 PolarHBondContact O-OH 3.03Å; L82-M177 HydrophobicContact CD1-CE 3.93Å
83	A	87.3	Confident	78.9	Confident	5 Å²	5	47.8 Å²	47.8	4%	0.041	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127.6	174.5	0	0	0	0	0	109.2	V69 S70 Y72 I91	V69-A83 WeakPolarHBondContact CA-O 3.06Å; S70-A83 PolarHBondContact N-O 2.94Å; S70-A83 PolarHBondContact O-N 3.33Å; Y72-A83 HydrophobicContact CD2-CB 3.75Å; Y72-A83 HydrophobicContact CE2-CB 3.4Å; Y72-A83 VanDerWaalsContact CE2-CB 3.4Å; A83-I91 HydrophobicContact CB-CG1 3.93Å
84	F	91.1	Very high	78.9	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.013	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.9	-180	-66.6	-104.9	0	0	0	107.7	I67 V69 L82 G86 I87 T90 V111 I127 Y140 V161	I67-F84 HydrophobicContact CD1-CB 4.1Å; I67-F84 HydrophobicContact CD1-CD1 4.34Å; V69-F84 HydrophobicContact CG1-CE1 4.29Å; V69-F84 HydrophobicContact CG1-CE2 4.46Å; V69-F84 HydrophobicContact CG1-CZ 4.23Å; V69-F84 HydrophobicContact CG2-CD1 3.64Å; V69-F84 HydrophobicContact CG2-CE1 3.61Å; V69-F84 HydrophobicContact CG2-CG 4.4Å; V69-F84 HydrophobicContact CG2-CZ 4.35Å; L82-F84 HydrophobicContact CB-CD2 4.43Å; L82-F84 HydrophobicContact CB-CE2 3.66Å; L82-F84 HydrophobicContact CB-CZ 4.23Å; L82-F84 WeakPolarHBondContact O-CD2 3.23Å; F84-G86 PolarHBondContact O-N 2.78Å; F84-I87 HydrophobicContact CB-CB 4.06Å; F84-I87 HydrophobicContact CB-CG1 3.88Å; F84-I87 PolarHBondContact O-N 2.9Å; F84-T90 HydrophobicContact CB-CG2 4.32Å; F84-T90 HydrophobicContact CD2-CG2 3.72Å; F84-T90 HydrophobicContact CG-CG2 4.39Å; F84-T90 PolarHBondContact N-OG1 3.3Å; F84-T90 PolarHBondContact O-OG1 2.84Å; F84-V111 HydrophobicContact CD1-CG2 3.68Å; F84-V111 HydrophobicContact CE1-CG1 4.36Å; F84-V111 HydrophobicContact CE1-CG2 3.79Å; F84-I127 HydrophobicContact CE1-CD1 4.13Å; F84-Y140 HydrophobicContact CD2-CE1 4.49Å; F84-Y140 AromaticContact CE2-CD1 3.69Å; F84-Y140 HydrophobicContact CE2-CD1 3.69Å; F84-Y140 AromaticContact CE2-CE1 3.64Å; F84-Y140 HydrophobicContact CE2-CE1 3.64Å; F84-Y140 HydrophobicContact CE2-CG 4.49Å; F84-Y140 HydrophobicContact CZ-CD1 4.05Å; F84-Y140 HydrophobicContact CZ-CE1 4.45Å; F84-V161 HydrophobicContact CD1-CB 4.21Å; F84-V161 HydrophobicContact CD1-CG2 4.14Å; F84-V161 WeakPolarHBondContact CD1-O 3.24Å; F84-V161 HydrophobicContact CD2-CB 3.92Å; F84-V161 HydrophobicContact CD2-CG2 3.95Å; F84-V161 HydrophobicContact CE1-CB 4.37Å; F84-V161 HydrophobicContact CE1-CG2 3.78Å; F84-V161 HydrophobicContact CE2-CB 4.08Å; F84-V161 HydrophobicContact CE2-CG2 3.57Å; F84-V161 HydrophobicContact CG-CB 4Å; F84-V161 HydrophobicContact CG-CG2 4.23Å; F84-V161 HydrophobicContact CZ-CB 4.31Å; F84-V161 HydrophobicContact CZ-CG2 3.49Å; F84-V161 VanDerWaalsContact CZ-CG2 3.49Å
85	T	85.8	Confident	78.6	Confident	63 Å²	63	47.9 Å²	47.9	39%	0.387	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	124.2	-175.5	-61.5	0	0	0	0	110.9	I67 N68	I67-T85 WeakPolarHBondContact CG2-O 2.99Å; N68-T85 PolarHBondContact O-N 2.92Å; N68-T85 PolarHBondContact O-OG1 3.17Å
86	G	84.4	Confident	78.3	Confident	73 Å²	73	52.3 Å²	52.3	75%	0.753	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-1.7	-179.1	0	0	0	0	0	115.5	F84	F84-G86 PolarHBondContact O-N 2.78Å
87	I	88.1	Confident	78.2	Confident	33 Å²	33	59.8 Å²	59.8	17%	0.169	33%	0.327	C	S	.	.			trans	-107.6	95.8	179.6	-50.1	-60.4	0	0	0	109.9	I67 F84 N89 T90 P114 V161	I67-I87 HydrophobicContact CD1-CG1 4.16Å; F84-I87 HydrophobicContact CB-CB 4.06Å; F84-I87 HydrophobicContact CB-CG1 3.88Å; F84-I87 PolarHBondContact O-N 2.9Å; I87-N89 VanDerWaalsContact C-N 3.25Å; I87-N89 WeakPolarHBondContact CG2-OD1 3.49Å; I87-N89 PolarHBondContact O-N 2.94Å; I87-N89 VanDerWaalsContact O-N 3.11Å; I87-T90 HydrophobicContact CB-CG2 4.12Å; I87-T90 HydrophobicContact CG2-CG2 3.7Å; I87-T90 PolarHBondContact O-N 3.21Å; I87-T90 PolarHBondContact O-OG1 3.18Å; I87-P114 HydrophobicContact CD1-CG 3.93Å; I87-V161 HydrophobicContact CG2-CG1 4.36Å
88	A	77.1	Confident	78.4	Confident	78 Å²	78	61 Å²	61	65%	0.645	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-34.4	-167.8	0	0	0	0	0	114.9	T90 I91	A88-T90 VanDerWaalsContact C-N 3.28Å; A88-T90 PolarHBondContact O-N 2.89Å; A88-I91 VanDerWaalsContact O-O 3.13Å
89	N	76.7	Confident	78.3	Confident	92 Å²	92	57.7 Å²	57.7	49%	0.492	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-4.8	-177.7	38.2	-37.3	0	0	0	114.2	I87 R158	I87-N89 VanDerWaalsContact C-N 3.25Å; I87-N89 WeakPolarHBondContact CG2-OD1 3.49Å; I87-N89 PolarHBondContact O-N 2.94Å; I87-N89 VanDerWaalsContact O-N 3.11Å; N89-R158 PolarHBondContact ND2-O 3.39Å
90	T	82.7	Confident	78.6	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.012	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-20.4	174.9	67.1	0	0	0	0	112.9	I81 F84 I87 A88 V161	I81-T90 WeakPolarHBondContact CG2-O 3.46Å; F84-T90 HydrophobicContact CB-CG2 4.32Å; F84-T90 HydrophobicContact CD2-CG2 3.72Å; F84-T90 HydrophobicContact CG-CG2 4.39Å; F84-T90 PolarHBondContact N-OG1 3.3Å; F84-T90 PolarHBondContact O-OG1 2.84Å; I87-T90 HydrophobicContact CB-CG2 4.12Å; I87-T90 HydrophobicContact CG2-CG2 3.7Å; I87-T90 PolarHBondContact O-N 3.21Å; I87-T90 PolarHBondContact O-OG1 3.18Å; A88-T90 VanDerWaalsContact C-N 3.28Å; A88-T90 PolarHBondContact O-N 2.89Å; T90-V161 HydrophobicContact CG2-CB 4.01Å; T90-V161 HydrophobicContact CG2-CG1 3.43Å; T90-V161 VanDerWaalsContact CG2-CG1 3.43Å
91	I	74.8	Confident	78.9	Confident	64 Å²	64	70.4 Å²	70.4	33%	0.328	39%	0.386	S	S	.	.	S	Bend	trans	-93.8	126.3	176.2	-59.7	171.2	0	0	0	107.7	A83 A88 T93 L95	A83-I91 HydrophobicContact CB-CG1 3.93Å; A88-I91 VanDerWaalsContact O-O 3.13Å; I91-T93 PolarHBondContact O-N 2.93Å; I91-T93 VanDerWaalsContact O-N 3.11Å; I91-L95 HydrophobicContact CG2-CD2 4Å
92	P	71.2	Confident	78.9	Confident	16 Å²	16	70.5 Å²	70.5	10%	0.104	39%	0.386	C	S	.	.			trans	-57	120.7	174.3	-23.4	33	0	0	0	111.4	I81 D94 L95 Y102	I81-P92 HydrophobicContact CD1-CG 3.95Å; P92-D94 PolarHBondContact O-N 3.5Å; P92-D94 VanDerWaalsContact O-N 3.1Å; P92-L95 HydrophobicContact CB-CB 4.34Å; P92-L95 WeakPolarHBondContact O-CB 3.49Å; P92-L95 PolarHBondContact O-N 3.48Å; P92-Y102 HydrophobicContact CB-CD1 4.35Å; P92-Y102 HydrophobicContact CB-CD2 4.22Å; P92-Y102 HydrophobicContact CB-CE1 3.7Å; P92-Y102 HydrophobicContact CB-CE2 3.54Å; P92-Y102 WeakPolarHBondContact CB-OH 3.36Å; P92-Y102 HydrophobicContact CG-CD1 3.89Å; P92-Y102 HydrophobicContact CG-CE1 3.47Å; P92-Y102 VanDerWaalsContact CG-CE1 3.47Å; P92-Y102 HydrophobicContact CG-CE2 4.16Å; P92-Y102 HydrophobicContact CG-CG 4.41Å
93	T	72.6	Confident	78.3	Confident	141 Å²	141	73 Å²	73	87%	0.865	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.7	-177.4	53.4	0	0	0	0	113.8	I91	I91-T93 PolarHBondContact O-N 2.93Å; I91-T93 VanDerWaalsContact O-N 3.11Å
94	D	76.8	Confident	77.7	Confident	40 Å²	40	78.3 Å²	78.3	21%	0.214	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	10.5	176.2	63.6	-36.8	0	0	0	113.4	P92 D96 R97 N98 K101 Y102	P92-D94 PolarHBondContact O-N 3.5Å; P92-D94 VanDerWaalsContact O-N 3.1Å; D94-D96 VanDerWaalsContact C-N 3.34Å; D94-D96 PolarHBondContact O-N 3.26Å; D94-R97 CarbonylContact O-C 3.49Å; D94-R97 PolarHBondContact O-N 3.22Å; D94-N98 WeakPolarHBondContact O-CB 3.47Å; D94-N98 PolarHBondContact O-N 2.95Å; D94-K101 IonicContact OD1-NZ 2.86Å; D94-K101 WeakPolarHBondContact OD2-CD 3.39Å; D94-K101 IonicContact OD2-NZ 3.68Å; D94-K101 PolarHBondContact OD2-NZ 3.28Å; D94-Y102 WeakPolarHBondContact OD1-CE2 3.49Å; D94-Y102 PolarHBondContact OD1-OH 3.04Å
95	L	73	Confident	76.5	Confident	30 Å²	30	80.2 Å²	80.2	16%	0.157	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-48.9	-177.5	-174.5	68.4	0	0	0	112.1	Y72 I91 P92 R97 N98 A99 Y102	Y72-L95 HydrophobicContact CD1-CD1 3.87Å; Y72-L95 HydrophobicContact CE1-CD1 3.78Å; Y72-L95 HydrophobicContact CE1-CD2 3.74Å; Y72-L95 HydrophobicContact CE1-CG 4.41Å; I91-L95 HydrophobicContact CG2-CD2 4Å; P92-L95 HydrophobicContact CB-CB 4.34Å; P92-L95 WeakPolarHBondContact O-CB 3.49Å; P92-L95 PolarHBondContact O-N 3.48Å; L95-R97 VanDerWaalsContact C-N 3.32Å; L95-R97 PolarHBondContact O-N 3.38Å; L95-N98 PolarHBondContact O-N 2.82Å; L95-A99 PolarHBondContact O-N 2.93Å; L95-Y102 VanDerWaalsContact CD1-CB 3.49Å; L95-Y102 HydrophobicContact CD1-CD2 3.74Å; L95-Y102 HydrophobicContact CD1-CG 3.69Å
96	D	70.2	Confident	75.3	Confident	159 Å²	159	78.1 Å²	78.1	85%	0.85	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-28.1	179.9	-62.7	-29.8	0	0	0	112.9	D94	D94-D96 VanDerWaalsContact C-N 3.34Å; D94-D96 PolarHBondContact O-N 3.26Å
97	R	73.8	Confident	74.4	Confident	232 Å²	232	77.8 Å²	77.8	88%	0.875	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-23	-178.3	-64.7	-176.3	-178.2	-174.6	0.8	112.6	D94 L95	D94-R97 CarbonylContact O-C 3.49Å; D94-R97 PolarHBondContact O-N 3.22Å; L95-R97 VanDerWaalsContact C-N 3.32Å; L95-R97 PolarHBondContact O-N 3.38Å
98	N	76.8	Confident	73.4	Confident	65 Å²	65	76.6 Å²	76.6	35%	0.348	41%	0.408	S	S	.	.			trans	-136.4	56.2	-171	-156.2	-12.7	0	0	0	111.7	D94 L95 R100 K101	D94-N98 WeakPolarHBondContact O-CB 3.47Å; D94-N98 PolarHBondContact O-N 2.95Å; L95-N98 PolarHBondContact O-N 2.82Å; N98-R100 PolarHBondContact O-N 3.19Å; N98-K101 HydrophobicContact CB-CB 4.04Å; N98-K101 WeakPolarHBondContact O-CB 3.48Å; N98-K101 PolarHBondContact O-N 2.62Å; N98-K101 WeakPolarHBondContact OD1-CB 3.49Å; N98-K101 PolarHBondContact OD1-N 2.64Å
99	A	68	Low	73.2	Confident	80 Å²	80	73.8 Å²	73.8	66%	0.661	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19.1	176.8	0	0	0	0	0	113.9	L95 Y102	L95-A99 PolarHBondContact O-N 2.93Å; A99-Y102 VanDerWaalsContact O-O 3.06Å
100	R	75.5	Confident	73.6	Confident	231 Å²	231	71.1 Å²	71.1	87%	0.872	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-27	173.7	-66.8	-173.8	-179.8	-174.1	0.4	113.3	N75 N98 Y102	N75-R100 PolarHBondContact ND2-O 2.92Å; N98-R100 PolarHBondContact O-N 3.19Å; R100-Y102 VanDerWaalsContact C-N 3.35Å
101	K	82.2	Confident	73.9	Confident	48 Å²	48	72 Å²	72	21%	0.209	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-28.1	178.1	-179.3	179.7	176.5	-153.9	0	112	N75 S76 D94 N98	N75-K101 VanDerWaalsContact CB-O 3.28Å; N75-K101 WeakPolarHBondContact CB-O 3.38Å; N75-K101 PolarHBondContact N-O 2.03Å; N75-K101 PolarHBondContact ND2-O 3.26Å; S76-K101 WeakPolarHBondContact OG-CE 3.25Å; D94-K101 IonicContact OD1-NZ 2.86Å; D94-K101 WeakPolarHBondContact OD2-CD 3.39Å; D94-K101 IonicContact OD2-NZ 3.68Å; D94-K101 PolarHBondContact OD2-NZ 3.28Å; N98-K101 HydrophobicContact CB-CB 4.04Å; N98-K101 WeakPolarHBondContact O-CB 3.48Å; N98-K101 PolarHBondContact O-N 2.62Å; N98-K101 WeakPolarHBondContact OD1-CB 3.49Å; N98-K101 PolarHBondContact OD1-N 2.64Å
102	Y	80.6	Confident	74.8	Confident	17 Å²	17	69.2 Å²	69.2	7%	0.067	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	122.8	-175.1	-62.3	-70.6	0	0	0	111.8	Y73 D74 I81 P92 D94 L95 A99 R100	Y73-Y102 CarbonylContact O-C 3.56Å; Y73-Y102 WeakPolarHBondContact O-CA 3.46Å; D74-Y102 HydrophobicContact CB-CD1 3.98Å; D74-Y102 HydrophobicContact CB-CE1 3.67Å; D74-Y102 WeakPolarHBondContact OD2-CE1 3.34Å; D74-Y102 PolarHBondContact OD2-OH 2.71Å; I81-Y102 HydrophobicContact CD1-CE1 3.99Å; P92-Y102 HydrophobicContact CB-CD1 4.35Å; P92-Y102 HydrophobicContact CB-CD2 4.22Å; P92-Y102 HydrophobicContact CB-CE1 3.7Å; P92-Y102 HydrophobicContact CB-CE2 3.54Å; P92-Y102 WeakPolarHBondContact CB-OH 3.36Å; P92-Y102 HydrophobicContact CG-CD1 3.89Å; P92-Y102 HydrophobicContact CG-CE1 3.47Å; P92-Y102 VanDerWaalsContact CG-CE1 3.47Å; P92-Y102 HydrophobicContact CG-CE2 4.16Å; P92-Y102 HydrophobicContact CG-CG 4.41Å; D94-Y102 WeakPolarHBondContact OD1-CE2 3.49Å; D94-Y102 PolarHBondContact OD1-OH 3.04Å; L95-Y102 VanDerWaalsContact CD1-CB 3.49Å; L95-Y102 HydrophobicContact CD1-CD2 3.74Å; L95-Y102 HydrophobicContact CD1-CG 3.69Å; A99-Y102 VanDerWaalsContact O-O 3.06Å; R100-Y102 VanDerWaalsContact C-N 3.35Å
103	T	76.2	Confident	75.8	Confident	61 Å²	61	72.6 Å²	72.6	37%	0.374	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.2	169.8	-53.4	0	0	0	0	108.7	Y72 Y73 N75 L105	Y72-T103 CarbonylContact C-O 3.58Å; Y72-T103 WeakPolarHBondContact CA-O 3.36Å; Y73-T103 PolarHBondContact N-O 2.93Å; Y73-T103 PolarHBondContact O-N 2.79Å; N75-T103 PolarHBondContact ND2-OG1 3.38Å; N75-T103 PolarHBondContact OD1-OG1 3.28Å; T103-L105 HydrophobicContact CG2-CD2 4.15Å; T103-L105 PolarHBondContact O-N 1.98Å
104	I	74	Confident	76.7	Confident	117 Å²	117	68.1 Å²	68.1	60%	0.6	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	119.2	174	-49.4	-172.8	0	0	0	107.7	Y72	Y72-I104 HydrophobicContact CD1-CB 4.49Å; Y72-I104 HydrophobicContact CD1-CG1 3.96Å; Y72-I104 HydrophobicContact CE1-CB 4.38Å; Y72-I104 HydrophobicContact CE1-CD1 4.06Å; Y72-I104 HydrophobicContact CE1-CG1 3.66Å; Y72-I104 HydrophobicContact CE1-CG2 4.29Å
105	L	65	Low	77.1	Confident	43 Å²	43	69.6 Å²	69.6	23%	0.225	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-18.3	178.6	-62.9	-176.5	0	0	0	112.6	R71 N80 T103	R71-L105 HydrophobicContact CB-CB 4.27Å; R71-L105 HydrophobicContact CG-CB 4.2Å; R71-L105 HydrophobicContact CG-CD1 4Å; R71-L105 WeakPolarHBondContact O-CB 3.26Å; R71-L105 PolarHBondContact O-N 2.98Å; N80-L105 WeakPolarHBondContact OD1-CD1 3.45Å; T103-L105 HydrophobicContact CG2-CD2 4.15Å; T103-L105 PolarHBondContact O-N 1.98Å
106	G	62	Low	77.7	Confident	18 Å²	18	69.1 Å²	69.1	19%	0.186	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.1	-175.9	172.7	0	0	0	0	0	113.9	S70 R71	S70-G106 WeakPolarHBondContact CA-O 3.4Å; R71-G106 PolarHBondContact N-O 3.23Å; R71-G106 PolarHBondContact O-N 1.97Å
107	P	65.1	Low	78.3	Confident	67 Å²	67	67.4 Å²	67.4	44%	0.435	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	147.5	176.2	29.8	-34.4	0	0	0	111.1
108	V	67	Low	78.8	Confident	7 Å²	7	57 Å²	57	4%	0.042	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-41.5	175.9	179.9	0	0	0	0	110.4	V69 R71 L82 M177	V69-V108 HydrophobicContact CB-CB 4.29Å; V69-V108 HydrophobicContact CG1-CB 4.17Å; V69-V108 HydrophobicContact CG1-CG2 4.44Å; V69-V108 PolarHBondContact O-N 2.9Å; R71-V108 HydrophobicContact CB-CG2 3.53Å; L82-V108 HydrophobicContact CD2-CG2 4.07Å; V108-M177 HydrophobicContact CG1-CE 4.02Å; V108-M177 HydrophobicContact CG1-SD 3.34Å; V108-M177 WeakPolarHBondContact CG1-SD 3.45Å
109	G	73.7	Confident	78.8	Confident	20 Å²	20	59.9 Å²	59.9	21%	0.206	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.1	-156.9	-175.7	0	0	0	0	0	111.4	V69	V69-G109 PolarHBondContact N-O 3Å
110	S	84.3	Confident	79.3	Confident	35 Å²	35	57.5 Å²	57.5	25%	0.245	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.1	173	66.3	0	0	0	0	111.2	I67	I67-S110 CarbonylContact O-C 3.59Å; I67-S110 VanDerWaalsContact O-CA 3.25Å; I67-S110 WeakPolarHBondContact O-CA 3.4Å; I67-S110 WeakPolarHBondContact O-CB 3.49Å
111	V	90	Very high	79.4	Confident	22 Å²	22	46.6 Å²	46.6	13%	0.133	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	161.1	175.8	-60.2	0	0	0	0	109.4	R66 I67 V69 F84 I127	R66-V111 CarbonylContact C-O 3.58Å; R66-V111 WeakPolarHBondContact CA-O 3.25Å; R66-V111 WeakPolarHBondContact CB-O 3.06Å; I67-V111 HydrophobicContact CD1-CG2 4.09Å; I67-V111 HydrophobicContact CG1-CG2 3.65Å; I67-V111 PolarHBondContact N-O 2.84Å; I67-V111 PolarHBondContact O-N 3.1Å; V69-V111 HydrophobicContact CG2-CB 4.38Å; V69-V111 HydrophobicContact CG2-CG1 3.77Å; V69-V111 HydrophobicContact CG2-CG2 3.85Å; F84-V111 HydrophobicContact CD1-CG2 3.68Å; F84-V111 HydrophobicContact CE1-CG1 4.36Å; F84-V111 HydrophobicContact CE1-CG2 3.79Å; V111-I127 HydrophobicContact CB-CD1 3.91Å; V111-I127 HydrophobicContact CG1-CD1 3.59Å; V111-I127 HydrophobicContact CG2-CD1 4.25Å
112	V	92.4	Very high	79.1	Confident	5 Å²	5	49 Å²	49	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	142.2	174.3	174.8	0	0	0	0	109.5	P61 D65 A116 V118 L124 G162 Q163	P61-V112 HydrophobicContact CB-CG2 3.6Å; P61-V112 HydrophobicContact CG-CG2 3.38Å; D65-V112 CarbonylContact O-C 3.48Å; D65-V112 WeakPolarHBondContact O-CA 3.49Å; V112-A116 HydrophobicContact CG1-CB 3.85Å; V112-V118 HydrophobicContact CG1-CG2 3.94Å; V112-V118 HydrophobicContact CG2-CG2 4.43Å; V112-L124 HydrophobicContact CB-CD1 4.29Å; V112-L124 HydrophobicContact CB-CD2 4.26Å; V112-L124 HydrophobicContact CG1-CD1 4.03Å; V112-L124 HydrophobicContact CG2-CD1 4.06Å; V112-L124 HydrophobicContact CG2-CD2 3.83Å; V112-G162 CarbonylContact O-C 3.56Å; V112-G162 WeakPolarHBondContact O-CA 3.48Å; V112-Q163 HydrophobicContact CB-CB 4.07Å; V112-Q163 HydrophobicContact CG1-CB 4.42Å; V112-Q163 PolarHBondContact N-O 2.99Å; V112-Q163 PolarHBondContact O-N 2.85Å
113	K	92.4	Very high	78.8	Confident	87 Å²	87	51.5 Å²	51.5	38%	0.378	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-55.8	145.2	178.4	-75.2	168.4	-177.8	177.7	0	111.3	G64 D65 R66 I67 G115 A116 Q163	G64-K113 WeakPolarHBondContact O-CE 3.41Å; G64-K113 PolarHBondContact O-NZ 3.33Å; D65-K113 WeakPolarHBondContact O-CB 3.29Å; D65-K113 WeakPolarHBondContact O-CG 3.27Å; D65-K113 PolarHBondContact O-N 3.24Å; R66-K113 WeakPolarHBondContact O-CE 3.46Å; I67-K113 HydrophobicContact CB-CG 4.49Å; I67-K113 HydrophobicContact CG1-CG 4.44Å; I67-K113 HydrophobicContact CG2-CD 4.27Å; I67-K113 HydrophobicContact CG2-CG 3.53Å; K113-G115 PolarHBondContact O-N 2.55Å; K113-A116 HydrophobicContact CB-CB 3.98Å; K113-A116 PolarHBondContact O-N 2.87Å; K113-Q163 PolarHBondContact O-NE2 3.36Å
114	P	91	Very high	79.3	Confident	47 Å²	47	50 Å²	50	31%	0.305	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	129.9	170.6	-24.4	32.9	0	0	0	111.4	I87 A116 I160	I87-P114 HydrophobicContact CD1-CG 3.93Å; P114-A116 PolarHBondContact O-N 2.99Å; P114-A116 VanDerWaalsContact O-N 3.16Å; P114-I160 HydrophobicContact CB-CG2 4.24Å
115	G	85	Confident	79.8	Confident	70 Å²	70	46.9 Å²	46.9	72%	0.722	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	-4.7	176.7	0	0	0	0	0	116.2	K113 T117	K113-G115 PolarHBondContact O-N 2.55Å; G115-T117 PolarHBondContact O-N 3.15Å
116	A	87.2	Confident	81.1	Confident	20 Å²	20	46.4 Å²	46.4	17%	0.165	30%	0.301	C	S	.	.			trans	-66.5	127.2	173.5	0	0	0	0	0	110.4	V112 K113 P114 Q163	V112-A116 HydrophobicContact CG1-CB 3.85Å; K113-A116 HydrophobicContact CB-CB 3.98Å; K113-A116 PolarHBondContact O-N 2.87Å; P114-A116 PolarHBondContact O-N 2.99Å; P114-A116 VanDerWaalsContact O-N 3.16Å; A116-Q163 PolarHBondContact O-NE2 3.22Å
117	T	82.4	Confident	82.6	Confident	123 Å²	123	46.1 Å²	46.1	76%	0.755	30%	0.296	S	S	*	.			trans	-90.5	120.9	173.3	53.1	0	0	0	0	109	G115 P119	G115-T117 PolarHBondContact O-N 3.15Å; T117-P119 WeakPolarHBondContact O-CD 3.35Å
118	V	83.4	Confident	83.9	Confident	13 Å²	13	46.1 Å²	46.1	8%	0.079	29%	0.287	C	S	.	.			trans	-112.4	94.4	174.8	-176.4	0	0	0	0	106.9	P61 V112 G120 C121 L124	P61-V118 HydrophobicContact CB-CG1 4.06Å; P61-V118 HydrophobicContact CB-CG2 4Å; P61-V118 HydrophobicContact CG-CG1 4.19Å; P61-V118 HydrophobicContact CG-CG2 4.38Å; V112-V118 HydrophobicContact CG1-CG2 3.94Å; V112-V118 HydrophobicContact CG2-CG2 4.43Å; V118-G120 PolarHBondContact O-N 3.29Å; V118-C121 HydrophobicContact CB-CB 4.21Å; V118-C121 HydrophobicContact CG1-CB 3.89Å; V118-C121 CarbonylContact O-C 3.56Å; V118-C121 PolarHBondContact O-N 3.08Å; V118-L124 HydrophobicContact CB-CD1 3.82Å; V118-L124 HydrophobicContact CG2-CD1 3.8Å
119	P	77.2	Confident	85.1	Confident	127 Å²	127	45.9 Å²	45.9	83%	0.825	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.4	-174.4	-26.7	34.7	0	0	0	113.2	T117 C121	T117-P119 WeakPolarHBondContact O-CD 3.35Å; P119-C121 VanDerWaalsContact C-N 3.29Å; P119-C121 PolarHBondContact O-N 3.27Å
120	G	77.8	Confident	85.9	Confident	29 Å²	29	44.9 Å²	44.9	30%	0.299	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-10.8	176.7	0	0	0	0	0	114.6	G58 T59 V118	G58-G120 CarbonylContact C-O 3.36Å; G58-G120 VanDerWaalsContact C-O 3.28Å; G58-G120 WeakPolarHBondContact CA-O 3.44Å; T59-G120 PolarHBondContact N-O 2.93Å; T59-G120 VanDerWaalsContact OG1-CA 3.31Å; T59-G120 WeakPolarHBondContact OG1-CA 3.47Å; V118-G120 PolarHBondContact O-N 3.29Å
121	C	78.2	Confident	86.1	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.02	27%	0.27	C	S	.	.			trans	-127.8	82.1	-177.9	-178.9	0	0	0	0	111.4	V118 P119 Y123 L124 C171	V118-C121 HydrophobicContact CB-CB 4.21Å; V118-C121 HydrophobicContact CG1-CB 3.89Å; V118-C121 CarbonylContact O-C 3.56Å; V118-C121 PolarHBondContact O-N 3.08Å; P119-C121 VanDerWaalsContact C-N 3.29Å; P119-C121 PolarHBondContact O-N 3.27Å; C121-Y123 PolarHBondContact O-N 2.94Å; C121-L124 HydrophobicContact CB-CD1 4.27Å; C121-L124 HydrophobicContact CB-CG 4.2Å; C121-L124 WeakPolarHBondContact SG-CG 3.4Å; C121-C171 WeakPolarHBondContact CA-SG 2.85Å; C121-C171 HydrophobicContact CB-CB 3.72Å; C121-C171 WeakPolarHBondContact CB-SG 3.41Å; C121-C171 WeakPolarHBondContact SG-CB 3.43Å; C121-C171 CovalentContact SG-SG 1.98Å; C121-C171 PolarHBondContact SG-SG 3.26Å
122	P	75.2	Confident	85.9	Confident	99 Å²	99	45.2 Å²	45.2	64%	0.643	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-8.7	-175.4	30.6	-36	0	0	0	113.8
123	Y	76.3	Confident	85.3	Confident	68 Å²	68	50.6 Å²	50.6	27%	0.267	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	4.3	-175.1	-53	-75.5	0	0	0	113.7	C121 K125 I170 A493	C121-Y123 PolarHBondContact O-N 2.94Å; Y123-K125 PolarHBondContact O-N 2.82Å; Y123-I170 VanDerWaalsContact CB-CG2 3.42Å; Y123-I170 HydrophobicContact CD2-CG2 3.48Å; Y123-I170 VanDerWaalsContact CD2-CG2 3.48Å; Y123-I170 HydrophobicContact CE2-CG2 4.42Å; Y123-I170 HydrophobicContact CG-CG2 3.6Å; Y123-A493 HydrophobicContact CE1-CB 4.42Å
124	L	85.5	Confident	84.5	Confident	31 Å²	31	50.2 Å²	50.2	16%	0.162	32%	0.323	C	S	.	.			trans	-62.3	130	176.6	-71.5	172.3	0	0	0	110.6	V112 V118 C121 Q163 V165	V112-L124 HydrophobicContact CB-CD1 4.29Å; V112-L124 HydrophobicContact CB-CD2 4.26Å; V112-L124 HydrophobicContact CG1-CD1 4.03Å; V112-L124 HydrophobicContact CG2-CD1 4.06Å; V112-L124 HydrophobicContact CG2-CD2 3.83Å; V118-L124 HydrophobicContact CB-CD1 3.82Å; V118-L124 HydrophobicContact CG2-CD1 3.8Å; C121-L124 HydrophobicContact CB-CD1 4.27Å; C121-L124 HydrophobicContact CB-CG 4.2Å; C121-L124 WeakPolarHBondContact SG-CG 3.4Å; L124-Q163 HydrophobicContact CB-CB 4.24Å; L124-Q163 HydrophobicContact CD2-CB 4.25Å; L124-V165 HydrophobicContact CD2-CG1 4.21Å
125	K	84.8	Confident	83.5	Confident	50 Å²	50	49.2 Å²	49.2	22%	0.217	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.8	171	-68.7	-169.1	178.2	-177.1	0	110.1	Y123 I142 Q163 A164 T166	Y123-K125 PolarHBondContact O-N 2.82Å; K125-I142 HydrophobicContact CB-CB 4.38Å; K125-Q163 CarbonylContact O-C 3.49Å; K125-Q163 WeakPolarHBondContact O-CA 3.29Å; K125-Q163 WeakPolarHBondContact O-CB 3.45Å; K125-A164 PolarHBondContact N-O 3.26Å; K125-A164 PolarHBondContact O-N 3.45Å; K125-T166 HydrophobicContact CD-CG2 4.08Å
126	P	92.7	Very high	83.2	Confident	33 Å²	33	51.3 Å²	51.3	21%	0.214	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	136.9	177.7	28.1	-34.2	0	0	0	111	I160	P126-I160 HydrophobicContact CB-CD1 3.76Å; P126-I160 HydrophobicContact CB-CG1 3.97Å; P126-I160 HydrophobicContact CB-CG2 3.77Å; P126-I160 HydrophobicContact CG-CD1 4.49Å
127	I	93.7	Very high	82.8	Confident	13 Å²	13	51.7 Å²	51.7	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	110.6	168.5	-51.2	169	0	0	0	107.2	F84 V111 L141 I142 I160 V161 G162 A164	F84-I127 HydrophobicContact CE1-CD1 4.13Å; V111-I127 HydrophobicContact CB-CD1 3.91Å; V111-I127 HydrophobicContact CG1-CD1 3.59Å; V111-I127 HydrophobicContact CG2-CD1 4.25Å; I127-L141 CarbonylContact C-O 3.58Å; I127-L141 WeakPolarHBondContact CA-O 3.18Å; I127-I142 HydrophobicContact CB-CG2 4.16Å; I127-I142 HydrophobicContact CG1-CG2 3.6Å; I127-I142 HydrophobicContact CG2-CG2 4.45Å; I127-I160 WeakPolarHBondContact O-CA 3.43Å; I127-V161 HydrophobicContact CB-CG2 4.05Å; I127-V161 HydrophobicContact CG2-CG2 3.81Å; I127-V161 WeakPolarHBondContact O-CG2 3.46Å; I127-V161 PolarHBondContact O-N 3.31Å; I127-G162 PolarHBondContact N-O 2.05Å; I127-A164 HydrophobicContact CD1-CB 3.81Å; I127-A164 HydrophobicContact CG1-CB 3.94Å
128	R	92.2	Very high	82.9	Confident	66 Å²	66	46.3 Å²	46.3	25%	0.249	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.2	172.5	-68.1	-161.5	-170	-118.1	0.4	111.7	L130 Y140 L141 E144 I147 D157 I160	R128-L130 HydrophobicContact CB-CD2 4.43Å; R128-Y140 WeakPolarHBondContact O-CA 3.34Å; R128-L141 PolarHBondContact N-O 3.29Å; R128-L141 PolarHBondContact O-N 3.42Å; R128-E144 IonicContact NE-OE2 3.16Å; R128-I147 HydrophobicContact CB-CD1 3.91Å; R128-I147 HydrophobicContact CB-CG1 4.28Å; R128-I147 HydrophobicContact CG-CD1 3.86Å; R128-D157 IonicContact CZ-OD2 3.62Å; R128-D157 IonicContact NH1-OD2 3.06Å; R128-D157 PolarHBondContact NH1-OD2 2.93Å; R128-I160 HydrophobicContact CG-CG1 4.3Å
129	H	92.7	Very high	83	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	109.6	172.7	177.5	-169.5	0	0	0	109.6	N138 L139 Y140 R158 G159 V161	H129-N138 PolarHBondContact NE2-OD1 2.97Å; H129-L139 WeakPolarHBondContact CA-O 3.22Å; H129-Y140 HydrophobicContact CB-CD1 4.07Å; H129-Y140 HydrophobicContact CB-CE1 4.07Å; H129-Y140 AromaticContact CD2-CE1 3.68Å; H129-Y140 AromaticContact CG-CE1 3.68Å; H129-R158 HydrophobicContact CB-CB 4.13Å; H129-R158 VanDerWaalsContact CE1-CD 3.45Å; H129-R158 WeakPolarHBondContact CE1-CD 3.46Å; H129-R158 WeakPolarHBondContact O-CA 3.38Å; H129-R158 WeakPolarHBondContact O-CB 3.4Å; H129-R158 PolarHBondContact O-N 2.99Å; H129-G159 PolarHBondContact N-O 3.1Å; H129-V161 HydrophobicContact CB-CG1 3.69Å; H129-V161 HydrophobicContact CB-CG2 4.47Å
130	L	90.3	Very high	83.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	142.3	174.1	-54.2	-169.6	0	0	0	110.8	R128 L139 L141 R150 L151 M155 L156 D157	R128-L130 HydrophobicContact CB-CD2 4.43Å; L130-L139 HydrophobicContact CB-CB 4.47Å; L130-L139 PolarHBondContact N-O 2.85Å; L130-L139 PolarHBondContact O-N 2.96Å; L130-L141 HydrophobicContact CD1-CD1 3.68Å; L130-L141 HydrophobicContact CG-CD1 4.33Å; L130-R150 HydrophobicContact CD1-CB 3.37Å; L130-R150 HydrophobicContact CD1-CG 4.02Å; L130-L151 HydrophobicContact CD1-CD2 4.5Å; L130-L151 HydrophobicContact CD2-CD2 3.77Å; L130-L151 HydrophobicContact CD2-CG 4.48Å; L130-M155 HydrophobicContact CB-CB 4.38Å; L130-M155 HydrophobicContact CB-CE 3.76Å; L130-M155 HydrophobicContact CB-SD 4.42Å; L130-L156 CarbonylContact C-O 3.6Å; L130-L156 WeakPolarHBondContact CA-O 3.21Å; L130-D157 HydrophobicContact CD2-CB 4.13Å
131	Y	88	Confident	84.1	Confident	34 Å²	34	39.3 Å²	39.3	13%	0.133	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.8	179.6	-178.1	-103.3	0	0	0	112.1	L133 Q137 N138 L156	Y131-L133 HydrophobicContact CD1-CD2 4.4Å; Y131-L133 HydrophobicContact CD1-CG 4.49Å; Y131-L133 HydrophobicContact CE1-CD2 3.92Å; Y131-L133 HydrophobicContact CE1-CG 4.34Å; Y131-Q137 WeakPolarHBondContact CA-O 3.16Å; Y131-Q137 VanDerWaalsContact CD2-O 3.25Å; Y131-Q137 WeakPolarHBondContact CD2-O 3.42Å; Y131-N138 WeakPolarHBondContact CD2-OD1 3.21Å; Y131-L156 HydrophobicContact CD1-CD1 4.41Å; Y131-L156 PolarHBondContact N-O 3.07Å; Y131-L156 PolarHBondContact O-N 3.02Å
132	S	85	Confident	84.5	Confident	30 Å²	30	41 Å²	41	21%	0.21	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	118.2	171.5	176.9	0	0	0	0	110.1	G135 K136 Q137	S132-G135 PolarHBondContact OG-N 3.41Å; S132-G135 VanDerWaalsContact OG-N 3.08Å; S132-K136 VanDerWaalsContact O-CA 3.27Å; S132-K136 WeakPolarHBondContact O-CA 3.38Å; S132-K136 PolarHBondContact O-N 3.05Å; S132-Q137 PolarHBondContact N-O 2.81Å; S132-Q137 PolarHBondContact O-N 2.85Å
133	L	80.4	Confident	84.6	Confident	118 Å²	118	37.4 Å²	37.4	62%	0.618	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-43.6	173.7	-75.9	166.4	0	0	0	111.6	Y131 L156	Y131-L133 HydrophobicContact CD1-CD2 4.4Å; Y131-L133 HydrophobicContact CD1-CG 4.49Å; Y131-L133 HydrophobicContact CE1-CD2 3.92Å; Y131-L133 HydrophobicContact CE1-CG 4.34Å; L133-L156 HydrophobicContact CD1-CD1 3.83Å; L133-L156 HydrophobicContact CD1-CG 4.25Å; L133-L156 HydrophobicContact CD2-CD1 4.09Å; L133-L156 HydrophobicContact CG-CD1 3.81Å; L133-L156 HydrophobicContact CG-CG 4.37Å
134	G	75.1	Confident	84.6	Confident	79 Å²	79	37.2 Å²	37.2	81%	0.814	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-42	-178.4	0	0	0	0	0	113
135	G	70.9	Confident	83.7	Confident	26 Å²	26	37.1 Å²	37.1	27%	0.268	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-13.6	179	0	0	0	0	0	114.3	S132 Q137 N186	S132-G135 PolarHBondContact OG-N 3.41Å; S132-G135 VanDerWaalsContact OG-N 3.08Å; G135-Q137 VanDerWaalsContact C-N 3.3Å; G135-Q137 PolarHBondContact O-N 2.63Å; G135-N186 VanDerWaalsContact O-CG 3.31Å; G135-N186 PolarHBondContact O-ND2 2.84Å; G135-N186 PolarHBondContact O-OD1 3.34Å
136	K	77.7	Confident	83.2	Confident	114 Å²	114	35 Å²	35	50%	0.496	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	52.1	-168.3	-58.8	-176.2	-179.2	179.8	0	111.6	I77 S132 N186	I77-K136 HydrophobicContact CB-CB 4.16Å; I77-K136 HydrophobicContact CB-CD 4.34Å; I77-K136 HydrophobicContact CG2-CB 4.27Å; I77-K136 HydrophobicContact CG2-CD 3.83Å; S132-K136 VanDerWaalsContact O-CA 3.27Å; S132-K136 WeakPolarHBondContact O-CA 3.38Å; S132-K136 PolarHBondContact O-N 3.05Å; K136-N186 PolarHBondContact O-ND2 3.13Å
137	Q	79.4	Confident	82.8	Confident	27 Å²	27	33.5 Å²	33.5	13%	0.126	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.4	-167	178.1	-178.6	9.7	0	0	111.3	Y131 S132 G135 N186	Y131-Q137 WeakPolarHBondContact CA-O 3.16Å; Y131-Q137 VanDerWaalsContact CD2-O 3.25Å; Y131-Q137 WeakPolarHBondContact CD2-O 3.42Å; S132-Q137 PolarHBondContact N-O 2.81Å; S132-Q137 PolarHBondContact O-N 2.85Å; G135-Q137 VanDerWaalsContact C-N 3.3Å; G135-Q137 PolarHBondContact O-N 2.63Å; Q137-N186 HydrophobicContact CB-CB 4.2Å; Q137-N186 HydrophobicContact CG-CB 3.99Å
138	N	84.8	Confident	82.2	Confident	10 Å²	10	36.9 Å²	36.9	5%	0.053	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134	170.9	-57.5	-75.8	0	0	0	109.6	N80 H129 Y131 Y140	N80-N138 PolarHBondContact O-ND2 3.39Å; H129-N138 PolarHBondContact NE2-OD1 2.97Å; Y131-N138 WeakPolarHBondContact CD2-OD1 3.21Å; N138-Y140 HydrophobicContact CB-CE2 3.83Å
139	L	85.9	Confident	81.3	Confident	5 Å²	5	34 Å²	34	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.6	169	-68.4	-179	0	0	0	109	H129 L130 L141 M155 V187	H129-L139 WeakPolarHBondContact CA-O 3.22Å; L130-L139 HydrophobicContact CB-CB 4.47Å; L130-L139 PolarHBondContact N-O 2.85Å; L130-L139 PolarHBondContact O-N 2.96Å; L139-L141 HydrophobicContact CB-CD2 4.36Å; L139-L141 HydrophobicContact CB-CG 4.22Å; L139-M155 HydrophobicContact CB-CE 4.28Å; L139-M155 HydrophobicContact CD1-CE 3.77Å; L139-M155 HydrophobicContact CD1-SD 3.99Å; L139-M155 HydrophobicContact CG-CE 4.06Å; L139-V187 HydrophobicContact CD2-CB 4.11Å; L139-V187 HydrophobicContact CD2-CG1 4.2Å
140	Y	90.5	Very high	80.9	Confident	15 Å²	15	35.1 Å²	35.1	6%	0.059	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	109.2	175.8	-54.8	-87.5	0	0	0	107.8	L82 F84 R128 H129 N138 V161 Q189	L82-Y140 HydrophobicContact CB-CD1 4.5Å; L82-Y140 HydrophobicContact CB-CD2 4Å; L82-Y140 HydrophobicContact CB-CE1 4.12Å; L82-Y140 HydrophobicContact CB-CE2 3.6Å; L82-Y140 HydrophobicContact CB-CG 4.43Å; L82-Y140 HydrophobicContact CD1-CD2 3.54Å; L82-Y140 HydrophobicContact CD1-CE2 3.99Å; L82-Y140 HydrophobicContact CD1-CG 3.94Å; L82-Y140 HydrophobicContact CG-CD2 3.73Å; L82-Y140 HydrophobicContact CG-CE2 3.61Å; L82-Y140 HydrophobicContact CG-CG 4.44Å; L82-Y140 PolarHBondContact N-OH 2.89Å; L82-Y140 PolarHBondContact O-OH 3.03Å; F84-Y140 HydrophobicContact CD2-CE1 4.49Å; F84-Y140 AromaticContact CE2-CD1 3.69Å; F84-Y140 HydrophobicContact CE2-CD1 3.69Å; F84-Y140 AromaticContact CE2-CE1 3.64Å; F84-Y140 HydrophobicContact CE2-CE1 3.64Å; F84-Y140 HydrophobicContact CE2-CG 4.49Å; F84-Y140 HydrophobicContact CZ-CD1 4.05Å; F84-Y140 HydrophobicContact CZ-CE1 4.45Å; R128-Y140 WeakPolarHBondContact O-CA 3.34Å; H129-Y140 HydrophobicContact CB-CD1 4.07Å; H129-Y140 HydrophobicContact CB-CE1 4.07Å; H129-Y140 AromaticContact CD2-CE1 3.68Å; H129-Y140 AromaticContact CG-CE1 3.68Å; N138-Y140 HydrophobicContact CB-CE2 3.83Å; Y140-V161 HydrophobicContact CD1-CG2 4.11Å; Y140-Q189 PolarHBondContact O-NE2 3.3Å
141	L	87.3	Confident	80.7	Confident	3 Å²	3	38 Å²	38	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	146.5	-167.4	-57	-179.1	0	0	0	111.1	I127 R128 L130 L139 E146 I147 R150	I127-L141 CarbonylContact C-O 3.58Å; I127-L141 WeakPolarHBondContact CA-O 3.18Å; R128-L141 PolarHBondContact N-O 3.29Å; R128-L141 PolarHBondContact O-N 3.42Å; L130-L141 HydrophobicContact CD1-CD1 3.68Å; L130-L141 HydrophobicContact CG-CD1 4.33Å; L139-L141 HydrophobicContact CB-CD2 4.36Å; L139-L141 HydrophobicContact CB-CG 4.22Å; L141-E146 HydrophobicContact CD1-CG 3.91Å; L141-I147 HydrophobicContact CB-CD1 4.1Å; L141-I147 HydrophobicContact CB-CG1 3.62Å; L141-I147 HydrophobicContact CD1-CG1 4.07Å; L141-R150 HydrophobicContact CD1-CG 3.98Å
142	I	86.4	Confident	80.5	Confident	39 Å²	39	42.8 Å²	42.8	20%	0.2	24%	0.238	C	C	.	.			trans	-120.7	-11.2	173.4	59.9	173.8	0	0	0	112.9	K125 I127 E144 A164 V165 T166	K125-I142 HydrophobicContact CB-CB 4.38Å; I127-I142 HydrophobicContact CB-CG2 4.16Å; I127-I142 HydrophobicContact CG1-CG2 3.6Å; I127-I142 HydrophobicContact CG2-CG2 4.45Å; I142-E144 PolarHBondContact O-N 2.77Å; I142-A164 HydrophobicContact CG2-CB 4.36Å; I142-V165 WeakPolarHBondContact CD1-O 3.3Å; I142-T166 HydrophobicContact CD1-CG2 3.67Å; I142-T166 HydrophobicContact CG1-CG2 4.26Å
143	D	76.1	Confident	80.3	Confident	22 Å²	22	45.4 Å²	45.4	12%	0.118	25%	0.247	C	C	.	.			trans	-86.7	109.4	178.9	-178.1	65	0	0	0	108.7	F145 E146 I147 Y502	D143-F145 PolarHBondContact O-N 2.86Å; D143-E146 HydrophobicContact CB-CB 4.29Å; D143-E146 PolarHBondContact O-N 3.26Å; D143-E146 PolarHBondContact OD2-N 2.86Å; D143-I147 WeakPolarHBondContact O-CD1 3.27Å; D143-I147 VanDerWaalsContact O-CG1 3.27Å; D143-I147 WeakPolarHBondContact O-CG1 3.44Å; D143-I147 PolarHBondContact O-N 3.06Å; D143-Y502 PolarHBondContact OD2-OH 3.02Å
144	E	77.6	Confident	80.5	Confident	64 Å²	64	42.5 Å²	42.5	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-57.6	-33.5	-176.6	-67.4	-63.1	150.1	0	0	111.8	R128 I142 I147 D148	R128-E144 IonicContact NE-OE2 3.16Å; I142-E144 PolarHBondContact O-N 2.77Å; E144-I147 WeakPolarHBondContact O-CB 3.37Å; E144-I147 PolarHBondContact O-N 3.29Å; E144-D148 PolarHBondContact O-N 2.89Å
145	F	65.8	Low	81.2	Confident	29 Å²	29	39.6 Å²	39.6	13%	0.127	21%	0.211	C	C	.	.	H	α-helix	trans	-70.2	-45	-179.6	-176	-107.3	0	0	0	112.5	D143 I147 A149 Y502 Y517 V520 R521 F524	D143-F145 PolarHBondContact O-N 2.86Å; F145-I147 VanDerWaalsContact C-N 3.3Å; F145-I147 PolarHBondContact O-N 3.48Å; F145-A149 WeakPolarHBondContact O-CB 3.46Å; F145-A149 PolarHBondContact O-N 3.49Å; F145-Y502 HydrophobicContact CD1-CE1 4.3Å; F145-Y502 HydrophobicContact CD1-CE2 4.47Å; F145-Y502 AromaticContact CD1-CZ 3.94Å; F145-Y517 HydrophobicContact CD2-CD2 4.09Å; F145-Y517 AromaticContact CD2-CE2 3.52Å; F145-Y517 HydrophobicContact CD2-CE2 3.52Å; F145-Y517 AromaticContact CE2-CD2 3.62Å; F145-Y517 HydrophobicContact CE2-CD2 3.62Å; F145-Y517 AromaticContact CE2-CE2 3.11Å; F145-Y517 HydrophobicContact CE2-CE2 3.11Å; F145-Y517 AromaticContact CE2-CZ 3.72Å; F145-Y517 HydrophobicContact CZ-CD2 4.04Å; F145-Y517 AromaticContact CZ-CE2 3.96Å; F145-Y517 HydrophobicContact CZ-CE2 3.96Å; F145-V520 HydrophobicContact CD1-CG1 4.14Å; F145-V520 HydrophobicContact CE1-CB 3.8Å; F145-V520 HydrophobicContact CE1-CG1 3.41Å; F145-V520 VanDerWaalsContact CE1-CG1 3.41Å; F145-V520 HydrophobicContact CZ-CB 4.3Å; F145-V520 HydrophobicContact CZ-CG1 4.35Å; F145-R521 HydrophobicContact CE2-CB 4.12Å; F145-R521 HydrophobicContact CE2-CG 4.17Å; F145-R521 HydrophobicContact CZ-CB 3.61Å; F145-R521 HydrophobicContact CZ-CG 4.07Å; F145-F524 AromaticContact CD1-CD2 3.85Å; F145-F524 HydrophobicContact CD1-CD2 3.85Å; F145-F524 AromaticContact CD1-CE2 3.59Å; F145-F524 HydrophobicContact CD1-CE2 3.59Å; F145-F524 AromaticContact CE1-CD2 3.4Å; F145-F524 HydrophobicContact CE1-CD2 3.4Å; F145-F524 VanDerWaalsContact CE1-CD2 3.4Å; F145-F524 AromaticContact CE1-CE2 3.55Å; F145-F524 HydrophobicContact CE1-CE2 3.55Å; F145-F524 HydrophobicContact CZ-CD2 4.25Å
146	E	75.4	Confident	82.2	Confident	7 Å²	7	42.3 Å²	42.3	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-38.7	170.4	-177.6	167.7	-156.6	0	0	111.5	L141 D143 A149 R150 R179 F524 S533	L141-E146 HydrophobicContact CD1-CG 3.91Å; D143-E146 HydrophobicContact CB-CB 4.29Å; D143-E146 PolarHBondContact O-N 3.26Å; D143-E146 PolarHBondContact OD2-N 2.86Å; E146-A149 WeakPolarHBondContact O-CB 3.49Å; E146-R150 HydrophobicContact CG-CG 4.2Å; E146-R150 VanDerWaalsContact O-CG 3.25Å; E146-R150 WeakPolarHBondContact O-CG 3.33Å; E146-R150 PolarHBondContact O-N 3.2Å; E146-R150 IonicContact OE1-CZ 2.64Å; E146-R150 IonicContact OE1-NE 2.78Å; E146-R150 PolarHBondContact OE1-NE 2.94Å; E146-R150 IonicContact OE1-NH2 2.92Å; E146-R150 PolarHBondContact OE1-NH2 3.39Å; E146-R179 VanDerWaalsContact CD-NH1 3.29Å; E146-R179 IonicContact OE1-CZ 3.3Å; E146-R179 IonicContact OE1-NH1 3.55Å; E146-R179 PolarHBondContact OE1-NH1 3.22Å; E146-R179 IonicContact OE1-NH2 3.57Å; E146-R179 IonicContact OE2-CZ 2.81Å; E146-R179 IonicContact OE2-NH1 3.2Å; E146-R179 PolarHBondContact OE2-NH1 2.84Å; E146-R179 VanDerWaalsContact OE2-NH1 3.1Å; E146-R179 IonicContact OE2-NH2 2.9Å; E146-R179 PolarHBondContact OE2-NH2 3.48Å; E146-F524 HydrophobicContact CB-CE1 4.04Å; E146-F524 HydrophobicContact CB-CE2 4.45Å; E146-F524 HydrophobicContact CB-CZ 3.73Å; E146-F524 HydrophobicContact CG-CE1 3.57Å; E146-F524 HydrophobicContact CG-CZ 3.77Å; E146-S533 WeakPolarHBondContact OE1-CB 3.39Å; E146-S533 PolarHBondContact OE1-OG 3.05Å
147	I	84.3	Confident	82.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-56.3	176.9	-74.9	161.2	0	0	0	110.7	R128 L141 D143 E144 F145 A149 R150 L151	R128-I147 HydrophobicContact CB-CD1 3.91Å; R128-I147 HydrophobicContact CB-CG1 4.28Å; R128-I147 HydrophobicContact CG-CD1 3.86Å; L141-I147 HydrophobicContact CB-CD1 4.1Å; L141-I147 HydrophobicContact CB-CG1 3.62Å; L141-I147 HydrophobicContact CD1-CG1 4.07Å; D143-I147 WeakPolarHBondContact O-CD1 3.27Å; D143-I147 VanDerWaalsContact O-CG1 3.27Å; D143-I147 WeakPolarHBondContact O-CG1 3.44Å; D143-I147 PolarHBondContact O-N 3.06Å; E144-I147 WeakPolarHBondContact O-CB 3.37Å; E144-I147 PolarHBondContact O-N 3.29Å; F145-I147 VanDerWaalsContact C-N 3.3Å; F145-I147 PolarHBondContact O-N 3.48Å; I147-A149 VanDerWaalsContact C-N 3.28Å; I147-A149 PolarHBondContact O-N 2.81Å; I147-R150 PolarHBondContact O-N 2.88Å; I147-L151 HydrophobicContact CG2-CD1 3.98Å; I147-L151 HydrophobicContact CG2-CG 4.47Å; I147-L151 WeakPolarHBondContact O-CG 3.15Å; I147-L151 PolarHBondContact O-N 3.37Å
148	D	81	Confident	83.4	Confident	85 Å²	85	43.3 Å²	43.3	46%	0.455	22%	0.223	S	C	.	.	H	α-helix	trans	-56.8	-46	-177.2	-72.9	-20.2	0	0	0	110.9	E144 R150 L151 E152	E144-D148 PolarHBondContact O-N 2.89Å; D148-R150 PolarHBondContact O-N 3.01Å; D148-L151 WeakPolarHBondContact O-CB 3.2Å; D148-L151 PolarHBondContact O-N 3.35Å; D148-E152 WeakPolarHBondContact O-CG 3.39Å; D148-E152 PolarHBondContact O-N 2.91Å
149	A	72.6	Confident	83.7	Confident	5 Å²	5	44.2 Å²	44.2	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-55.8	-45.3	173.9	0	0	0	0	0	113.7	F145 E146 I147 L151 E152 Q153 F524	F145-A149 WeakPolarHBondContact O-CB 3.46Å; F145-A149 PolarHBondContact O-N 3.49Å; E146-A149 WeakPolarHBondContact O-CB 3.49Å; I147-A149 VanDerWaalsContact C-N 3.28Å; I147-A149 PolarHBondContact O-N 2.81Å; A149-L151 VanDerWaalsContact C-N 3.31Å; A149-L151 PolarHBondContact O-N 3.04Å; A149-E152 PolarHBondContact O-N 3.13Å; A149-Q153 WeakPolarHBondContact O-CG 3.25Å; A149-Q153 PolarHBondContact O-N 3.24Å; A149-Q153 VanDerWaalsContact O-N 3.09Å; A149-F524 HydrophobicContact CB-CB 3.44Å; A149-F524 VanDerWaalsContact CB-CB 3.44Å; A149-F524 HydrophobicContact CB-CD1 3.81Å; A149-F524 HydrophobicContact CB-CD2 4.1Å; A149-F524 HydrophobicContact CB-CG 3.52Å
150	R	83.7	Confident	84.1	Confident	26 Å²	26	47.5 Å²	47.5	10%	0.098	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-33.6	179.2	-70.5	-30.2	176.7	152	5.2	112.2	L130 L141 E146 I147 D148 Q153 M155	L130-R150 HydrophobicContact CD1-CB 3.37Å; L130-R150 HydrophobicContact CD1-CG 4.02Å; L141-R150 HydrophobicContact CD1-CG 3.98Å; E146-R150 HydrophobicContact CG-CG 4.2Å; E146-R150 VanDerWaalsContact O-CG 3.25Å; E146-R150 WeakPolarHBondContact O-CG 3.33Å; E146-R150 PolarHBondContact O-N 3.2Å; E146-R150 IonicContact OE1-CZ 2.64Å; E146-R150 IonicContact OE1-NE 2.78Å; E146-R150 PolarHBondContact OE1-NE 2.94Å; E146-R150 IonicContact OE1-NH2 2.92Å; E146-R150 PolarHBondContact OE1-NH2 3.39Å; I147-R150 PolarHBondContact O-N 2.88Å; D148-R150 PolarHBondContact O-N 3.01Å; R150-Q153 VanDerWaalsContact CD-OE1 3.3Å; R150-Q153 WeakPolarHBondContact O-CB 3.46Å; R150-Q153 PolarHBondContact O-N 3.47Å; R150-M155 HydrophobicContact CB-CB 4.4Å; R150-M155 HydrophobicContact CB-CG 4.27Å; R150-M155 HydrophobicContact CB-SD 3.69Å; R150-M155 HydrophobicContact CG-SD 3.85Å; R150-M155 VanDerWaalsContact O-CB 3.25Å; R150-M155 WeakPolarHBondContact O-CB 3.39Å; R150-M155 WeakPolarHBondContact O-CG 3.43Å; R150-M155 PolarHBondContact O-N 3.15Å; R150-M155 VanDerWaalsContact O-N 3.07Å
151	L	87.5	Confident	84.2	Confident	59 Å²	59	46.8 Å²	46.8	31%	0.309	25%	0.248	S	C	.	.	H	α-helix	trans	-67.3	-41.7	174.6	-64	176.2	0	0	0	111	L130 I147 D148 A149 Q153 G154 D157	L130-L151 HydrophobicContact CD1-CD2 4.5Å; L130-L151 HydrophobicContact CD2-CD2 3.77Å; L130-L151 HydrophobicContact CD2-CG 4.48Å; I147-L151 HydrophobicContact CG2-CD1 3.98Å; I147-L151 HydrophobicContact CG2-CG 4.47Å; I147-L151 WeakPolarHBondContact O-CG 3.15Å; I147-L151 PolarHBondContact O-N 3.37Å; D148-L151 WeakPolarHBondContact O-CB 3.2Å; D148-L151 PolarHBondContact O-N 3.35Å; A149-L151 VanDerWaalsContact C-N 3.31Å; A149-L151 PolarHBondContact O-N 3.04Å; L151-Q153 PolarHBondContact O-N 2.78Å; L151-G154 WeakPolarHBondContact O-CA 3.45Å; L151-G154 PolarHBondContact O-N 3.25Å; L151-D157 HydrophobicContact CD2-CB 3.77Å
152	E	83.8	Confident	84.5	Confident	136 Å²	136	46.7 Å²	46.7	64%	0.636	25%	0.248	S	C	*	.	H	α-helix	trans	-61.5	-31.9	173.2	-70.8	178.1	-178.9	0	0	112.7	D148 A149 G154	D148-E152 WeakPolarHBondContact O-CG 3.39Å; D148-E152 PolarHBondContact O-N 2.91Å; A149-E152 PolarHBondContact O-N 3.13Å; E152-G154 PolarHBondContact O-N 3Å
153	Q	79.4	Confident	84.8	Confident	85 Å²	85	46.2 Å²	46.2	40%	0.397	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-2.8	171.8	-69.5	-178.3	-21.5	0	0	114	A149 R150 L151 F524	A149-Q153 WeakPolarHBondContact O-CG 3.25Å; A149-Q153 PolarHBondContact O-N 3.24Å; A149-Q153 VanDerWaalsContact O-N 3.09Å; R150-Q153 VanDerWaalsContact CD-OE1 3.3Å; R150-Q153 WeakPolarHBondContact O-CB 3.46Å; R150-Q153 PolarHBondContact O-N 3.47Å; L151-Q153 PolarHBondContact O-N 2.78Å; Q153-F524 PolarHBondContact NE2-O 2.91Å
154	G	86.4	Confident	85.5	Confident	56 Å²	56	46.5 Å²	46.5	58%	0.577	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	17.7	180	0	0	0	0	0	114.7	L151 E152	L151-G154 WeakPolarHBondContact O-CA 3.45Å; L151-G154 PolarHBondContact O-N 3.25Å; E152-G154 PolarHBondContact O-N 3Å
155	M	88.8	Confident	85.6	Confident	19 Å²	19	44.5 Å²	44.5	9%	0.094	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-67.7	141.5	167.5	-64.9	-169.6	68.9	0	0	110.3	L130 L139 R150	L130-M155 HydrophobicContact CB-CB 4.38Å; L130-M155 HydrophobicContact CB-CE 3.76Å; L130-M155 HydrophobicContact CB-SD 4.42Å; L139-M155 HydrophobicContact CB-CE 4.28Å; L139-M155 HydrophobicContact CD1-CE 3.77Å; L139-M155 HydrophobicContact CD1-SD 3.99Å; L139-M155 HydrophobicContact CG-CE 4.06Å; R150-M155 HydrophobicContact CB-CB 4.4Å; R150-M155 HydrophobicContact CB-CG 4.27Å; R150-M155 HydrophobicContact CB-SD 3.69Å; R150-M155 HydrophobicContact CG-SD 3.85Å; R150-M155 VanDerWaalsContact O-CB 3.25Å; R150-M155 WeakPolarHBondContact O-CB 3.39Å; R150-M155 WeakPolarHBondContact O-CG 3.43Å; R150-M155 PolarHBondContact O-N 3.15Å; R150-M155 VanDerWaalsContact O-N 3.07Å
156	L	91	Very high	85.8	Confident	82 Å²	82	44.5 Å²	44.5	43%	0.429	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.5	177.4	-63.4	178	0	0	0	110.1	L130 Y131 L133	L130-L156 CarbonylContact C-O 3.6Å; L130-L156 WeakPolarHBondContact CA-O 3.21Å; Y131-L156 HydrophobicContact CD1-CD1 4.41Å; Y131-L156 PolarHBondContact N-O 3.07Å; Y131-L156 PolarHBondContact O-N 3.02Å; L133-L156 HydrophobicContact CD1-CD1 3.83Å; L133-L156 HydrophobicContact CD1-CG 4.25Å; L133-L156 HydrophobicContact CD2-CD1 4.09Å; L133-L156 HydrophobicContact CG-CD1 3.81Å; L133-L156 HydrophobicContact CG-CG 4.37Å
157	D	92.5	Very high	85.1	Confident	62 Å²	62	44.5 Å²	44.5	33%	0.332	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121	167.3	-162.2	-16.4	0	0	0	109.9	R128 L130 L151 G159	R128-D157 IonicContact CZ-OD2 3.62Å; R128-D157 IonicContact NH1-OD2 3.06Å; R128-D157 PolarHBondContact NH1-OD2 2.93Å; L130-D157 HydrophobicContact CD2-CB 4.13Å; L151-D157 HydrophobicContact CD2-CB 3.77Å; D157-G159 WeakPolarHBondContact OD1-CA 3.36Å; D157-G159 PolarHBondContact OD1-N 2.75Å
158	R	90.7	Very high	84.1	Confident	101 Å²	101	48.7 Å²	48.7	38%	0.381	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	6.7	174.9	-66.3	-171.5	169.9	-163.9	4.1	112.9	N89 H129	N89-R158 PolarHBondContact ND2-O 3.39Å; H129-R158 HydrophobicContact CB-CB 4.13Å; H129-R158 VanDerWaalsContact CE1-CD 3.45Å; H129-R158 WeakPolarHBondContact CE1-CD 3.46Å; H129-R158 WeakPolarHBondContact O-CA 3.38Å; H129-R158 WeakPolarHBondContact O-CB 3.4Å; H129-R158 PolarHBondContact O-N 2.99Å
159	G	92.1	Very high	83.3	Confident	28 Å²	28	46.9 Å²	46.9	29%	0.289	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	94.8	-176.4	175.7	0	0	0	0	0	113.9	H129 D157	H129-G159 PolarHBondContact N-O 3.1Å; D157-G159 WeakPolarHBondContact OD1-CA 3.36Å; D157-G159 PolarHBondContact OD1-N 2.75Å
160	I	92.9	Very high	83.1	Confident	75 Å²	75	46.7 Å²	46.7	39%	0.385	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	127.5	-179.3	-60.3	170.1	0	0	0	109.2	P114 P126 I127 R128 G162	P114-I160 HydrophobicContact CB-CG2 4.24Å; P126-I160 HydrophobicContact CB-CD1 3.76Å; P126-I160 HydrophobicContact CB-CG1 3.97Å; P126-I160 HydrophobicContact CB-CG2 3.77Å; P126-I160 HydrophobicContact CG-CD1 4.49Å; I127-I160 WeakPolarHBondContact O-CA 3.43Å; R128-I160 HydrophobicContact CG-CG1 4.3Å; I160-G162 VanDerWaalsContact CG2-O 3.32Å; I160-G162 WeakPolarHBondContact CG2-O 3.32Å
161	V	93.7	Very high	82.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-11.4	-176.3	-61.8	0	0	0	0	113.7	F84 I87 T90 I127 H129 Y140	F84-V161 HydrophobicContact CD1-CB 4.21Å; F84-V161 HydrophobicContact CD1-CG2 4.14Å; F84-V161 WeakPolarHBondContact CD1-O 3.24Å; F84-V161 HydrophobicContact CD2-CB 3.92Å; F84-V161 HydrophobicContact CD2-CG2 3.95Å; F84-V161 HydrophobicContact CE1-CB 4.37Å; F84-V161 HydrophobicContact CE1-CG2 3.78Å; F84-V161 HydrophobicContact CE2-CB 4.08Å; F84-V161 HydrophobicContact CE2-CG2 3.57Å; F84-V161 HydrophobicContact CG-CB 4Å; F84-V161 HydrophobicContact CG-CG2 4.23Å; F84-V161 HydrophobicContact CZ-CB 4.31Å; F84-V161 HydrophobicContact CZ-CG2 3.49Å; F84-V161 VanDerWaalsContact CZ-CG2 3.49Å; I87-V161 HydrophobicContact CG2-CG1 4.36Å; T90-V161 HydrophobicContact CG2-CB 4.01Å; T90-V161 HydrophobicContact CG2-CG1 3.43Å; T90-V161 VanDerWaalsContact CG2-CG1 3.43Å; I127-V161 HydrophobicContact CB-CG2 4.05Å; I127-V161 HydrophobicContact CG2-CG2 3.81Å; I127-V161 WeakPolarHBondContact O-CG2 3.46Å; I127-V161 PolarHBondContact O-N 3.31Å; H129-V161 HydrophobicContact CB-CG1 3.69Å; H129-V161 HydrophobicContact CB-CG2 4.47Å; Y140-V161 HydrophobicContact CD1-CG2 4.11Å
162	G	93.3	Very high	81.8	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.2	-167.3	174.6	0	0	0	0	0	111	V112 I127 I160	V112-G162 CarbonylContact O-C 3.56Å; V112-G162 WeakPolarHBondContact O-CA 3.48Å; I127-G162 PolarHBondContact N-O 2.05Å; I160-G162 VanDerWaalsContact CG2-O 3.32Å; I160-G162 WeakPolarHBondContact CG2-O 3.32Å
163	Q	92.6	Very high	81.2	Confident	29 Å²	29	41.1 Å²	41.1	14%	0.136	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.3	170	-52.4	172.6	66.4	0	0	109.7	V112 K113 A116 L124 K125	V112-Q163 HydrophobicContact CB-CB 4.07Å; V112-Q163 HydrophobicContact CG1-CB 4.42Å; V112-Q163 PolarHBondContact N-O 2.99Å; V112-Q163 PolarHBondContact O-N 2.85Å; K113-Q163 PolarHBondContact O-NE2 3.36Å; A116-Q163 PolarHBondContact O-NE2 3.22Å; L124-Q163 HydrophobicContact CB-CB 4.24Å; L124-Q163 HydrophobicContact CD2-CB 4.25Å; K125-Q163 CarbonylContact O-C 3.49Å; K125-Q163 WeakPolarHBondContact O-CA 3.29Å; K125-Q163 WeakPolarHBondContact O-CB 3.45Å
164	A	89.7	Confident	80.5	Confident	28 Å²	28	40.2 Å²	40.2	23%	0.231	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	-179.1	179	0	0	0	0	0	110.5	K125 I127 I142	K125-A164 PolarHBondContact N-O 3.26Å; K125-A164 PolarHBondContact O-N 3.45Å; I127-A164 HydrophobicContact CD1-CB 3.81Å; I127-A164 HydrophobicContact CG1-CB 3.94Å; I142-A164 HydrophobicContact CG2-CB 4.36Å
165	V	80.3	Confident	79.4	Confident	22 Å²	22	40.1 Å²	40.1	13%	0.133	22%	0.221	C	C	.	.			trans	-114.6	157	178.9	-61.9	0	0	0	0	110.2	L124 I142 G167 I170 C171 A173	L124-V165 HydrophobicContact CD2-CG1 4.21Å; I142-V165 WeakPolarHBondContact CD1-O 3.3Å; V165-G167 WeakPolarHBondContact CG2-O 3.07Å; V165-I170 HydrophobicContact CB-CB 3.96Å; V165-I170 HydrophobicContact CB-CG2 3.92Å; V165-I170 HydrophobicContact CG1-CB 4.24Å; V165-I170 HydrophobicContact CG1-CG2 3.77Å; V165-I170 HydrophobicContact CG2-CB 4Å; V165-I170 HydrophobicContact CG2-CG2 4.44Å; V165-I170 WeakPolarHBondContact CG2-O 3.26Å; V165-C171 HydrophobicContact CG1-CB 4.34Å; V165-A173 HydrophobicContact CG2-CB 3.36Å
166	T	69.8	Low	78.2	Confident	29 Å²	29	40.7 Å²	40.7	18%	0.178	23%	0.229	C	C	.	.	S	Bend	trans	-84.4	-14.2	-176.7	49.4	0	0	0	0	114.7	K125 I142 Y492	K125-T166 HydrophobicContact CD-CG2 4.08Å; I142-T166 HydrophobicContact CD1-CG2 3.67Å; I142-T166 HydrophobicContact CG1-CG2 4.26Å; T166-Y492 WeakPolarHBondContact OG1-CB 3.37Å; T166-Y492 PolarHBondContact OG1-N 2.81Å
167	G	62	Low	77.1	Confident	7 Å²	7	40.6 Å²	40.6	7%	0.072	23%	0.227	C	C	.	.	S	Bend	trans	-132.9	153.5	-170.8	0	0	0	0	0	112.6	V165	V165-G167 WeakPolarHBondContact CG2-O 3.07Å
168	H	62.6	Low	75.6	Confident	88 Å²	88	39.6 Å²	39.6	41%	0.407	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	140.2	177.4	-173.7	54.7	0	0	0	110.8	I170 A173 M494	H168-I170 PolarHBondContact O-N 3.18Å; H168-A173 PolarHBondContact ND1-O 2.92Å; H168-M494 WeakPolarHBondContact O-CE 3.46Å
169	M	64.4	Low	74.3	Confident	47 Å²	47	37 Å²	37	23%	0.232	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	-4.9	179.9	-59	-61.9	-67.9	0	0	116.8	C171 N172 A173 T174	M169-C171 PolarHBondContact O-N 3.37Å; M169-N172 PolarHBondContact O-N 2.86Å; M169-N172 VanDerWaalsContact O-N 3.07Å; M169-A173 PolarHBondContact N-O 3.11Å; M169-T174 HydrophobicContact SD-CG2 4.09Å
170	I	67.7	Low	72.5	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-62.6	125.9	167.4	-58.6	-177.8	0	0	0	107.8	Y123 V165 H168 N172 A173 M494	Y123-I170 VanDerWaalsContact CB-CG2 3.42Å; Y123-I170 HydrophobicContact CD2-CG2 3.48Å; Y123-I170 VanDerWaalsContact CD2-CG2 3.48Å; Y123-I170 HydrophobicContact CE2-CG2 4.42Å; Y123-I170 HydrophobicContact CG-CG2 3.6Å; V165-I170 HydrophobicContact CB-CB 3.96Å; V165-I170 HydrophobicContact CB-CG2 3.92Å; V165-I170 HydrophobicContact CG1-CB 4.24Å; V165-I170 HydrophobicContact CG1-CG2 3.77Å; V165-I170 HydrophobicContact CG2-CB 4Å; V165-I170 HydrophobicContact CG2-CG2 4.44Å; V165-I170 WeakPolarHBondContact CG2-O 3.26Å; H168-I170 PolarHBondContact O-N 3.18Å; I170-N172 PolarHBondContact O-N 3.21Å; I170-N172 VanDerWaalsContact O-N 3.15Å; I170-A173 VanDerWaalsContact O-CB 3.24Å; I170-A173 WeakPolarHBondContact O-CB 3.21Å; I170-A173 PolarHBondContact O-N 2.85Å; I170-M494 HydrophobicContact CD1-CE 3.7Å; I170-M494 HydrophobicContact CD1-CG 4.05Å; I170-M494 HydrophobicContact CG1-CE 3.38Å; I170-M494 HydrophobicContact CG1-CG 4.31Å
171	C	75.3	Confident	70.5	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.034	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	50.6	36.2	-173.5	-49.2	0	0	0	0	113.6	C57 G58 E60 C121 V165 M169 A173	C57-C171 PolarHBondContact O-N 2.64Å; G58-C171 WeakPolarHBondContact O-CA 3.08Å; E60-C171 WeakPolarHBondContact CA-O 3.32Å; C121-C171 WeakPolarHBondContact CA-SG 2.85Å; C121-C171 HydrophobicContact CB-CB 3.72Å; C121-C171 WeakPolarHBondContact CB-SG 3.41Å; C121-C171 WeakPolarHBondContact SG-CB 3.43Å; C121-C171 CovalentContact SG-SG 1.98Å; C121-C171 PolarHBondContact SG-SG 3.26Å; V165-C171 HydrophobicContact CG1-CB 4.34Å; M169-C171 PolarHBondContact O-N 3.37Å; C171-A173 PolarHBondContact O-N 2.78Å
172	N	69	Low	68.3	Low	66 Å²	66	43.5 Å²	43.5	35%	0.353	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	60.2	26.5	-178	-149.1	29.7	0	0	0	114.2	E60 M169 I170 T174	E60-N172 HydrophobicContact CB-CB 3.79Å; E60-N172 HydrophobicContact CG-CB 3.97Å; E60-N172 PolarHBondContact OE2-ND2 2.93Å; M169-N172 PolarHBondContact O-N 2.86Å; M169-N172 VanDerWaalsContact O-N 3.07Å; I170-N172 PolarHBondContact O-N 3.21Å; I170-N172 VanDerWaalsContact O-N 3.15Å; N172-T174 PolarHBondContact O-N 3.22Å
173	A	70.4	Confident	65.8	Low	34 Å²	34	48.8 Å²	48.8	28%	0.281	27%	0.265	S	S	.	.			trans	-74.1	113.1	176.2	0	0	0	0	0	111.4	V165 H168 M169 I170 C171	V165-A173 HydrophobicContact CG2-CB 3.36Å; H168-A173 PolarHBondContact ND1-O 2.92Å; M169-A173 PolarHBondContact N-O 3.11Å; I170-A173 VanDerWaalsContact O-CB 3.24Å; I170-A173 WeakPolarHBondContact O-CB 3.21Å; I170-A173 PolarHBondContact O-N 2.85Å; C171-A173 PolarHBondContact O-N 2.78Å
174	T	65.5	Low	63.3	Low	65 Å²	65	51.1 Å²	51.1	40%	0.399	29%	0.289	S	S	.	.			trans	-101.2	-15.4	-174.4	54	0	0	0	0	114.3	M169 N172 N192	M169-T174 HydrophobicContact SD-CG2 4.09Å; N172-T174 PolarHBondContact O-N 3.22Å; T174-N192 PolarHBondContact O-ND2 3.02Å
175	I	64	Low	61.3	Low	54 Å²	54	53.8 Å²	53.8	28%	0.277	30%	0.296	S	S	.	.			trans	-101.7	114.6	-175.1	-61.4	170.4	0	0	0	109.3	N192 L193	I175-N192 WeakPolarHBondContact CG2-OD1 3.3Å; I175-L193 HydrophobicContact CD1-CD1 3.55Å; I175-L193 HydrophobicContact CD1-CG 4.47Å; I175-L193 HydrophobicContact CG1-CD1 3.99Å; I175-L193 HydrophobicContact CG1-CG 4.42Å
176	A	62.3	Low	60.2	Low	32 Å²	32	54.3 Å²	54.3	26%	0.264	30%	0.298	S	S	.	.			trans	-86.8	136.4	172.4	0	0	0	0	0	110.4	Y178 S191 N192	A176-Y178 HydrophobicContact CB-CE1 4.5Å; A176-Y178 HydrophobicContact CB-CE2 4.02Å; A176-S191 WeakPolarHBondContact O-CA 3.36Å; A176-N192 PolarHBondContact O-N 3.01Å
177	M	68.6	Low	59.7	Low	79 Å²	79	53.9 Å²	53.9	39%	0.389	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	107.3	172.3	-75	-62	-64.3	0	0	109.9	L82 V108 Q189 L190	L82-M177 HydrophobicContact CD1-CE 3.93Å; V108-M177 HydrophobicContact CG1-CE 4.02Å; V108-M177 HydrophobicContact CG1-SD 3.34Å; V108-M177 WeakPolarHBondContact CG1-SD 3.45Å; M177-Q189 HydrophobicContact CE-CB 3.79Å; M177-L190 CarbonylContact C-O 3.54Å
178	Y	60.6	Low	59.5	Low	42 Å²	42	54.3 Å²	54.3	17%	0.165	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	151.5	175.9	-60.2	-76.8	0	0	0	111.4	A176 F180 Q189 L190 N192 N467 L469	A176-Y178 HydrophobicContact CB-CE1 4.5Å; A176-Y178 HydrophobicContact CB-CE2 4.02Å; Y178-F180 HydrophobicContact CG-CE2 4.1Å; Y178-F180 HydrophobicContact CG-CZ 4.22Å; Y178-Q189 CarbonylContact O-C 3.42Å; Y178-Q189 VanDerWaalsContact O-CA 3.22Å; Y178-Q189 WeakPolarHBondContact O-CA 3.48Å; Y178-L190 PolarHBondContact N-O 3.03Å; Y178-L190 PolarHBondContact O-N 2.86Å; Y178-N192 HydrophobicContact CE2-CB 3.92Å; Y178-N467 WeakPolarHBondContact CE1-ND2 3.28Å; Y178-N467 PolarHBondContact OH-ND2 3.28Å; Y178-L469 HydrophobicContact CE2-CD2 4.14Å
179	R	63.6	Low	59.6	Low	47 Å²	47	51 Å²	51	18%	0.177	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.3	174.2	-170.5	-177	-63.1	175	15.5	108.9	E146 V187	E146-R179 VanDerWaalsContact CD-NH1 3.29Å; E146-R179 IonicContact OE1-CZ 3.3Å; E146-R179 IonicContact OE1-NH1 3.55Å; E146-R179 PolarHBondContact OE1-NH1 3.22Å; E146-R179 IonicContact OE1-NH2 3.57Å; E146-R179 IonicContact OE2-CZ 2.81Å; E146-R179 IonicContact OE2-NH1 3.2Å; E146-R179 PolarHBondContact OE2-NH1 2.84Å; E146-R179 VanDerWaalsContact OE2-NH1 3.1Å; E146-R179 IonicContact OE2-NH2 2.9Å; E146-R179 PolarHBondContact OE2-NH2 3.48Å; R179-V187 HydrophobicContact CB-CG1 4.47Å; R179-V187 HydrophobicContact CG-CG1 3.09Å
180	F	55.1	Low	59.1	Low	67 Å²	67	50.1 Å²	50.1	29%	0.294	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142.5	175.5	-62.6	-81.3	0	0	0	110.1	Y178 V187 V188 L190	Y178-F180 HydrophobicContact CG-CE2 4.1Å; Y178-F180 HydrophobicContact CG-CZ 4.22Å; F180-V187 WeakPolarHBondContact O-CA 3.3Å; F180-V187 WeakPolarHBondContact O-CG1 3.39Å; F180-V188 PolarHBondContact N-O 3.29Å; F180-V188 PolarHBondContact O-N 2.85Å; F180-L190 HydrophobicContact CD2-CB 4.04Å; F180-L190 HydrophobicContact CD2-CD1 3.55Å; F180-L190 HydrophobicContact CD2-CG 3.8Å; F180-L190 HydrophobicContact CE2-CB 3.96Å; F180-L190 HydrophobicContact CE2-CD1 3.75Å; F180-L190 HydrophobicContact CE2-CG 4.12Å; F180-L190 HydrophobicContact CG-CD1 4.49Å
181	R	50.8	Low	58.6	Low	89 Å²	89	50.2 Å²	50.2	34%	0.336	28%	0.278	S	S	.	.			trans	-113.1	133.4	172	-174.3	-177.4	175.7	-178.1	10.8	108.9	E532	R181-E532 WeakPolarHBondContact CD-OE2 3.39Å; R181-E532 IonicContact CZ-OE1 3.17Å; R181-E532 IonicContact CZ-OE2 3.61Å; R181-E532 IonicContact NE-OE1 2.63Å; R181-E532 IonicContact NE-OE2 3.63Å; R181-E532 PolarHBondContact NE-OE2 2.74Å; R181-E532 VanDerWaalsContact NE-OE2 3.11Å; R181-E532 IonicContact NH1-OE1 3.03Å; R181-E532 PolarHBondContact NH1-OE1 3.34Å; R181-E532 IonicContact NH1-OE2 3.4Å; R181-E532 PolarHBondContact NH1-OE2 3.39Å; R181-E532 IonicContact NH2-OE1 3.73Å; R181-E532 PolarHBondContact NH2-OE1 2.93Å; R181-E532 IonicContact NH2-OE2 3.7Å; R181-E532 PolarHBondContact NH2-OE2 3.41Å
182	I	46.8	Very low	57.2	Low	83 Å²	83	53.3 Å²	53.3	43%	0.426	29%	0.294	S	S	.	.			trans	-106.7	128.9	168	-50.9	172.7	0	0	0	106.4	A184 F185 V188	I182-A184 PolarHBondContact O-N 2.77Å; I182-F185 HydrophobicContact CB-CB 4.18Å; I182-F185 HydrophobicContact CB-CD2 4.01Å; I182-F185 HydrophobicContact CD1-CD2 4.33Å; I182-F185 HydrophobicContact CG2-CD2 3.67Å; I182-F185 HydrophobicContact CG2-CE2 4.38Å; I182-F185 CarbonylContact O-C 3.51Å; I182-F185 PolarHBondContact O-N 3.36Å; I182-V188 HydrophobicContact CD1-CG2 4.5Å
183	S	41.7	Very low	55.8	Low	110 Å²	110	53.5 Å²	53.5	77%	0.769	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.2	-173.6	36.1	0	0	0	0	114.7
184	A	39.5	Very low	54.1	Low	79 Å²	79	53.1 Å²	53.1	65%	0.653	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-4.6	174.3	0	0	0	0	0	114.6	I182	I182-A184 PolarHBondContact O-N 2.77Å
185	F	46.9	Very low	52.5	Low	83 Å²	83	52.1 Å²	52.1	36%	0.364	28%	0.281	S	S	.	.	S	Bend	trans	-139.6	164.6	-171.8	-56.5	-76.7	0	0	0	113.4	R78 I182	R78-F185 HydrophobicContact CB-CD1 4.22Å; R78-F185 HydrophobicContact CB-CE1 4.45Å; I182-F185 HydrophobicContact CB-CB 4.18Å; I182-F185 HydrophobicContact CB-CD2 4.01Å; I182-F185 HydrophobicContact CD1-CD2 4.33Å; I182-F185 HydrophobicContact CG2-CD2 3.67Å; I182-F185 HydrophobicContact CG2-CE2 4.38Å; I182-F185 CarbonylContact O-C 3.51Å; I182-F185 PolarHBondContact O-N 3.36Å
186	N	57.6	Low	50.9	Low	34 Å²	34	55 Å²	55	18%	0.182	31%	0.313	C	S	.	.			trans	-57.3	160.1	171.6	-69.5	-31.1	0	0	0	111.7	G135 K136 Q137 V188	G135-N186 VanDerWaalsContact O-CG 3.31Å; G135-N186 PolarHBondContact O-ND2 2.84Å; G135-N186 PolarHBondContact O-OD1 3.34Å; K136-N186 PolarHBondContact O-ND2 3.13Å; Q137-N186 HydrophobicContact CB-CB 4.2Å; Q137-N186 HydrophobicContact CG-CB 3.99Å; N186-V188 PolarHBondContact O-N 3.35Å
187	V	59.5	Low	49.3	Very low	19 Å²	19	57.5 Å²	57.5	12%	0.115	33%	0.329	C	S	.	.			trans	-60.4	139.7	175.1	177.2	0	0	0	0	110.1	L139 R179 F180	L139-V187 HydrophobicContact CD2-CB 4.11Å; L139-V187 HydrophobicContact CD2-CG1 4.2Å; R179-V187 HydrophobicContact CB-CG1 4.47Å; R179-V187 HydrophobicContact CG-CG1 3.09Å; F180-V187 WeakPolarHBondContact O-CA 3.3Å; F180-V187 WeakPolarHBondContact O-CG1 3.39Å
188	V	57.4	Low	47.4	Very low	16 Å²	16	55.3 Å²	55.3	10%	0.097	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.5	175	-176.2	0	0	0	0	108.6	N80 F180 I182 N186 L190	N80-V188 WeakPolarHBondContact ND2-CG1 2.86Å; N80-V188 WeakPolarHBondContact ND2-CG2 3.39Å; F180-V188 PolarHBondContact N-O 3.29Å; F180-V188 PolarHBondContact O-N 2.85Å; I182-V188 HydrophobicContact CD1-CG2 4.5Å; N186-V188 PolarHBondContact O-N 3.35Å; V188-L190 HydrophobicContact CG1-CD1 4.49Å; V188-L190 HydrophobicContact CG1-CD2 3.49Å; V188-L190 VanDerWaalsContact CG1-CD2 3.49Å; V188-L190 HydrophobicContact CG1-CG 3.8Å
189	Q	63.9	Low	45.8	Very low	20 Å²	20	61 Å²	61	9%	0.093	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120	171.4	-65.9	-177.8	-92.4	0	0	109.4	Y140 M177 Y178	Y140-Q189 PolarHBondContact O-NE2 3.3Å; M177-Q189 HydrophobicContact CE-CB 3.79Å; Y178-Q189 CarbonylContact O-C 3.42Å; Y178-Q189 VanDerWaalsContact O-CA 3.22Å; Y178-Q189 WeakPolarHBondContact O-CA 3.48Å
190	L	55.8	Low	44	Very low	27 Å²	27	62.8 Å²	62.8	14%	0.141	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.1	-173.8	-61.8	-173.1	0	0	0	110.3	R71 M177 Y178 F180 V188	R71-L190 VanDerWaalsContact NH2-CD2 3.31Å; M177-L190 CarbonylContact C-O 3.54Å; Y178-L190 PolarHBondContact N-O 3.03Å; Y178-L190 PolarHBondContact O-N 2.86Å; F180-L190 HydrophobicContact CD2-CB 4.04Å; F180-L190 HydrophobicContact CD2-CD1 3.55Å; F180-L190 HydrophobicContact CD2-CG 3.8Å; F180-L190 HydrophobicContact CE2-CB 3.96Å; F180-L190 HydrophobicContact CE2-CD1 3.75Å; F180-L190 HydrophobicContact CE2-CG 4.12Å; F180-L190 HydrophobicContact CG-CD1 4.49Å; V188-L190 HydrophobicContact CG1-CD1 4.49Å; V188-L190 HydrophobicContact CG1-CD2 3.49Å; V188-L190 VanDerWaalsContact CG1-CD2 3.49Å; V188-L190 HydrophobicContact CG1-CG 3.8Å
191	S	56.6	Low	42.7	Very low	3 Å²	3	64.9 Å²	64.9	2%	0.021	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	158.7	167.1	46.6	0	0	0	0	111	A176 L193 T194	A176-S191 WeakPolarHBondContact O-CA 3.36Å; S191-L193 PolarHBondContact O-N 2.86Å; S191-L193 VanDerWaalsContact O-N 3.1Å; S191-T194 PolarHBondContact N-OG1 3.01Å; S191-T194 VanDerWaalsContact N-OG1 3.1Å; S191-T194 PolarHBondContact O-N 2.74Å; S191-T194 PolarHBondContact O-OG1 2.81Å; S191-T194 PolarHBondContact OG-OG1 2.83Å
192	N	45	Very low	41.6	Very low	71 Å²	71	62.8 Å²	62.8	38%	0.38	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.8	163.3	56.2	-13.9	0	0	0	113.6	T174 I175 A176 Y178	T174-N192 PolarHBondContact O-ND2 3.02Å; I175-N192 WeakPolarHBondContact CG2-OD1 3.3Å; A176-N192 PolarHBondContact O-N 3.01Å; Y178-N192 HydrophobicContact CE2-CB 3.92Å
193	L	39.8	Very low	40.7	Very low	70 Å²	70	65.1 Å²	65.1	37%	0.366	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-13	174	-64.3	178	0	0	0	114.5	I175 S191	I175-L193 HydrophobicContact CD1-CD1 3.55Å; I175-L193 HydrophobicContact CD1-CG 4.47Å; I175-L193 HydrophobicContact CG1-CD1 3.99Å; I175-L193 HydrophobicContact CG1-CG 4.42Å; S191-L193 PolarHBondContact O-N 2.86Å; S191-L193 VanDerWaalsContact O-N 3.1Å
194	T	35.1	Very low	40.1	Very low	26 Å²	26	62.1 Å²	62.1	16%	0.16	37%	0.367	C	S	.	.	S	Bend	trans	-97.7	113.8	179.2	40.2	0	0	0	0	109.3	S191	S191-T194 PolarHBondContact N-OG1 3.01Å; S191-T194 VanDerWaalsContact N-OG1 3.1Å; S191-T194 PolarHBondContact O-N 2.74Å; S191-T194 PolarHBondContact O-OG1 2.81Å; S191-T194 PolarHBondContact OG-OG1 2.83Å
195	D	31.6	Very low	39.6	Very low	44 Å²	44	61.3 Å²	61.3	24%	0.235	35%	0.352	C	S	.	.			trans	-56.7	150	168.3	68.6	-19.7	0	0	0	110.6	S197 G198 K199	D195-S197 VanDerWaalsContact CG-OG 3.25Å; D195-S197 PolarHBondContact O-N 3.38Å; D195-S197 WeakPolarHBondContact OD2-CB 3.4Å; D195-S197 PolarHBondContact OD2-OG 2.86Å; D195-G198 PolarHBondContact O-N 3.44Å; D195-G198 PolarHBondContact OD1-N 3.36Å; D195-K199 PolarHBondContact OD1-N 2.74Å
196	A	29.7	Very low	39.3	Very low	114 Å²	114	61.7 Å²	61.7	94%	0.942	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-2.3	175.8	0	0	0	0	0	113.7
197	S	29.1	Very low	38.8	Very low	85 Å²	85	61.3 Å²	61.3	59%	0.594	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-5.8	177.2	25.4	0	0	0	0	115.7	D195 K199	D195-S197 VanDerWaalsContact CG-OG 3.25Å; D195-S197 PolarHBondContact O-N 3.38Å; D195-S197 WeakPolarHBondContact OD2-CB 3.4Å; D195-S197 PolarHBondContact OD2-OG 2.86Å; S197-K199 VanDerWaalsContact C-N 3.31Å; S197-K199 PolarHBondContact O-N 2.85Å
198	G	28.9	Very low	38.2	Very low	33 Å²	33	64.4 Å²	64.4	34%	0.34	36%	0.362	S	S	.	.			trans	64.1	29.3	174.2	0	0	0	0	0	114.7	D195	D195-G198 PolarHBondContact O-N 3.44Å; D195-G198 PolarHBondContact OD1-N 3.36Å
199	K	26.9	Very low	37.9	Very low	162 Å²	162	68.2 Å²	68.2	70%	0.704	38%	0.375	S	S	*	.			trans	-137.8	99.1	-179.7	-74	-170.7	179	-177.9	0	112.5	D195 S197	D195-K199 PolarHBondContact OD1-N 2.74Å; S197-K199 VanDerWaalsContact C-N 3.31Å; S197-K199 PolarHBondContact O-N 2.85Å
200	S	26.6	Very low	37.7	Very low	83 Å²	83	68.9 Å²	68.9	58%	0.58	38%	0.379	S	S	*	.			trans	60	99.4	147.9	-162	0	0	0	0	118.4
201	F	27.9	Very low	37.8	Very low	112 Å²	112	73.7 Å²	73.7	49%	0.491	40%	0.396	S	S	.	.			trans	-103.4	27.2	157.9	-152.4	-97.9	0	0	0	111.3	L203	F201-L203 PolarHBondContact O-N 2.74Å
202	S	27.7	Very low	38.5	Very low	44 Å²	44	78.6 Å²	78.6	31%	0.308	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	1.8	-154.7	-162.4	0	0	0	0	117.2
203	L	27.5	Very low	39.9	Very low	133 Å²	133	75.2 Å²	75.2	70%	0.696	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	10.2	-170	-96.2	141.1	0	0	0	116.3	F201 Q260	F201-L203 PolarHBondContact O-N 2.74Å; L203-Q260 VanDerWaalsContact C-NE2 3.27Å; L203-Q260 PolarHBondContact O-NE2 2.82Å
204	L	29.3	Very low	41.3	Very low	47 Å²	47	72.5 Å²	72.5	25%	0.246	39%	0.391	C	S	.	.	S	Bend	trans	-108.4	2.8	174.4	-89.7	157.4	0	0	0	114.3	E206 F256	L204-E206 VanDerWaalsContact C-N 3.35Å; L204-E206 PolarHBondContact O-N 2.89Å; L204-F256 HydrophobicContact CD1-CB 3.66Å; L204-F256 HydrophobicContact CD1-CD1 3.48Å; L204-F256 VanDerWaalsContact CD1-CD1 3.48Å; L204-F256 HydrophobicContact CD1-CD2 4.34Å; L204-F256 HydrophobicContact CD1-CE1 4.19Å; L204-F256 HydrophobicContact CD1-CG 3.58Å
205	L	29.7	Very low	43	Very low	62 Å²	62	74.1 Å²	74.1	33%	0.325	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	12.7	-165.5	-79.1	159.5	0	0	0	115.8	L369	L205-L369 HydrophobicContact CD2-CD1 4.16Å
206	E	39.2	Very low	45.4	Very low	90 Å²	90	74.1 Å²	74.1	42%	0.421	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1	178.8	-75	-162.6	156	0	0	115.1	L204 L360	L204-E206 VanDerWaalsContact C-N 3.35Å; L204-E206 PolarHBondContact O-N 2.89Å; E206-L360 HydrophobicContact CG-CD1 3.87Å; E206-L360 WeakPolarHBondContact OE1-CD2 3.28Å
207	R	48.5	Very low	47.8	Very low	26 Å²	26	68.7 Å²	68.7	10%	0.098	36%	0.359	C	S	.	.			trans	-122.7	131.3	-166.1	-63	116.7	178	-99.4	-1.2	113.9	W209 G289 N290 T292	R207-W209 PolarHBondContact O-N 3.26Å; R207-G289 WeakPolarHBondContact CG-O 3.42Å; R207-N290 WeakPolarHBondContact CA-O 3.35Å; R207-T292 HydrophobicContact CB-CG2 3.3Å; R207-T292 HydrophobicContact CG-CG2 3.89Å; R207-T292 PolarHBondContact NH1-OG1 3.12Å
208	F	46	Very low	50.2	Low	84 Å²	84	67.5 Å²	67.5	37%	0.368	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	131.5	156.6	-65.1	-79.3	0	0	0	108.3	N210 N290 E291 T292 R370 V372	F208-N210 PolarHBondContact O-N 2.88Å; F208-N290 VanDerWaalsContact CD2-O 3.32Å; F208-N290 WeakPolarHBondContact CD2-O 3.48Å; F208-N290 PolarHBondContact N-O 3Å; F208-E291 HydrophobicContact CB-CG 4.28Å; F208-E291 CarbonylContact O-C 3.08Å; F208-E291 VanDerWaalsContact O-CA 3.28Å; F208-E291 WeakPolarHBondContact O-CA 3.38Å; F208-T292 PolarHBondContact O-N 3.04Å; F208-R370 HydrophobicContact CD1-CB 4.08Å; F208-R370 HydrophobicContact CE1-CB 4.05Å; F208-V372 HydrophobicContact CD1-CG2 4.26Å
209	W	50.8	Low	52.8	Low	97 Å²	97	69.6 Å²	69.6	37%	0.367	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	116.6	172.9	-178.7	-90.9	0	0	0	108.7	R207 A214 T292 C294 L369	R207-W209 PolarHBondContact O-N 3.26Å; W209-A214 HydrophobicContact CH2-CB 4.16Å; W209-A214 HydrophobicContact CZ2-CB 3.43Å; W209-A214 VanDerWaalsContact CZ2-CB 3.43Å; W209-T292 CarbonylContact C-O 3.46Å; W209-T292 WeakPolarHBondContact CA-O 3.4Å; W209-T292 HydrophobicContact CE3-CG2 4.49Å; W209-C294 HydrophobicContact CH2-CB 4.33Å; W209-C294 HydrophobicContact CZ3-CB 4.49Å; W209-L369 HydrophobicContact CB-CD2 4.22Å
210	N	59.3	Low	55.2	Low	34 Å²	34	62.2 Å²	62.2	18%	0.182	32%	0.318	C	S	.	.			trans	-105.3	118	176.7	-178.7	-40.1	0	0	0	109.3	F208 D212 I213 A214 E291 T292	F208-N210 PolarHBondContact O-N 2.88Å; N210-D212 VanDerWaalsContact C-N 3.32Å; N210-D212 PolarHBondContact O-N 2.9Å; N210-D212 WeakPolarHBondContact OD1-CA 3.25Å; N210-D212 WeakPolarHBondContact OD1-CB 3.48Å; N210-D212 PolarHBondContact OD1-N 3.1Å; N210-I213 HydrophobicContact CB-CB 4.12Å; N210-I213 HydrophobicContact CB-CD1 3.78Å; N210-I213 HydrophobicContact CB-CG1 3.83Å; N210-I213 PolarHBondContact O-N 2.7Å; N210-I213 PolarHBondContact OD1-N 2.94Å; N210-I213 VanDerWaalsContact OD1-N 3.14Å; N210-A214 PolarHBondContact O-N 3.1Å; N210-E291 HydrophobicContact CB-CB 4.01Å; N210-E291 PolarHBondContact ND2-OE2 3.09Å; N210-T292 PolarHBondContact N-O 2.94Å
211	R	58	Low	57.8	Low	128 Å²	128	58.3 Å²	58.3	48%	0.483	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-35.2	-179.3	-72.2	-173.9	175.5	172.6	3.2	113.1	S51 A214 A215	S51-R211 PolarHBondContact OG-NH2 3.07Å; R211-A214 PolarHBondContact O-N 2.94Å; R211-A215 WeakPolarHBondContact O-CB 3.2Å; R211-A215 PolarHBondContact O-N 3.17Å
212	D	72.1	Confident	60.5	Low	106 Å²	106	57 Å²	57	57%	0.567	29%	0.289	S	S	*	.	H	α-helix	trans	-69.7	-37.2	178.4	-62	-27.6	0	0	0	111.5	N210 Y216	N210-D212 VanDerWaalsContact C-N 3.32Å; N210-D212 PolarHBondContact O-N 2.9Å; N210-D212 WeakPolarHBondContact OD1-CA 3.25Å; N210-D212 WeakPolarHBondContact OD1-CB 3.48Å; N210-D212 PolarHBondContact OD1-N 3.1Å; D212-Y216 WeakPolarHBondContact O-CB 3.13Å; D212-Y216 PolarHBondContact O-N 3.4Å
213	I	74.8	Confident	63.3	Low	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.5	-40.5	173.1	-58.5	-178.4	0	0	0	110	N210 Y216 A217 Y234 E291 G293 G320	N210-I213 HydrophobicContact CB-CB 4.12Å; N210-I213 HydrophobicContact CB-CD1 3.78Å; N210-I213 HydrophobicContact CB-CG1 3.83Å; N210-I213 PolarHBondContact O-N 2.7Å; N210-I213 PolarHBondContact OD1-N 2.94Å; N210-I213 VanDerWaalsContact OD1-N 3.14Å; I213-Y216 PolarHBondContact O-N 3.16Å; I213-A217 WeakPolarHBondContact O-CB 3.47Å; I213-A217 PolarHBondContact O-N 3.39Å; I213-Y234 HydrophobicContact CB-CD2 4.33Å; I213-Y234 HydrophobicContact CB-CE2 4.33Å; I213-Y234 HydrophobicContact CD1-CD1 4.41Å; I213-Y234 HydrophobicContact CD1-CE1 4.42Å; I213-Y234 HydrophobicContact CG1-CD1 4.13Å; I213-Y234 HydrophobicContact CG1-CD2 4.04Å; I213-Y234 HydrophobicContact CG1-CE1 3.96Å; I213-Y234 HydrophobicContact CG1-CE2 3.84Å; I213-Y234 HydrophobicContact CG1-CG 4.18Å; I213-Y234 HydrophobicContact CG2-CD2 4.25Å; I213-Y234 HydrophobicContact CG2-CG 4.4Å; I213-E291 HydrophobicContact CD1-CB 3.91Å; I213-G293 VanDerWaalsContact CG2-N 3.32Å; I213-G320 VanDerWaalsContact CG2-CA 3.49Å; I213-G320 WeakPolarHBondContact CG2-O 2.98Å
214	A	67.7	Low	66.1	Low	13 Å²	13	55.2 Å²	55.2	11%	0.107	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-45.4	178.1	0	0	0	0	0	112.2	W209 N210 R211 Y216 A217 Q218	W209-A214 HydrophobicContact CH2-CB 4.16Å; W209-A214 HydrophobicContact CZ2-CB 3.43Å; W209-A214 VanDerWaalsContact CZ2-CB 3.43Å; N210-A214 PolarHBondContact O-N 3.1Å; R211-A214 PolarHBondContact O-N 2.94Å; A214-Y216 VanDerWaalsContact C-N 3.31Å; A214-Y216 PolarHBondContact O-N 3.37Å; A214-A217 PolarHBondContact O-N 2.99Å; A214-Q218 WeakPolarHBondContact O-CB 3.34Å; A214-Q218 PolarHBondContact O-N 2.89Å
215	A	71.4	Confident	68.8	Low	59 Å²	59	53.7 Å²	53.7	49%	0.488	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-42.8	175.2	0	0	0	0	0	111.3	R211 Q218 T219	R211-A215 WeakPolarHBondContact O-CB 3.2Å; R211-A215 PolarHBondContact O-N 3.17Å; A215-Q218 PolarHBondContact O-N 2.96Å; A215-T219 PolarHBondContact O-N 3.4Å; A215-T219 VanDerWaalsContact O-N 3.08Å
216	Y	81.9	Confident	70.9	Confident	44 Å²	44	51.2 Å²	51.2	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-45.7	173.3	177.8	-100.7	0	0	0	112.4	D212 I213 A214 Q218 T219 F220 P232 K233 Y234 V236	D212-Y216 WeakPolarHBondContact O-CB 3.13Å; D212-Y216 PolarHBondContact O-N 3.4Å; I213-Y216 PolarHBondContact O-N 3.16Å; A214-Y216 VanDerWaalsContact C-N 3.31Å; A214-Y216 PolarHBondContact O-N 3.37Å; Y216-Q218 VanDerWaalsContact C-N 3.3Å; Y216-Q218 PolarHBondContact O-N 3.43Å; Y216-T219 PolarHBondContact O-N 3.18Å; Y216-T219 PolarHBondContact O-OG1 3.32Å; Y216-F220 PolarHBondContact O-N 3.27Å; Y216-P232 HydrophobicContact CE1-CB 4.48Å; Y216-P232 WeakPolarHBondContact OH-CA 3.39Å; Y216-P232 WeakPolarHBondContact OH-CB 3.48Å; Y216-K233 HydrophobicContact CD2-CB 4.08Å; Y216-K233 HydrophobicContact CE1-CB 4.44Å; Y216-K233 HydrophobicContact CE2-CB 3.7Å; Y216-K233 PolarHBondContact OH-N 3.46Å; Y216-K233 VanDerWaalsContact OH-N 3.09Å; Y216-Y234 AromaticContact CD1-CD2 3.53Å; Y216-Y234 HydrophobicContact CD1-CD2 3.53Å; Y216-Y234 HydrophobicContact CD1-CE2 4.46Å; Y216-Y234 HydrophobicContact CD1-CG 4.32Å; Y216-Y234 HydrophobicContact CE1-CD2 4.21Å; Y216-Y234 AromaticContact CG-CD2 3.72Å; Y216-Y234 HydrophobicContact CG-CD2 3.72Å; Y216-Y234 HydrophobicContact CG-CE2 4.23Å; Y216-V236 HydrophobicContact CD1-CG2 4.41Å; Y216-V236 HydrophobicContact CE1-CG2 3.7Å
217	A	79.7	Confident	72.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-35	177.4	0	0	0	0	0	112.3	I213 A214 F220 A221 A318	I213-A217 WeakPolarHBondContact O-CB 3.47Å; I213-A217 PolarHBondContact O-N 3.39Å; A214-A217 PolarHBondContact O-N 2.99Å; A217-F220 WeakPolarHBondContact O-CB 3.22Å; A217-F220 PolarHBondContact O-N 3.42Å; A217-A221 PolarHBondContact O-N 3.47Å; A217-A318 HydrophobicContact CB-CB 4.29Å; A217-A318 WeakPolarHBondContact O-CB 3.33Å
218	Q	80.8	Confident	73.6	Confident	61 Å²	61	53.7 Å²	53.7	29%	0.285	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-45.3	174.5	-170.1	63.3	47.7	0	0	111.7	A214 A215 Y216 F220 A221 D222 F296 T297	A214-Q218 WeakPolarHBondContact O-CB 3.34Å; A214-Q218 PolarHBondContact O-N 2.89Å; A215-Q218 PolarHBondContact O-N 2.96Å; Y216-Q218 VanDerWaalsContact C-N 3.3Å; Y216-Q218 PolarHBondContact O-N 3.43Å; Q218-F220 PolarHBondContact O-N 3.13Å; Q218-F220 VanDerWaalsContact O-N 3.12Å; Q218-A221 PolarHBondContact O-N 3.4Å; Q218-D222 PolarHBondContact NE2-OD1 2.87Å; Q218-D222 WeakPolarHBondContact O-CB 3.25Å; Q218-D222 PolarHBondContact O-N 2.89Å; Q218-F296 PolarHBondContact NE2-O 3.27Å; Q218-T297 PolarHBondContact NE2-OG1 2.97Å; Q218-T297 VanDerWaalsContact NE2-OG1 3.08Å
219	T	82.3	Confident	74.8	Confident	77 Å²	77	51.7 Å²	51.7	47%	0.472	27%	0.269	S	S	.	.	H	α-helix	trans	-55.9	-34	175.2	57.8	0	0	0	0	112.4	A215 Y216 D223	A215-T219 PolarHBondContact O-N 3.4Å; A215-T219 VanDerWaalsContact O-N 3.08Å; Y216-T219 PolarHBondContact O-N 3.18Å; Y216-T219 PolarHBondContact O-OG1 3.32Å; T219-D223 PolarHBondContact O-N 2.78Å
220	F	78	Confident	75.6	Confident	7 Å²	7	55.4 Å²	55.4	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-76	-38.9	177.2	-177	-91.6	0	0	0	113.2	Y216 A217 Q218 D222 D223 Q227 P229 V236 I238 A318	Y216-F220 PolarHBondContact O-N 3.27Å; A217-F220 WeakPolarHBondContact O-CB 3.22Å; A217-F220 PolarHBondContact O-N 3.42Å; Q218-F220 PolarHBondContact O-N 3.13Å; Q218-F220 VanDerWaalsContact O-N 3.12Å; F220-D222 VanDerWaalsContact C-N 3.26Å; F220-D222 PolarHBondContact O-N 3.21Å; F220-D223 PolarHBondContact O-N 3.31Å; F220-Q227 WeakPolarHBondContact CE2-O 3.47Å; F220-Q227 WeakPolarHBondContact CZ-O 3.41Å; F220-P229 HydrophobicContact CD2-CG 3.56Å; F220-P229 VanDerWaalsContact CE2-CD 3.43Å; F220-P229 HydrophobicContact CE2-CG 3.78Å; F220-V236 HydrophobicContact CD1-CG1 4.35Å; F220-I238 HydrophobicContact CD1-CD1 4.22Å; F220-I238 HydrophobicContact CD1-CG1 4.11Å; F220-I238 HydrophobicContact CE1-CB 4.32Å; F220-I238 HydrophobicContact CE1-CD1 3.14Å; F220-I238 HydrophobicContact CE1-CG1 3.35Å; F220-I238 HydrophobicContact CE1-CG2 4.01Å; F220-I238 HydrophobicContact CE2-CD1 4.32Å; F220-I238 HydrophobicContact CZ-CD1 3.2Å; F220-I238 HydrophobicContact CZ-CG1 3.98Å; F220-A318 HydrophobicContact CB-CB 4.43Å; F220-A318 HydrophobicContact CD1-CB 3.61Å; F220-A318 HydrophobicContact CE1-CB 4.45Å; F220-A318 HydrophobicContact CG-CB 4.49Å
221	A	81.6	Confident	76.1	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.7	-36.3	173.9	0	0	0	0	0	111.5	A217 Q218 D223 C224 T297 V316 A318	A217-A221 PolarHBondContact O-N 3.47Å; Q218-A221 PolarHBondContact O-N 3.4Å; A221-D223 VanDerWaalsContact C-N 3.32Å; A221-D223 PolarHBondContact O-N 2.93Å; A221-C224 PolarHBondContact O-N 3.31Å; A221-T297 WeakPolarHBondContact O-CB 3.49Å; A221-T297 WeakPolarHBondContact O-CG2 3.24Å; A221-V316 HydrophobicContact CB-CG1 4.4Å; A221-A318 HydrophobicContact CB-CB 4.19Å
222	D	85.2	Confident	76.9	Confident	86 Å²	86	54.5 Å²	54.5	46%	0.46	31%	0.309	S	S	.	.	H	α-helix	trans	-68.6	-27.6	178.7	-66.2	-17.8	0	0	0	113.3	Q218 F220 C224 T297	Q218-D222 PolarHBondContact NE2-OD1 2.87Å; Q218-D222 WeakPolarHBondContact O-CB 3.25Å; Q218-D222 PolarHBondContact O-N 2.89Å; F220-D222 VanDerWaalsContact C-N 3.26Å; F220-D222 PolarHBondContact O-N 3.21Å; D222-C224 PolarHBondContact O-N 2.84Å; D222-T297 WeakPolarHBondContact OD1-CB 3.4Å; D222-T297 PolarHBondContact OD1-OG1 2.87Å
223	D	86.2	Confident	77.3	Confident	113 Å²	113	56.4 Å²	56.4	60%	0.604	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-10.3	175.3	-76.2	-17.5	0	0	0	113.2	T219 F220 A221 S225	T219-D223 PolarHBondContact O-N 2.78Å; F220-D223 PolarHBondContact O-N 3.31Å; A221-D223 VanDerWaalsContact C-N 3.32Å; A221-D223 PolarHBondContact O-N 2.93Å; D223-S225 PolarHBondContact O-N 2.81Å; D223-S225 VanDerWaalsContact O-N 3.11Å
224	C	86.8	Confident	77.4	Confident	25 Å²	25	58.3 Å²	58.3	17%	0.169	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	40	178.9	-73	0	0	0	0	113.6	A221 D222 C299 I302 T303	A221-C224 PolarHBondContact O-N 3.31Å; D222-C224 PolarHBondContact O-N 2.84Å; C224-C299 WeakPolarHBondContact CA-SG 3.43Å; C224-C299 HydrophobicContact CB-CB 3.68Å; C224-C299 WeakPolarHBondContact CB-SG 3.32Å; C224-C299 VanDerWaalsContact SG-CA 3.55Å; C224-C299 WeakPolarHBondContact SG-CB 3.38Å; C224-C299 CovalentContact SG-SG 2.03Å; C224-C299 PolarHBondContact SG-SG 3.39Å; C224-I302 WeakPolarHBondContact O-CA 3.47Å; C224-T303 PolarHBondContact O-N 2.85Å; C224-T303 PolarHBondContact O-OG1 3.34Å
225	S	84.2	Confident	77.8	Confident	16 Å²	16	58.8 Å²	58.8	11%	0.112	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-106.9	134.8	178.9	176.1	0	0	0	0	110.8	D223 Q227 T303	D223-S225 PolarHBondContact O-N 2.81Å; D223-S225 VanDerWaalsContact O-N 3.11Å; S225-Q227 PolarHBondContact O-N 3.5Å; S225-Q227 PolarHBondContact OG-N 2.63Å; S225-Q227 PolarHBondContact OG-O 2.74Å; S225-Q227 VanDerWaalsContact OG-O 3.11Å; S225-T303 CarbonylContact C-O 3.55Å; S225-T303 WeakPolarHBondContact CA-O 3.49Å
226	G	75.4	Confident	78	Confident	10 Å²	10	56 Å²	56	10%	0.103	30%	0.298	C	S	.	.	S	Bend	trans	-77.9	-0.4	168.9	0	0	0	0	0	114.2	T303	G226-T303 PolarHBondContact N-O 2.75Å
227	Q	74.5	Confident	77.8	Confident	112 Å²	112	53.9 Å²	53.9	52%	0.523	29%	0.29	S	S	.	.	S	Bend	trans	-118.7	132.5	-176.8	-86.4	-177.4	-6.5	0	0	113	F220 S225 N304	F220-Q227 WeakPolarHBondContact CE2-O 3.47Å; F220-Q227 WeakPolarHBondContact CZ-O 3.41Å; S225-Q227 PolarHBondContact O-N 3.5Å; S225-Q227 PolarHBondContact OG-N 2.63Å; S225-Q227 PolarHBondContact OG-O 2.74Å; S225-Q227 VanDerWaalsContact OG-O 3.11Å; Q227-N304 HydrophobicContact CB-CB 4.07Å; Q227-N304 HydrophobicContact CG-CB 3.86Å; Q227-N304 WeakPolarHBondContact CG-O 3.47Å
228	K	69.9	Low	77.7	Confident	56 Å²	56	54 Å²	54	24%	0.243	29%	0.291	C	S	.	.			trans	-58.1	148.6	173.1	178.8	-174.3	169.6	-176	0	111.5	I238 D281	K228-I238 HydrophobicContact CB-CD1 3.99Å; K228-D281 HydrophobicContact CD-CB 3.97Å
229	P	70.5	Confident	77.6	Confident	42 Å²	42	51.1 Å²	51.1	27%	0.273	28%	0.277	S	S	.	.			trans	-63.5	146.1	173.2	-17.9	32.3	0	0	0	111.8	F220 S231 P232	F220-P229 HydrophobicContact CD2-CG 3.56Å; F220-P229 VanDerWaalsContact CE2-CD 3.43Å; F220-P229 HydrophobicContact CE2-CG 3.78Å; P229-S231 PolarHBondContact O-N 3.42Å; P229-P232 HydrophobicContact CB-CB 4.1Å; P229-P232 HydrophobicContact CG-CB 4.16Å; P229-P232 WeakPolarHBondContact O-CD 3.33Å
230	I	68.4	Low	77.6	Confident	174 Å²	174	47.6 Å²	47.6	89%	0.892	26%	0.256	S	S	*	.	S	Bend	trans	-61.1	-29.3	-179.1	-60.7	170.4	0	0	0	112.1
231	S	69.4	Low	77.9	Confident	109 Å²	109	47.3 Å²	47.3	76%	0.762	26%	0.255	S	S	*	.	S	Bend	trans	-145	77	179.4	-63.3	0	0	0	0	109.7	P229	P229-S231 PolarHBondContact O-N 3.42Å
232	P	74.5	Confident	77.9	Confident	35 Å²	35	49.8 Å²	49.8	23%	0.227	27%	0.27	C	S	.	.			trans	-79.4	142.5	-172.2	36.3	-35.9	0	0	0	110.4	Y216 P229 Y234 V236	Y216-P232 HydrophobicContact CE1-CB 4.48Å; Y216-P232 WeakPolarHBondContact OH-CA 3.39Å; Y216-P232 WeakPolarHBondContact OH-CB 3.48Å; P229-P232 HydrophobicContact CB-CB 4.1Å; P229-P232 HydrophobicContact CG-CB 4.16Å; P229-P232 WeakPolarHBondContact O-CD 3.33Å; P232-Y234 VanDerWaalsContact CB-O 3.24Å; P232-Y234 WeakPolarHBondContact CB-O 3.08Å; P232-Y234 PolarHBondContact O-N 3.06Å; P232-V236 HydrophobicContact CB-CG2 4.43Å
233	K	79.9	Confident	77.6	Confident	146 Å²	146	47.6 Å²	47.6	64%	0.635	27%	0.265	S	S	*	.	S	Bend	trans	-59.2	-36.9	178.4	-178.4	-179.5	176.5	-175.5	0	111.6	Y216	Y216-K233 HydrophobicContact CD2-CB 4.08Å; Y216-K233 HydrophobicContact CE1-CB 4.44Å; Y216-K233 HydrophobicContact CE2-CB 3.7Å; Y216-K233 PolarHBondContact OH-N 3.46Å; Y216-K233 VanDerWaalsContact OH-N 3.09Å
234	Y	78.2	Confident	77.3	Confident	40 Å²	40	48.7 Å²	48.7	16%	0.157	27%	0.27	C	S	.	.	S	Bend	trans	-123.6	146.8	174	-59.8	-62.3	0	0	0	108.4	I213 Y216 P232 V236 F321	I213-Y234 HydrophobicContact CB-CD2 4.33Å; I213-Y234 HydrophobicContact CB-CE2 4.33Å; I213-Y234 HydrophobicContact CD1-CD1 4.41Å; I213-Y234 HydrophobicContact CD1-CE1 4.42Å; I213-Y234 HydrophobicContact CG1-CD1 4.13Å; I213-Y234 HydrophobicContact CG1-CD2 4.04Å; I213-Y234 HydrophobicContact CG1-CE1 3.96Å; I213-Y234 HydrophobicContact CG1-CE2 3.84Å; I213-Y234 HydrophobicContact CG1-CG 4.18Å; I213-Y234 HydrophobicContact CG2-CD2 4.25Å; I213-Y234 HydrophobicContact CG2-CG 4.4Å; Y216-Y234 AromaticContact CD1-CD2 3.53Å; Y216-Y234 HydrophobicContact CD1-CD2 3.53Å; Y216-Y234 HydrophobicContact CD1-CE2 4.46Å; Y216-Y234 HydrophobicContact CD1-CG 4.32Å; Y216-Y234 HydrophobicContact CE1-CD2 4.21Å; Y216-Y234 AromaticContact CG-CD2 3.72Å; Y216-Y234 HydrophobicContact CG-CD2 3.72Å; Y216-Y234 HydrophobicContact CG-CE2 4.23Å; P232-Y234 VanDerWaalsContact CB-O 3.24Å; P232-Y234 WeakPolarHBondContact CB-O 3.08Å; P232-Y234 PolarHBondContact O-N 3.06Å; Y234-V236 VanDerWaalsContact O-CG2 3.28Å; Y234-V236 WeakPolarHBondContact O-CG2 3.47Å; Y234-V236 PolarHBondContact O-N 3.35Å; Y234-F321 WeakPolarHBondContact CB-O 2.94Å
235	P	75.2	Confident	76.3	Confident	22 Å²	22	48 Å²	48	14%	0.143	27%	0.265	C	S	.	.			trans	-47.6	141	160.1	-22.3	25.1	0	0	0	110.2	G320 F321	P235-G320 CarbonylContact O-C 3.59Å; P235-G320 VanDerWaalsContact O-CA 3.23Å; P235-G320 WeakPolarHBondContact O-CA 3.22Å; P235-F321 HydrophobicContact CB-CB 4.2Å; P235-F321 HydrophobicContact CB-CD2 4.24Å; P235-F321 VanDerWaalsContact CD-O 3.23Å; P235-F321 WeakPolarHBondContact CD-O 3.48Å; P235-F321 WeakPolarHBondContact O-CD2 3.18Å; P235-F321 PolarHBondContact O-N 3.19Å
236	V	76.2	Confident	74.5	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.6	-177.2	-175.3	0	0	0	0	110.2	Y216 F220 P232 Y234 I238 S285 A318 C319	Y216-V236 HydrophobicContact CD1-CG2 4.41Å; Y216-V236 HydrophobicContact CE1-CG2 3.7Å; F220-V236 HydrophobicContact CD1-CG1 4.35Å; P232-V236 HydrophobicContact CB-CG2 4.43Å; Y234-V236 VanDerWaalsContact O-CG2 3.28Å; Y234-V236 WeakPolarHBondContact O-CG2 3.47Å; Y234-V236 PolarHBondContact O-N 3.35Å; V236-I238 HydrophobicContact CG1-CG1 3.99Å; V236-S285 PolarHBondContact O-OG 3.04Å; V236-A318 HydrophobicContact CG1-CB 4.34Å; V236-C319 CarbonylContact C-O 3.6Å; V236-C319 VanDerWaalsContact CA-O 3.24Å; V236-C319 WeakPolarHBondContact CA-O 3.44Å
237	A	76.3	Confident	73.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.5	170.5	0	0	0	0	0	108.7	I259 T282 A318 C319 F321	A237-I259 HydrophobicContact CB-CD1 4.12Å; A237-I259 HydrophobicContact CB-CG1 4.36Å; A237-I259 HydrophobicContact CB-CG2 3.86Å; A237-T282 HydrophobicContact CB-CG2 3.65Å; A237-A318 CarbonylContact O-C 3.48Å; A237-A318 WeakPolarHBondContact O-CA 3.48Å; A237-C319 PolarHBondContact N-O 3.36Å; A237-C319 PolarHBondContact O-N 2.82Å; A237-F321 HydrophobicContact CB-CE2 3.49Å; A237-F321 VanDerWaalsContact CB-CE2 3.49Å; A237-F321 HydrophobicContact CB-CZ 3.58Å
238	I	77.4	Confident	72.1	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.2	-172.7	-50.5	161.4	0	0	0	109.6	F220 K228 V236 L240 V278 T282 V316 L317	F220-I238 HydrophobicContact CD1-CD1 4.22Å; F220-I238 HydrophobicContact CD1-CG1 4.11Å; F220-I238 HydrophobicContact CE1-CB 4.32Å; F220-I238 HydrophobicContact CE1-CD1 3.14Å; F220-I238 HydrophobicContact CE1-CG1 3.35Å; F220-I238 HydrophobicContact CE1-CG2 4.01Å; F220-I238 HydrophobicContact CE2-CD1 4.32Å; F220-I238 HydrophobicContact CZ-CD1 3.2Å; F220-I238 HydrophobicContact CZ-CG1 3.98Å; K228-I238 HydrophobicContact CB-CD1 3.99Å; V236-I238 HydrophobicContact CG1-CG1 3.99Å; I238-L240 HydrophobicContact CG2-CD2 4.09Å; I238-V278 WeakPolarHBondContact O-CG1 3.3Å; I238-T282 PolarHBondContact N-OG1 2.74Å; I238-V316 HydrophobicContact CG2-CG1 4.07Å; I238-L317 CarbonylContact C-O 3.58Å; I238-L317 VanDerWaalsContact CA-O 3.24Å; I238-L317 WeakPolarHBondContact CA-O 3.47Å
239	A	78.6	Confident	71	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.7	168.1	0	0	0	0	0	111.1	G255 L258 I259 P277 V278 L317	A239-G255 WeakPolarHBondContact CB-O 3.46Å; A239-L258 HydrophobicContact CB-CB 4.03Å; A239-I259 HydrophobicContact CB-CD1 4.38Å; A239-I259 HydrophobicContact CB-CG1 3.86Å; A239-P277 WeakPolarHBondContact CA-O 3.32Å; A239-V278 HydrophobicContact CB-CG1 4.46Å; A239-L317 HydrophobicContact CB-CB 4.3Å; A239-L317 PolarHBondContact N-O 2.89Å; A239-L317 PolarHBondContact O-N 3.13Å
240	L	83.4	Confident	70	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.7	175	-52.1	-179.3	0	0	0	110	I238 P277 I302 A305 L309 V311 Y315 V316	I238-L240 HydrophobicContact CG2-CD2 4.09Å; L240-P277 HydrophobicContact CB-CB 4.23Å; L240-P277 PolarHBondContact N-O 2.73Å; L240-P277 VanDerWaalsContact O-CB 3.24Å; L240-P277 WeakPolarHBondContact O-CB 3.38Å; L240-P277 VanDerWaalsContact O-CG 3.27Å; L240-P277 WeakPolarHBondContact O-CG 3.31Å; L240-I302 HydrophobicContact CD1-CG2 4.32Å; L240-I302 HydrophobicContact CD2-CD1 4.38Å; L240-I302 HydrophobicContact CD2-CG2 4.21Å; L240-A305 HydrophobicContact CD1-CB 3.89Å; L240-L309 HydrophobicContact CD1-CD1 3.86Å; L240-V311 HydrophobicContact CB-CB 4.36Å; L240-V311 HydrophobicContact CB-CG1 4.3Å; L240-Y315 WeakPolarHBondContact CA-O 3.28Å; L240-V316 HydrophobicContact CD2-CB 4.45Å; L240-V316 HydrophobicContact CD2-CG1 4.28Å; L240-V316 HydrophobicContact CD2-CG2 3.85Å
241	L	83.2	Confident	69.3	Low	1 Å²	1	46.9 Å²	46.9	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	144.2	-179.6	-60.6	110	0	0	0	111.7	I245 A251 Q254 L258 F296 V311 G314 Y315	L241-I245 HydrophobicContact CB-CD1 3.69Å; L241-I245 HydrophobicContact CD2-CD1 3.48Å; L241-I245 VanDerWaalsContact CD2-CD1 3.48Å; L241-I245 HydrophobicContact CG-CD1 4.25Å; L241-A251 WeakPolarHBondContact CD1-O 2.88Å; L241-A251 WeakPolarHBondContact CD2-O 3.37Å; L241-Q254 HydrophobicContact CD2-CB 3.37Å; L241-L258 HydrophobicContact CD2-CD1 3.77Å; L241-L258 HydrophobicContact CG-CD1 3.95Å; L241-F296 HydrophobicContact CD1-CE2 4.35Å; L241-V311 WeakPolarHBondContact O-CG1 3.26Å; L241-G314 CarbonylContact O-C 3.49Å; L241-G314 VanDerWaalsContact O-CA 3.27Å; L241-G314 WeakPolarHBondContact O-CA 3.48Å; L241-Y315 HydrophobicContact CB-CD2 4.4Å; L241-Y315 PolarHBondContact N-O 2.01Å; L241-Y315 PolarHBondContact O-N 3.11Å
242	P	82.5	Confident	68.6	Low	51 Å²	51	45.2 Å²	45.2	33%	0.331	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	154.8	179.2	29.5	-36.5	0	0	0	112.7	N244 I245	P242-N244 WeakPolarHBondContact CB-OD1 3.37Å; P242-N244 WeakPolarHBondContact CG-OD1 3.31Å; P242-N244 PolarHBondContact O-N 2.96Å; P242-I245 HydrophobicContact CG-CD1 4.42Å; P242-I245 HydrophobicContact CG-CG1 4.32Å
243	A	79.9	Confident	67.6	Low	41 Å²	41	45.9 Å²	45.9	34%	0.339	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.6	178.9	0	0	0	0	0	114.8	I245 S313	A243-I245 VanDerWaalsContact C-N 3.26Å; A243-I245 PolarHBondContact O-N 3.5Å; A243-S313 PolarHBondContact N-O 3.01Å
244	N	78.2	Confident	66.9	Low	135 Å²	135	42.6 Å²	42.6	72%	0.722	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	8.6	-175.1	67.8	-7.5	0	0	0	114.2	P242	P242-N244 WeakPolarHBondContact CB-OD1 3.37Å; P242-N244 WeakPolarHBondContact CG-OD1 3.31Å; P242-N244 PolarHBondContact O-N 2.96Å
245	I	66.1	Low	66.2	Low	12 Å²	12	40.7 Å²	40.7	6%	0.062	23%	0.232	C	C	.	.			trans	-76.6	129.6	178.2	-59.7	176.6	0	0	0	109.6	L241 P242 A243 T247 N250 A251 Y315	L241-I245 HydrophobicContact CB-CD1 3.69Å; L241-I245 HydrophobicContact CD2-CD1 3.48Å; L241-I245 VanDerWaalsContact CD2-CD1 3.48Å; L241-I245 HydrophobicContact CG-CD1 4.25Å; P242-I245 HydrophobicContact CG-CD1 4.42Å; P242-I245 HydrophobicContact CG-CG1 4.32Å; A243-I245 VanDerWaalsContact C-N 3.26Å; A243-I245 PolarHBondContact O-N 3.5Å; I245-T247 VanDerWaalsContact C-N 3.25Å; I245-T247 PolarHBondContact O-N 3.37Å; I245-T247 VanDerWaalsContact O-N 3.1Å; I245-N250 HydrophobicContact CG2-CB 3.71Å; I245-A251 HydrophobicContact CB-CB 4.08Å; I245-A251 HydrophobicContact CD1-CB 3.84Å; I245-A251 HydrophobicContact CG2-CB 3.89Å; I245-Y315 HydrophobicContact CB-CE2 4.44Å
246	P	47	Very low	65.7	Low	113 Å²	113	41.1 Å²	41.1	73%	0.734	23%	0.231	S	C	*	.	S	Bend	trans	-61.9	-26.6	-167.1	-24.9	32.9	0	0	0	115.6
247	T	48.1	Very low	65.1	Low	55 Å²	55	45 Å²	45	34%	0.337	25%	0.249	S	C	.	.			trans	-144.8	147.6	-178.8	66.4	0	0	0	0	110.6	I245 I249 N250 A251	I245-T247 VanDerWaalsContact C-N 3.25Å; I245-T247 PolarHBondContact O-N 3.37Å; I245-T247 VanDerWaalsContact O-N 3.1Å; T247-I249 PolarHBondContact O-N 3.37Å; T247-N250 PolarHBondContact O-N 2.9Å; T247-N250 VanDerWaalsContact O-N 3.09Å; T247-N250 VanDerWaalsContact OG1-CB 3.27Å; T247-N250 WeakPolarHBondContact OG1-CB 3.4Å; T247-N250 PolarHBondContact OG1-N 3.06Å; T247-N250 VanDerWaalsContact OG1-N 3.14Å; T247-N250 PolarHBondContact OG1-ND2 3Å; T247-N250 VanDerWaalsContact OG1-ND2 3.14Å; T247-A251 PolarHBondContact O-N 3.39Å
248	T	51.5	Low	64.8	Low	50 Å²	50	46.3 Å²	46.3	31%	0.307	26%	0.256	S	S	.	.	H	α-helix	trans	-54.9	-38.4	174.6	-47.9	0	0	0	0	111.9	Y45 A251 M252 F296 Y315	Y45-T248 HydrophobicContact CE1-CG2 4.4Å; Y45-T248 WeakPolarHBondContact OH-CG2 3.47Å; T248-A251 WeakPolarHBondContact O-CB 3.48Å; T248-A251 PolarHBondContact O-N 3.49Å; T248-M252 WeakPolarHBondContact O-CB 3.45Å; T248-M252 PolarHBondContact O-N 2.54Å; T248-F296 HydrophobicContact CG2-CD1 4.2Å; T248-F296 HydrophobicContact CG2-CE1 3.56Å; T248-Y315 HydrophobicContact CG2-CE1 4.28Å
249	I	46.3	Very low	64.4	Low	104 Å²	104	46.6 Å²	46.6	53%	0.533	26%	0.258	S	S	.	.	H	α-helix	trans	-65.2	-44.2	177	-65.8	167.8	0	0	0	111	T247 A251 M252 I253	T247-I249 PolarHBondContact O-N 3.37Å; I249-A251 VanDerWaalsContact C-N 3.27Å; I249-A251 PolarHBondContact O-N 3.19Å; I249-M252 PolarHBondContact O-N 2.63Å; I249-I253 HydrophobicContact CG2-CD1 3.83Å; I249-I253 HydrophobicContact CG2-CG1 4.43Å; I249-I253 VanDerWaalsContact O-CG1 3.32Å; I249-I253 WeakPolarHBondContact O-CG1 3.23Å; I249-I253 PolarHBondContact O-N 2.72Å
250	N	50.1	Low	63.6	Low	64 Å²	64	49.6 Å²	49.6	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-35.8	176.1	-75.4	-17.3	0	0	0	111.5	I245 T247 Q254	I245-N250 HydrophobicContact CG2-CB 3.71Å; T247-N250 PolarHBondContact O-N 2.9Å; T247-N250 VanDerWaalsContact O-N 3.09Å; T247-N250 VanDerWaalsContact OG1-CB 3.27Å; T247-N250 WeakPolarHBondContact OG1-CB 3.4Å; T247-N250 PolarHBondContact OG1-N 3.06Å; T247-N250 VanDerWaalsContact OG1-N 3.14Å; T247-N250 PolarHBondContact OG1-ND2 3Å; T247-N250 VanDerWaalsContact OG1-ND2 3.14Å; N250-Q254 WeakPolarHBondContact O-CB 3.5Å; N250-Q254 VanDerWaalsContact O-CG 3.25Å; N250-Q254 WeakPolarHBondContact O-CG 3.3Å; N250-Q254 PolarHBondContact O-N 2.61Å
251	A	54.2	Low	62.6	Low	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-41.9	175.4	0	0	0	0	0	111.2	L241 I245 T247 T248 I249 Q254 G255 F296 Y315	L241-A251 WeakPolarHBondContact CD1-O 2.88Å; L241-A251 WeakPolarHBondContact CD2-O 3.37Å; I245-A251 HydrophobicContact CB-CB 4.08Å; I245-A251 HydrophobicContact CD1-CB 3.84Å; I245-A251 HydrophobicContact CG2-CB 3.89Å; T247-A251 PolarHBondContact O-N 3.39Å; T248-A251 WeakPolarHBondContact O-CB 3.48Å; T248-A251 PolarHBondContact O-N 3.49Å; I249-A251 VanDerWaalsContact C-N 3.27Å; I249-A251 PolarHBondContact O-N 3.19Å; A251-Q254 PolarHBondContact O-N 2.88Å; A251-G255 PolarHBondContact O-N 3.49Å; A251-F296 HydrophobicContact CB-CZ 3.86Å; A251-Y315 HydrophobicContact CB-CD1 4.23Å; A251-Y315 HydrophobicContact CB-CD2 3.58Å; A251-Y315 HydrophobicContact CB-CE1 4.36Å; A251-Y315 HydrophobicContact CB-CE2 3.75Å; A251-Y315 HydrophobicContact CB-CG 3.84Å
252	M	54.1	Low	61.8	Low	73 Å²	73	53.8 Å²	53.8	36%	0.36	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-46.8	176.3	-168	-177.6	-173.1	0	0	112.2	T248 I249 Q254 G255 F256 F296	T248-M252 WeakPolarHBondContact O-CB 3.45Å; T248-M252 PolarHBondContact O-N 2.54Å; I249-M252 PolarHBondContact O-N 2.63Å; M252-Q254 PolarHBondContact O-N 3.18Å; M252-G255 PolarHBondContact O-N 2.81Å; M252-G255 VanDerWaalsContact O-N 3.14Å; M252-F256 HydrophobicContact CE-CE2 3.73Å; M252-F256 HydrophobicContact CE-CZ 3.65Å; M252-F256 HydrophobicContact CG-CD2 4.2Å; M252-F256 HydrophobicContact CG-CE2 3.58Å; M252-F256 HydrophobicContact CG-CZ 4.16Å; M252-F256 WeakPolarHBondContact O-CD2 3.33Å; M252-F256 PolarHBondContact O-N 3Å; M252-F256 HydrophobicContact SD-CE2 4.19Å; M252-F296 HydrophobicContact CB-CD2 4.42Å; M252-F296 HydrophobicContact CB-CE2 4.19Å; M252-F296 HydrophobicContact CB-CZ 4.25Å; M252-F296 HydrophobicContact CG-CD2 4.32Å; M252-F296 HydrophobicContact CG-CG 4.48Å
253	I	53.9	Low	60.9	Low	50 Å²	50	52.5 Å²	52.5	26%	0.256	28%	0.283	S	S	.	.	H	α-helix	trans	-60.3	-46.8	176.8	-68.5	168.2	0	0	0	110.9	I249 G255 F256 Q257	I249-I253 HydrophobicContact CG2-CD1 3.83Å; I249-I253 HydrophobicContact CG2-CG1 4.43Å; I249-I253 VanDerWaalsContact O-CG1 3.32Å; I249-I253 WeakPolarHBondContact O-CG1 3.23Å; I249-I253 PolarHBondContact O-N 2.72Å; I253-G255 VanDerWaalsContact C-N 3.28Å; I253-G255 PolarHBondContact O-N 3.48Å; I253-F256 PolarHBondContact O-N 2.96Å; I253-Q257 WeakPolarHBondContact O-CG 3.36Å; I253-Q257 PolarHBondContact O-N 3.05Å; I253-Q257 VanDerWaalsContact O-N 3.13Å
254	Q	64.6	Low	60.2	Low	76 Å²	76	52 Å²	52	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-39.9	175.5	-76	178	48.3	0	0	111	L241 N250 A251 M252 F256 Q257 L258	L241-Q254 HydrophobicContact CD2-CB 3.37Å; N250-Q254 WeakPolarHBondContact O-CB 3.5Å; N250-Q254 VanDerWaalsContact O-CG 3.25Å; N250-Q254 WeakPolarHBondContact O-CG 3.3Å; N250-Q254 PolarHBondContact O-N 2.61Å; A251-Q254 PolarHBondContact O-N 2.88Å; M252-Q254 PolarHBondContact O-N 3.18Å; Q254-F256 VanDerWaalsContact C-N 3.33Å; Q254-F256 PolarHBondContact O-N 2.84Å; Q254-Q257 WeakPolarHBondContact O-CB 3.44Å; Q254-Q257 PolarHBondContact O-N 2.84Å; Q254-L258 WeakPolarHBondContact O-CD1 3.45Å; Q254-L258 WeakPolarHBondContact O-CG 3.48Å; Q254-L258 PolarHBondContact O-N 3.11Å
255	G	63.9	Low	59.2	Low	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-44	177.7	0	0	0	0	0	112.2	A239 A251 M252 I253 Q257 L258 I259	A239-G255 WeakPolarHBondContact CB-O 3.46Å; A251-G255 PolarHBondContact O-N 3.49Å; M252-G255 PolarHBondContact O-N 2.81Å; M252-G255 VanDerWaalsContact O-N 3.14Å; I253-G255 VanDerWaalsContact C-N 3.28Å; I253-G255 PolarHBondContact O-N 3.48Å; G255-Q257 VanDerWaalsContact C-N 3.33Å; G255-Q257 PolarHBondContact O-N 3.46Å; G255-L258 PolarHBondContact O-N 2.91Å; G255-I259 WeakPolarHBondContact O-CG1 3.27Å; G255-I259 PolarHBondContact O-N 2.84Å; G255-I259 VanDerWaalsContact O-N 3.1Å
256	F	65.2	Low	58.9	Low	31 Å²	31	57.6 Å²	57.6	14%	0.136	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-40.9	175.6	-72.7	-49.9	0	0	0	112.7	L204 M252 I253 Q254 I259 Q260 C294 L317	L204-F256 HydrophobicContact CD1-CB 3.66Å; L204-F256 HydrophobicContact CD1-CD1 3.48Å; L204-F256 VanDerWaalsContact CD1-CD1 3.48Å; L204-F256 HydrophobicContact CD1-CD2 4.34Å; L204-F256 HydrophobicContact CD1-CE1 4.19Å; L204-F256 HydrophobicContact CD1-CG 3.58Å; M252-F256 HydrophobicContact CE-CE2 3.73Å; M252-F256 HydrophobicContact CE-CZ 3.65Å; M252-F256 HydrophobicContact CG-CD2 4.2Å; M252-F256 HydrophobicContact CG-CE2 3.58Å; M252-F256 HydrophobicContact CG-CZ 4.16Å; M252-F256 WeakPolarHBondContact O-CD2 3.33Å; M252-F256 PolarHBondContact O-N 3Å; M252-F256 HydrophobicContact SD-CE2 4.19Å; I253-F256 PolarHBondContact O-N 2.96Å; Q254-F256 VanDerWaalsContact C-N 3.33Å; Q254-F256 PolarHBondContact O-N 2.84Å; F256-I259 PolarHBondContact O-N 2.75Å; F256-Q260 PolarHBondContact O-N 3.3Å; F256-C294 HydrophobicContact CE1-CB 4.36Å; F256-L317 HydrophobicContact CD1-CD2 3.65Å; F256-L317 HydrophobicContact CE1-CD1 3.99Å; F256-L317 HydrophobicContact CE1-CD2 3.94Å; F256-L317 HydrophobicContact CG-CD2 4.1Å; F256-L317 HydrophobicContact CZ-CD1 4.2Å; F256-L317 VanDerWaalsContact N-CD2 3.34Å
257	Q	62.8	Low	59.7	Low	81 Å²	81	56.6 Å²	56.6	38%	0.379	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-43.2	175.7	-70.5	172.8	-17.2	0	0	111.5	I253 Q254 G255 I259 Q260 D261	I253-Q257 WeakPolarHBondContact O-CG 3.36Å; I253-Q257 PolarHBondContact O-N 3.05Å; I253-Q257 VanDerWaalsContact O-N 3.13Å; Q254-Q257 WeakPolarHBondContact O-CB 3.44Å; Q254-Q257 PolarHBondContact O-N 2.84Å; G255-Q257 VanDerWaalsContact C-N 3.33Å; G255-Q257 PolarHBondContact O-N 3.46Å; Q257-I259 VanDerWaalsContact C-N 3.31Å; Q257-I259 PolarHBondContact O-N 3.1Å; Q257-Q260 WeakPolarHBondContact O-CA 3.02Å; Q257-Q260 WeakPolarHBondContact O-CB 2.99Å; Q257-Q260 PolarHBondContact O-N 3.13Å; Q257-D261 PolarHBondContact O-N 2.81Å
258	L	69.2	Low	60.5	Low	28 Å²	28	56.5 Å²	56.5	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-36.1	179.6	-68.4	160.5	0	0	0	112.6	A239 L241 Q254 G255 S262 P277	A239-L258 HydrophobicContact CB-CB 4.03Å; L241-L258 HydrophobicContact CD2-CD1 3.77Å; L241-L258 HydrophobicContact CG-CD1 3.95Å; Q254-L258 WeakPolarHBondContact O-CD1 3.45Å; Q254-L258 WeakPolarHBondContact O-CG 3.48Å; Q254-L258 PolarHBondContact O-N 3.11Å; G255-L258 PolarHBondContact O-N 2.91Å; L258-S262 PolarHBondContact O-N 3.42Å; L258-P277 HydrophobicContact CB-CG 3.98Å; L258-P277 HydrophobicContact CD1-CG 3.53Å; L258-P277 HydrophobicContact CD2-CG 3.66Å; L258-P277 HydrophobicContact CG-CG 3.88Å
259	I	68.8	Low	61.1	Low	10 Å²	10	55 Å²	55	5%	0.051	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-45	171.5	-67.8	175.4	0	0	0	110.2	A237 A239 G255 F256 Q257 S262 V278 I286 L317 C319	A237-I259 HydrophobicContact CB-CD1 4.12Å; A237-I259 HydrophobicContact CB-CG1 4.36Å; A237-I259 HydrophobicContact CB-CG2 3.86Å; A239-I259 HydrophobicContact CB-CD1 4.38Å; A239-I259 HydrophobicContact CB-CG1 3.86Å; G255-I259 WeakPolarHBondContact O-CG1 3.27Å; G255-I259 PolarHBondContact O-N 2.84Å; G255-I259 VanDerWaalsContact O-N 3.1Å; F256-I259 PolarHBondContact O-N 2.75Å; Q257-I259 VanDerWaalsContact C-N 3.31Å; Q257-I259 PolarHBondContact O-N 3.1Å; I259-S262 VanDerWaalsContact O-CB 3.22Å; I259-S262 WeakPolarHBondContact O-CB 3.24Å; I259-S262 PolarHBondContact O-N 2.99Å; I259-S262 PolarHBondContact O-OG 2.73Å; I259-V278 HydrophobicContact CG1-CG1 4.42Å; I259-I286 HydrophobicContact CG2-CD1 3.6Å; I259-I286 HydrophobicContact CG2-CG1 4.2Å; I259-I286 WeakPolarHBondContact O-CD1 3.38Å; I259-L317 HydrophobicContact CD1-CD2 3.74Å; I259-L317 HydrophobicContact CD1-CG 4.24Å; I259-C319 HydrophobicContact CD1-CB 4.22Å
260	Q	62.3	Low	61.9	Low	62 Å²	62	50.8 Å²	50.8	29%	0.29	26%	0.255	S	S	.	.	H	α-helix	trans	-67.1	-42.6	-180	-69.6	177.7	-4.6	0	0	112.9	L203 F256 Q257 S262	L203-Q260 VanDerWaalsContact C-NE2 3.27Å; L203-Q260 PolarHBondContact O-NE2 2.82Å; F256-Q260 PolarHBondContact O-N 3.3Å; Q257-Q260 WeakPolarHBondContact O-CA 3.02Å; Q257-Q260 WeakPolarHBondContact O-CB 2.99Å; Q257-Q260 PolarHBondContact O-N 3.13Å; Q260-S262 PolarHBondContact O-N 2.85Å
261	D	62.8	Low	62.3	Low	88 Å²	88	51.1 Å²	51.1	47%	0.471	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-2.8	-177.8	-66.3	-19.7	0	0	0	112.9	Q257 Y263 G273	Q257-D261 PolarHBondContact O-N 2.81Å; D261-Y263 VanDerWaalsContact C-N 3.3Å; D261-Y263 PolarHBondContact O-N 2.91Å; D261-G273 WeakPolarHBondContact O-CA 3.14Å
262	S	65.8	Low	62.2	Low	5 Å²	5	57.2 Å²	57.2	4%	0.035	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.3	-179.2	73	0	0	0	0	114.3	L258 I259 Q260 C283 I286	L258-S262 PolarHBondContact O-N 3.42Å; I259-S262 VanDerWaalsContact O-CB 3.22Å; I259-S262 WeakPolarHBondContact O-CB 3.24Å; I259-S262 PolarHBondContact O-N 2.99Å; I259-S262 PolarHBondContact O-OG 2.73Å; Q260-S262 PolarHBondContact O-N 2.85Å; S262-C283 PolarHBondContact O-SG 3.3Å; S262-C283 WeakPolarHBondContact OG-CA 3.41Å; S262-I286 WeakPolarHBondContact OG-CD1 3.34Å
263	Y	65.1	Low	62.1	Low	24 Å²	24	54.4 Å²	54.4	9%	0.094	28%	0.275	C	S	.	.	S	Bend	trans	-111.7	123	-174.9	-176.8	-90.9	0	0	0	111.5	D261 I265 D268 C283 P331 H332	D261-Y263 VanDerWaalsContact C-N 3.3Å; D261-Y263 PolarHBondContact O-N 2.91Å; Y263-I265 HydrophobicContact CD1-CG1 4.3Å; Y263-I265 PolarHBondContact O-N 2.82Å; Y263-D268 WeakPolarHBondContact OH-CA 3.5Å; Y263-D268 PolarHBondContact OH-OD1 2.88Å; Y263-C283 VanDerWaalsContact CD2-SG 3.54Å; Y263-P331 HydrophobicContact CD1-CG 4.27Å; Y263-P331 HydrophobicContact CD2-CG 3.73Å; Y263-P331 HydrophobicContact CE1-CG 4.06Å; Y263-P331 HydrophobicContact CE2-CG 3.52Å; Y263-P331 HydrophobicContact CG-CG 4.12Å; Y263-P331 WeakPolarHBondContact OH-CD 3.44Å; Y263-H332 AromaticContact CD1-NE2 3.59Å; Y263-H332 AromaticContact CE1-CE1 3.78Å; Y263-H332 AromaticContact CE1-NE2 3.14Å; Y263-H332 WeakPolarHBondContact CE1-NE2 3.34Å
264	N	64.6	Low	61.5	Low	32 Å²	32	57.4 Å²	57.4	17%	0.171	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-85	107.4	174	-171.2	-45.4	0	0	0	110.5	E266 L267 D268 S269 Q272	N264-E266 VanDerWaalsContact C-N 3.31Å; N264-E266 PolarHBondContact O-N 3.02Å; N264-E266 PolarHBondContact OD1-N 2.84Å; N264-L267 HydrophobicContact CB-CB 4.35Å; N264-L267 PolarHBondContact OD1-N 2.83Å; N264-D268 PolarHBondContact O-N 2.83Å; N264-S269 WeakPolarHBondContact CA-O 3.5Å; N264-S269 WeakPolarHBondContact CB-O 3.23Å; N264-S269 PolarHBondContact N-O 3.43Å; N264-S269 PolarHBondContact O-N 3.08Å; N264-Q272 HydrophobicContact CB-CB 4.5Å; N264-Q272 PolarHBondContact ND2-O 3.22Å; N264-Q272 VanDerWaalsContact ND2-O 3.07Å
265	I	58	Low	60.6	Low	90 Å²	90	63.8 Å²	63.8	46%	0.462	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-38.7	-179.2	-58	-166.8	0	0	0	112.7	Y263 H332	Y263-I265 HydrophobicContact CD1-CG1 4.3Å; Y263-I265 PolarHBondContact O-N 2.82Å; I265-H332 VanDerWaalsContact CG1-NE2 3.33Å; I265-H332 WeakPolarHBondContact CG1-NE2 3.27Å; I265-H332 WeakPolarHBondContact CG2-CE1 3.33Å
266	E	58.9	Low	59.8	Low	174 Å²	174	69.9 Å²	69.9	81%	0.813	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-40.6	-174.1	-61.2	-173.8	162.2	0	0	111.8	N264	N264-E266 VanDerWaalsContact C-N 3.31Å; N264-E266 PolarHBondContact O-N 3.02Å; N264-E266 PolarHBondContact OD1-N 2.84Å
267	L	62.9	Low	59.2	Low	92 Å²	92	69 Å²	69	48%	0.482	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-2.1	-174.9	-63.1	177.5	0	0	0	113.5	N264 S269 Q272	N264-L267 HydrophobicContact CB-CB 4.35Å; N264-L267 PolarHBondContact OD1-N 2.83Å; L267-S269 WeakPolarHBondContact O-CB 3.29Å; L267-S269 PolarHBondContact O-N 3.03Å; L267-Q272 HydrophobicContact CD1-CB 3.7Å; L267-Q272 HydrophobicContact CD1-CG 3.9Å
268	D	65.9	Low	58.7	Low	52 Å²	52	66 Å²	66	28%	0.278	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	44.1	-174.9	-175	23.2	0	0	0	111.8	Y263 N264 R330	Y263-D268 WeakPolarHBondContact OH-CA 3.5Å; Y263-D268 PolarHBondContact OH-OD1 2.88Å; N264-D268 PolarHBondContact O-N 2.83Å; D268-R330 VanDerWaalsContact CG-CD 3.48Å; D268-R330 VanDerWaalsContact OD1-CG 3.3Å; D268-R330 WeakPolarHBondContact OD1-CG 3.13Å; D268-R330 IonicContact OD1-NE 2.94Å; D268-R330 WeakPolarHBondContact OD2-CD 3.11Å; D268-R330 VanDerWaalsContact OD2-CG 3.31Å; D268-R330 WeakPolarHBondContact OD2-CG 3.34Å; D268-R330 IonicContact OD2-CZ 2.7Å; D268-R330 IonicContact OD2-NE 3.59Å; D268-R330 PolarHBondContact OD2-NE 2.81Å; D268-R330 IonicContact OD2-NH2 3.1Å; D268-R330 PolarHBondContact OD2-NH2 3.06Å
269	S	64.4	Low	57.9	Low	20 Å²	20	66.4 Å²	66.4	14%	0.14	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-146.2	141.2	-165.6	178.1	0	0	0	0	112.2	N264 L267 D271	N264-S269 WeakPolarHBondContact CA-O 3.5Å; N264-S269 WeakPolarHBondContact CB-O 3.23Å; N264-S269 PolarHBondContact N-O 3.43Å; N264-S269 PolarHBondContact O-N 3.08Å; L267-S269 WeakPolarHBondContact O-CB 3.29Å; L267-S269 PolarHBondContact O-N 3.03Å; S269-D271 VanDerWaalsContact C-N 3.27Å; S269-D271 VanDerWaalsContact OG-CB 3.3Å; S269-D271 WeakPolarHBondContact OG-CB 3.33Å; S269-D271 PolarHBondContact OG-N 2.8Å; S269-D271 PolarHBondContact OG-OD2 3.43Å
270	C	63.6	Low	57	Low	15 Å²	15	71.7 Å²	71.7	10%	0.101	35%	0.353	C	S	.	.	S	Bend	trans	-82.1	-8.9	169	-60.6	0	0	0	0	112.4	Q280 C283	C270-Q280 HydrophobicContact CB-CG 4.32Å; C270-C283 WeakPolarHBondContact CA-SG 3.24Å; C270-C283 HydrophobicContact CB-CB 3.59Å; C270-C283 WeakPolarHBondContact CB-SG 3.41Å; C270-C283 WeakPolarHBondContact SG-CB 3.08Å; C270-C283 CovalentContact SG-SG 2.03Å; C270-C283 PolarHBondContact SG-SG 2.73Å
271	D	57.1	Low	56.6	Low	71 Å²	71	73.4 Å²	73.4	38%	0.38	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-10.8	-170.6	-58	-44.5	0	0	0	112.9	S269 R276 Q280	S269-D271 VanDerWaalsContact C-N 3.27Å; S269-D271 VanDerWaalsContact OG-CB 3.3Å; S269-D271 WeakPolarHBondContact OG-CB 3.33Å; S269-D271 PolarHBondContact OG-N 2.8Å; S269-D271 PolarHBondContact OG-OD2 3.43Å; D271-R276 PolarHBondContact O-NH2 2.97Å; D271-Q280 PolarHBondContact OD1-NE2 3.41Å
272	Q	53.1	Low	56.4	Low	128 Å²	128	69.2 Å²	69.2	60%	0.598	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.3	27.8	-174.6	-60.7	-137.2	-5.1	0	0	113.7	N264 L267	N264-Q272 HydrophobicContact CB-CB 4.5Å; N264-Q272 PolarHBondContact ND2-O 3.22Å; N264-Q272 VanDerWaalsContact ND2-O 3.07Å; L267-Q272 HydrophobicContact CD1-CB 3.7Å; L267-Q272 HydrophobicContact CD1-CG 3.9Å
273	G	50.5	Low	56.1	Low	14 Å²	14	69 Å²	69	14%	0.144	34%	0.341	C	S	.	.			trans	-69.2	136	167.2	0	0	0	0	0	111.5	D261 R275	D261-G273 WeakPolarHBondContact O-CA 3.14Å; G273-R275 PolarHBondContact O-N 2.82Å
274	V	42.2	Very low	55.8	Low	112 Å²	112	73 Å²	73	68%	0.679	36%	0.356	S	S	*	.	S	Bend	trans	-71.1	112.9	-178	-179.1	0	0	0	0	108.5
275	R	45.8	Very low	55.4	Low	211 Å²	211	71.6 Å²	71.6	80%	0.796	35%	0.348	S	S	*	.	S	Bend	trans	70.5	86.1	179.6	-55.4	172.3	-175.5	-138.1	-0.6	113.8	G273 P277	G273-R275 PolarHBondContact O-N 2.82Å; R275-P277 WeakPolarHBondContact O-CD 3.05Å
276	R	47.7	Very low	55.3	Low	128 Å²	128	69.5 Å²	69.5	48%	0.483	34%	0.338	S	S	.	.			trans	-67.2	124.5	175	-58.6	-176.5	-175	-170.3	2.8	110.1	D271 L309	D271-R276 PolarHBondContact O-NH2 2.97Å; R276-L309 VanDerWaalsContact C-CD2 3.44Å; R276-L309 HydrophobicContact CB-CD2 3.86Å; R276-L309 WeakPolarHBondContact O-CD2 3.32Å
277	P	51.4	Low	54.9	Low	11 Å²	11	64.1 Å²	64.1	7%	0.071	31%	0.31	C	S	.	.			trans	-138.7	58.6	133	41.5	-29.1	0	0	0	112.3	A239 L240 L258 R275 L309	A239-P277 WeakPolarHBondContact CA-O 3.32Å; L240-P277 HydrophobicContact CB-CB 4.23Å; L240-P277 PolarHBondContact N-O 2.73Å; L240-P277 VanDerWaalsContact O-CB 3.24Å; L240-P277 WeakPolarHBondContact O-CB 3.38Å; L240-P277 VanDerWaalsContact O-CG 3.27Å; L240-P277 WeakPolarHBondContact O-CG 3.31Å; L258-P277 HydrophobicContact CB-CG 3.98Å; L258-P277 HydrophobicContact CD1-CG 3.53Å; L258-P277 HydrophobicContact CD2-CG 3.66Å; L258-P277 HydrophobicContact CG-CG 3.88Å; R275-P277 WeakPolarHBondContact O-CD 3.05Å; P277-L309 HydrophobicContact CB-CD1 4.1Å; P277-L309 HydrophobicContact CB-CD2 4.03Å
278	V	53.4	Low	54.2	Low	20 Å²	20	64.7 Å²	64.7	12%	0.121	31%	0.31	C	S	.	.	S	Bend	trans	-149.7	123.9	-168.6	-91.4	0	0	0	0	107.1	I238 A239 I259 T282	I238-V278 WeakPolarHBondContact O-CG1 3.3Å; A239-V278 HydrophobicContact CB-CG1 4.46Å; I259-V278 HydrophobicContact CG1-CG1 4.42Å; V278-T282 HydrophobicContact CB-CG2 3.83Å; V278-T282 HydrophobicContact CG1-CG2 3.57Å
279	S	51.3	Low	53.5	Low	35 Å²	35	62.3 Å²	62.3	25%	0.245	30%	0.298	C	S	.	.			trans	-66.2	155	-179.8	62.4	0	0	0	0	111.9	D281 T282 C283	S279-D281 PolarHBondContact O-N 3.29Å; S279-D281 VanDerWaalsContact O-N 3.1Å; S279-T282 WeakPolarHBondContact O-CA 3.43Å; S279-T282 WeakPolarHBondContact O-CB 3.44Å; S279-T282 PolarHBondContact O-N 2.92Å; S279-T282 WeakPolarHBondContact OG-CB 3.24Å; S279-T282 PolarHBondContact OG-N 3.42Å; S279-T282 PolarHBondContact OG-OG1 3.02Å; S279-C283 PolarHBondContact O-N 2.82Å
280	Q	50.4	Low	53	Low	121 Å²	121	65 Å²	65	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-52.6	-34.4	175.6	-94	-178.4	-14.1	0	0	112.2	C270 D271	C270-Q280 HydrophobicContact CB-CG 4.32Å; D271-Q280 PolarHBondContact OD1-NE2 3.41Å
281	D	53.4	Low	52.9	Low	98 Å²	98	67.6 Å²	67.6	52%	0.524	32%	0.321	S	S	.	.	H	α-helix	trans	-72.2	-27.4	176	-63.4	-32.6	0	0	0	113.6	K228 S279 S285	K228-D281 HydrophobicContact CD-CB 3.97Å; S279-D281 PolarHBondContact O-N 3.29Å; S279-D281 VanDerWaalsContact O-N 3.1Å; D281-S285 PolarHBondContact O-OG 3.14Å
282	T	59.4	Low	53.3	Low	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-70.6	-41.8	176.1	-72.6	0	0	0	0	111.3	A237 I238 V278 S279 R284 S285	A237-T282 HydrophobicContact CB-CG2 3.65Å; I238-T282 PolarHBondContact N-OG1 2.74Å; V278-T282 HydrophobicContact CB-CG2 3.83Å; V278-T282 HydrophobicContact CG1-CG2 3.57Å; S279-T282 WeakPolarHBondContact O-CA 3.43Å; S279-T282 WeakPolarHBondContact O-CB 3.44Å; S279-T282 PolarHBondContact O-N 2.92Å; S279-T282 WeakPolarHBondContact OG-CB 3.24Å; S279-T282 PolarHBondContact OG-N 3.42Å; S279-T282 PolarHBondContact OG-OG1 3.02Å; T282-R284 VanDerWaalsContact C-N 3.3Å; T282-R284 PolarHBondContact O-N 2.85Å; T282-S285 PolarHBondContact O-N 2.79Å
283	C	60.3	Low	53.8	Low	2 Å²	2	58.5 Å²	58.5	1%	0.014	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-32.6	-176.2	162.6	0	0	0	0	113.3	S262 Y263 C270 S279	S262-C283 PolarHBondContact O-SG 3.3Å; S262-C283 WeakPolarHBondContact OG-CA 3.41Å; Y263-C283 VanDerWaalsContact CD2-SG 3.54Å; C270-C283 WeakPolarHBondContact CA-SG 3.24Å; C270-C283 HydrophobicContact CB-CB 3.59Å; C270-C283 WeakPolarHBondContact CB-SG 3.41Å; C270-C283 WeakPolarHBondContact SG-CB 3.08Å; C270-C283 CovalentContact SG-SG 2.03Å; C270-C283 PolarHBondContact SG-SG 2.73Å; S279-C283 PolarHBondContact O-N 2.82Å
284	R	57.2	Low	54.9	Low	107 Å²	107	58.5 Å²	58.5	40%	0.404	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-10.1	179.5	-65.2	-176.1	178.4	-120.2	1	114.2	T282 I286 A325 E327	T282-R284 VanDerWaalsContact C-N 3.3Å; T282-R284 PolarHBondContact O-N 2.85Å; R284-I286 PolarHBondContact O-N 3.05Å; R284-A325 WeakPolarHBondContact O-CB 3.22Å; R284-E327 PolarHBondContact NH1-O 2.83Å
285	S	56.7	Low	56.3	Low	2 Å²	2	53.3 Å²	53.3	1%	0.014	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.5	178.4	-64.3	0	0	0	0	113.6	V236 D281 T282 R287	V236-S285 PolarHBondContact O-OG 3.04Å; D281-S285 PolarHBondContact O-OG 3.14Å; T282-S285 PolarHBondContact O-N 2.79Å; S285-R287 PolarHBondContact O-N 3.35Å; S285-R287 VanDerWaalsContact O-N 3.13Å
286	I	55.9	Low	57.8	Low	47 Å²	47	43.6 Å²	43.6	24%	0.241	21%	0.207	C	C	.	.			trans	-90.4	49.9	-167.4	-45.8	175	0	0	0	112.4	I259 S262 R284	I259-I286 HydrophobicContact CG2-CD1 3.6Å; I259-I286 HydrophobicContact CG2-CG1 4.2Å; I259-I286 WeakPolarHBondContact O-CD1 3.38Å; S262-I286 WeakPolarHBondContact OG-CD1 3.34Å; R284-I286 PolarHBondContact O-N 3.05Å
287	R	51.2	Low	59.4	Low	60 Å²	60	38.5 Å²	38.5	23%	0.226	19%	0.19	C	C	.	.	S	Bend	trans	-128.1	128.6	177.8	-146.5	-174	-165.1	-167.9	10.3	114.8	S285 G289 A325 R330 P331	S285-R287 PolarHBondContact O-N 3.35Å; S285-R287 VanDerWaalsContact O-N 3.13Å; R287-G289 VanDerWaalsContact C-N 3.28Å; R287-G289 PolarHBondContact O-N 2.9Å; R287-A325 HydrophobicContact CB-CB 3.7Å; R287-R330 PolarHBondContact NE-O 2.88Å; R287-R330 PolarHBondContact NH1-O 3.35Å; R287-R330 PolarHBondContact NH2-O 2.83Å; R287-P331 HydrophobicContact CB-CB 4.48Å; R287-P331 VanDerWaalsContact CD-CA 3.5Å; R287-P331 WeakPolarHBondContact CD-O 2.99Å; R287-P331 HydrophobicContact CG-CB 4.23Å; R287-P331 WeakPolarHBondContact CG-O 3.05Å; R287-P331 VanDerWaalsContact NE-CA 3.28Å; R287-P331 PolarHBondContact NE-O 2.86Å
288	Q	48.6	Very low	61	Low	104 Å²	104	42.4 Å²	42.4	49%	0.486	20%	0.204	S	C	.	.			trans	29.8	44.7	163.7	-68.4	-172	-15.7	0	0	117.8
289	G	50	Low	62.4	Low	2 Å²	2	41.7 Å²	41.7	2%	0.021	20%	0.199	C	C	.	.			trans	-86.6	133.3	167.9	0	0	0	0	0	110.5	R207 R287 E291	R207-G289 WeakPolarHBondContact CG-O 3.42Å; R287-G289 VanDerWaalsContact C-N 3.28Å; R287-G289 PolarHBondContact O-N 2.9Å; G289-E291 VanDerWaalsContact C-N 3.26Å; G289-E291 PolarHBondContact O-N 3.29Å
290	N	53.9	Low	64	Low	77 Å²	77	45.7 Å²	45.7	41%	0.412	22%	0.223	S	C	.	.	S	Bend	trans	-71.5	-22.3	176.5	-74.5	-6.6	0	0	0	112.3	R207 F208 S322 K350	R207-N290 WeakPolarHBondContact CA-O 3.35Å; F208-N290 VanDerWaalsContact CD2-O 3.32Å; F208-N290 WeakPolarHBondContact CD2-O 3.48Å; F208-N290 PolarHBondContact N-O 3Å; N290-S322 PolarHBondContact N-OG 3.01Å; N290-K350 PolarHBondContact OD1-NZ 2.84Å
291	E	62.2	Low	65.8	Low	69 Å²	69	44.3 Å²	44.3	32%	0.322	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	147.3	-173.5	-45.7	-179.4	165.2	0	0	111.8	F208 N210 I213 G289 S322	F208-E291 HydrophobicContact CB-CG 4.28Å; F208-E291 CarbonylContact O-C 3.08Å; F208-E291 VanDerWaalsContact O-CA 3.28Å; F208-E291 WeakPolarHBondContact O-CA 3.38Å; N210-E291 HydrophobicContact CB-CB 4.01Å; N210-E291 PolarHBondContact ND2-OE2 3.09Å; I213-E291 HydrophobicContact CD1-CB 3.91Å; G289-E291 VanDerWaalsContact C-N 3.26Å; G289-E291 PolarHBondContact O-N 3.29Å; E291-S322 PolarHBondContact N-OG 3.11Å; E291-S322 PolarHBondContact O-N 3.07Å; E291-S322 VanDerWaalsContact O-N 3.08Å
292	T	64.4	Low	67.3	Low	9 Å²	9	40.2 Å²	40.2	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	157.7	179	-155.7	0	0	0	0	111.1	R207 F208 W209 N210 G320	R207-T292 HydrophobicContact CB-CG2 3.3Å; R207-T292 HydrophobicContact CG-CG2 3.89Å; R207-T292 PolarHBondContact NH1-OG1 3.12Å; F208-T292 PolarHBondContact O-N 3.04Å; W209-T292 CarbonylContact C-O 3.46Å; W209-T292 WeakPolarHBondContact CA-O 3.4Å; W209-T292 HydrophobicContact CE3-CG2 4.49Å; N210-T292 PolarHBondContact N-O 2.94Å; T292-G320 WeakPolarHBondContact CA-O 3.21Å; T292-G320 PolarHBondContact OG1-O 3.07Å
293	G	64.6	Low	68.5	Low	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	143.7	166.1	0	0	0	0	0	108.8	I213 G320	I213-G293 VanDerWaalsContact CG2-N 3.32Å; G293-G320 PolarHBondContact N-O 3.05Å; G293-G320 PolarHBondContact O-N 3Å
294	C	73.3	Confident	69.2	Low	14 Å²	14	48.1 Å²	48.1	10%	0.095	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	152.3	-177.7	-54.8	0	0	0	0	111.2	W209 F256 L317 A318 C319	W209-C294 HydrophobicContact CH2-CB 4.33Å; W209-C294 HydrophobicContact CZ3-CB 4.49Å; F256-C294 HydrophobicContact CE1-CB 4.36Å; C294-L317 HydrophobicContact CB-CD1 4.43Å; C294-A318 CarbonylContact C-O 3.09Å; C294-A318 WeakPolarHBondContact CA-O 3.34Å; C294-A318 WeakPolarHBondContact CB-O 3.23Å; C294-C319 HydrophobicContact CB-CB 4.11Å; C294-C319 WeakPolarHBondContact CB-SG 3.49Å; C294-C319 VanDerWaalsContact SG-CA 3.54Å; C294-C319 WeakPolarHBondContact SG-CB 3.47Å; C294-C319 CovalentContact SG-SG 2.05Å; C294-C319 PolarHBondContact SG-SG 2.88Å
295	G	70.4	Confident	69.8	Low	2 Å²	2	44.2 Å²	44.2	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.9	170.8	0	0	0	0	0	110.8	A318	G295-A318 PolarHBondContact N-O 3.26Å; G295-A318 PolarHBondContact O-N 2.03Å
296	F	78.8	Confident	70.3	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	127	-174.6	-173.8	-99.3	0	0	0	109.9	Y45 Q218 L241 T248 A251 M252 Y315 V316 L317	Y45-F296 HydrophobicContact CE1-CD1 4.45Å; Q218-F296 PolarHBondContact NE2-O 3.27Å; L241-F296 HydrophobicContact CD1-CE2 4.35Å; T248-F296 HydrophobicContact CG2-CD1 4.2Å; T248-F296 HydrophobicContact CG2-CE1 3.56Å; A251-F296 HydrophobicContact CB-CZ 3.86Å; M252-F296 HydrophobicContact CB-CD2 4.42Å; M252-F296 HydrophobicContact CB-CE2 4.19Å; M252-F296 HydrophobicContact CB-CZ 4.25Å; M252-F296 HydrophobicContact CG-CD2 4.32Å; M252-F296 HydrophobicContact CG-CG 4.48Å; F296-Y315 AromaticContact CE1-CD1 3.52Å; F296-Y315 HydrophobicContact CE1-CD1 3.52Å; F296-Y315 HydrophobicContact CE1-CE1 4.18Å; F296-Y315 HydrophobicContact CE1-CG 4.25Å; F296-Y315 HydrophobicContact CE2-CD1 4.47Å; F296-Y315 HydrophobicContact CE2-CG 4.44Å; F296-Y315 AromaticContact CZ-CD1 3.4Å; F296-Y315 HydrophobicContact CZ-CD1 3.4Å; F296-Y315 HydrophobicContact CZ-CE1 4.28Å; F296-Y315 AromaticContact CZ-CG 3.65Å; F296-Y315 HydrophobicContact CZ-CG 3.65Å; F296-V316 WeakPolarHBondContact CA-O 3.21Å; F296-L317 HydrophobicContact CB-CD1 4.25Å; F296-L317 HydrophobicContact CD2-CB 3.8Å; F296-L317 HydrophobicContact CD2-CD1 3.78Å; F296-L317 HydrophobicContact CD2-CG 4.39Å; F296-L317 HydrophobicContact CE2-CB 4.21Å; F296-L317 HydrophobicContact CG-CD1 4.48Å
297	T	80.7	Confident	70.8	Confident	21 Å²	21	51.1 Å²	51.1	13%	0.129	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150.2	-179.7	-93.4	0	0	0	0	111.3	Q218 A221 D222 Y315 V316	Q218-T297 PolarHBondContact NE2-OG1 2.97Å; Q218-T297 VanDerWaalsContact NE2-OG1 3.08Å; A221-T297 WeakPolarHBondContact O-CB 3.49Å; A221-T297 WeakPolarHBondContact O-CG2 3.24Å; D222-T297 WeakPolarHBondContact OD1-CB 3.4Å; D222-T297 PolarHBondContact OD1-OG1 2.87Å; T297-Y315 CarbonylContact O-C 3.26Å; T297-Y315 WeakPolarHBondContact O-CA 3.49Å; T297-V316 PolarHBondContact N-O 3.42Å; T297-V316 PolarHBondContact O-N 2.64Å
298	R	84.1	Confident	71.4	Confident	94 Å²	94	52 Å²	52	36%	0.355	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.5	170.6	-169.6	-175.7	-175.5	-177.8	3	109.5	N36 G314 Y315	N36-R298 PolarHBondContact OD1-NH1 3.34Å; R298-G314 CarbonylContact C-O 3.59Å; R298-G314 VanDerWaalsContact CA-O 3.3Å; R298-G314 WeakPolarHBondContact CA-O 3.15Å; R298-G314 WeakPolarHBondContact CG-O 3.32Å; R298-Y315 HydrophobicContact CB-CD1 3.89Å; R298-Y315 HydrophobicContact CB-CE1 3.99Å; R298-Y315 HydrophobicContact CG-CD1 3.97Å; R298-Y315 HydrophobicContact CG-CE1 3.84Å
299	C	84.6	Confident	72.1	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.027	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.7	-176.2	-63.8	0	0	0	0	110.7	C224 T301 I302 G314 V316	C224-C299 WeakPolarHBondContact CA-SG 3.43Å; C224-C299 HydrophobicContact CB-CB 3.68Å; C224-C299 WeakPolarHBondContact CB-SG 3.32Å; C224-C299 VanDerWaalsContact SG-CA 3.55Å; C224-C299 WeakPolarHBondContact SG-CB 3.38Å; C224-C299 CovalentContact SG-SG 2.03Å; C224-C299 PolarHBondContact SG-SG 3.39Å; C299-T301 VanDerWaalsContact C-N 3.29Å; C299-I302 HydrophobicContact CB-CD1 4.41Å; C299-I302 HydrophobicContact CB-CG1 3.63Å; C299-G314 PolarHBondContact N-O 3.19Å; C299-G314 PolarHBondContact O-N 3.29Å; C299-V316 HydrophobicContact CB-CG2 4.4Å; C299-V316 VanDerWaalsContact SG-CG2 3.52Å
300	T	84.4	Confident	73.1	Confident	120 Å²	120	55.2 Å²	55.2	74%	0.736	32%	0.32	S	S	*	.	S	Bend	trans	-68.7	-32.3	172.2	48.1	0	0	0	0	111.8	S313	T300-S313 VanDerWaalsContact O-CB 3.25Å; T300-S313 WeakPolarHBondContact O-CB 3.49Å
301	T	87.2	Confident	74.1	Confident	92 Å²	92	52.2 Å²	52.2	56%	0.564	31%	0.305	S	S	*	.	S	Bend	trans	-138	131	172.4	-52.4	0	0	0	0	108.2	C299 D312	C299-T301 VanDerWaalsContact C-N 3.29Å; T301-D312 CarbonylContact C-O 3.54Å; T301-D312 WeakPolarHBondContact CA-O 3.26Å
302	I	85.8	Confident	74.9	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.062	32%	0.317	C	S	.	.			trans	-103.3	116.5	173.4	-57.3	177.7	0	0	0	108.2	C224 L240 C299 A305 V311 D312 V316	C224-I302 WeakPolarHBondContact O-CA 3.47Å; L240-I302 HydrophobicContact CD1-CG2 4.32Å; L240-I302 HydrophobicContact CD2-CD1 4.38Å; L240-I302 HydrophobicContact CD2-CG2 4.21Å; C299-I302 HydrophobicContact CB-CD1 4.41Å; C299-I302 HydrophobicContact CB-CG1 3.63Å; I302-A305 HydrophobicContact CG2-CB 4.01Å; I302-V311 HydrophobicContact CD1-CG1 3.86Å; I302-D312 PolarHBondContact N-O 2.85Å; I302-V316 HydrophobicContact CD1-CG2 4.04Å; I302-V316 HydrophobicContact CG1-CG2 4.26Å
303	T	83.9	Confident	75.9	Confident	70 Å²	70	55.6 Å²	55.6	43%	0.429	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-85	151.7	178.5	62.6	0	0	0	0	110.8	C224 S225 G226 A305	C224-T303 PolarHBondContact O-N 2.85Å; C224-T303 PolarHBondContact O-OG1 3.34Å; S225-T303 CarbonylContact C-O 3.55Å; S225-T303 WeakPolarHBondContact CA-O 3.49Å; G226-T303 PolarHBondContact N-O 2.75Å; T303-A305 PolarHBondContact O-N 3.29Å
304	N	74.4	Confident	76.9	Confident	98 Å²	98	55.7 Å²	55.7	52%	0.524	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	22.5	176.5	-51.9	-47.7	0	0	0	115.3	Q227	Q227-N304 HydrophobicContact CB-CB 4.07Å; Q227-N304 HydrophobicContact CG-CB 3.86Å; Q227-N304 WeakPolarHBondContact CG-O 3.47Å
305	A	70.1	Confident	77.3	Confident	25 Å²	25	55.5 Å²	55.5	21%	0.207	33%	0.325	C	S	.	.			trans	-65	143.2	172	0	0	0	0	0	110.2	L240 I302 T303 P307	L240-A305 HydrophobicContact CD1-CB 3.89Å; I302-A305 HydrophobicContact CG2-CB 4.01Å; T303-A305 PolarHBondContact O-N 3.29Å; A305-P307 WeakPolarHBondContact O-CD 3.43Å
306	D	67.2	Low	77.9	Confident	70 Å²	70	55.4 Å²	55.4	37%	0.374	32%	0.324	S	S	.	.			trans	-59.5	121.4	171.5	173.6	-5.3	0	0	0	108.7	A308 L309	D306-A308 PolarHBondContact O-N 3.07Å; D306-A308 VanDerWaalsContact OD1-CB 3.26Å; D306-A308 WeakPolarHBondContact OD1-CB 3.35Å; D306-A308 PolarHBondContact OD1-N 2.97Å; D306-L309 HydrophobicContact CB-CD1 3.81Å; D306-L309 HydrophobicContact CB-CG 3.82Å; D306-L309 VanDerWaalsContact O-CB 3.31Å; D306-L309 WeakPolarHBondContact O-CB 3.17Å; D306-L309 WeakPolarHBondContact O-CG 3.32Å; D306-L309 PolarHBondContact O-N 3.19Å
307	P	66.7	Low	77.9	Confident	123 Å²	123	55 Å²	55	80%	0.799	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-55.2	-25.1	-178.9	-25.3	33.7	0	0	0	113.7	A305 L309	A305-P307 WeakPolarHBondContact O-CD 3.43Å; P307-L309 PolarHBondContact O-N 2.57Å
308	A	63.3	Low	77.9	Confident	79 Å²	79	54 Å²	54	65%	0.653	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-68.9	-17	177.4	0	0	0	0	0	113.6	D306	D306-A308 PolarHBondContact O-N 3.07Å; D306-A308 VanDerWaalsContact OD1-CB 3.26Å; D306-A308 WeakPolarHBondContact OD1-CB 3.35Å; D306-A308 PolarHBondContact OD1-N 2.97Å
309	L	64.5	Low	77.5	Confident	28 Å²	28	49.7 Å²	49.7	15%	0.147	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-83.4	-24	-176.1	-57.5	-176.8	0	0	0	113	L240 R276 P277 D306 P307 V311	L240-L309 HydrophobicContact CD1-CD1 3.86Å; R276-L309 VanDerWaalsContact C-CD2 3.44Å; R276-L309 HydrophobicContact CB-CD2 3.86Å; R276-L309 WeakPolarHBondContact O-CD2 3.32Å; P277-L309 HydrophobicContact CB-CD1 4.1Å; P277-L309 HydrophobicContact CB-CD2 4.03Å; D306-L309 HydrophobicContact CB-CD1 3.81Å; D306-L309 HydrophobicContact CB-CG 3.82Å; D306-L309 VanDerWaalsContact O-CB 3.31Å; D306-L309 WeakPolarHBondContact O-CB 3.17Å; D306-L309 WeakPolarHBondContact O-CG 3.32Å; D306-L309 PolarHBondContact O-N 3.19Å; P307-L309 PolarHBondContact O-N 2.57Å; L309-V311 HydrophobicContact CB-CG2 4.41Å; L309-V311 WeakPolarHBondContact O-CG2 3.43Å; L309-V311 PolarHBondContact O-N 2.96Å
310	N	70.2	Confident	77.2	Confident	146 Å²	146	49.5 Å²	49.5	78%	0.781	30%	0.3	S	S	*	.			trans	49.9	39.3	-175.9	-161.9	37	0	0	0	112.8
311	V	75.3	Confident	76.7	Confident	14 Å²	14	44 Å²	44	9%	0.085	27%	0.265	C	S	.	.			trans	-118.7	92.7	173.2	-170.9	0	0	0	0	107.7	L240 L241 I302 L309 S313	L240-V311 HydrophobicContact CB-CB 4.36Å; L240-V311 HydrophobicContact CB-CG1 4.3Å; L241-V311 WeakPolarHBondContact O-CG1 3.26Å; I302-V311 HydrophobicContact CD1-CG1 3.86Å; L309-V311 HydrophobicContact CB-CG2 4.41Å; L309-V311 WeakPolarHBondContact O-CG2 3.43Å; L309-V311 PolarHBondContact O-N 2.96Å; V311-S313 WeakPolarHBondContact CG1-O 3.37Å
312	D	79.8	Confident	75.8	Confident	111 Å²	111	41.7 Å²	41.7	59%	0.594	25%	0.253	S	S	*	.	S	Bend	trans	-91.4	-15.1	176.3	57.9	1.1	0	0	0	112.6	T301 I302	T301-D312 CarbonylContact C-O 3.54Å; T301-D312 WeakPolarHBondContact CA-O 3.26Å; I302-D312 PolarHBondContact N-O 2.85Å
313	S	84.5	Confident	74.6	Confident	38 Å²	38	44.7 Å²	44.7	27%	0.266	27%	0.271	S	S	.	.	S	Bend	trans	-156.9	149.8	-177.1	60.1	0	0	0	0	110.3	A243 T300 V311	A243-S313 PolarHBondContact N-O 3.01Å; T300-S313 VanDerWaalsContact O-CB 3.25Å; T300-S313 WeakPolarHBondContact O-CB 3.49Å; V311-S313 WeakPolarHBondContact CG1-O 3.37Å
314	G	85.7	Confident	73.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.4	-122.3	179.4	0	0	0	0	0	113.5	L241 R298 C299	L241-G314 CarbonylContact O-C 3.49Å; L241-G314 VanDerWaalsContact O-CA 3.27Å; L241-G314 WeakPolarHBondContact O-CA 3.48Å; R298-G314 CarbonylContact C-O 3.59Å; R298-G314 VanDerWaalsContact CA-O 3.3Å; R298-G314 WeakPolarHBondContact CA-O 3.15Å; R298-G314 WeakPolarHBondContact CG-O 3.32Å; C299-G314 PolarHBondContact N-O 3.19Å; C299-G314 PolarHBondContact O-N 3.29Å
315	Y	82.6	Confident	72.2	Confident	10 Å²	10	40.4 Å²	40.4	4%	0.039	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.2	-175.1	-52.6	-93.9	0	0	0	111.8	L240 L241 I245 T248 A251 F296 T297 R298	L240-Y315 WeakPolarHBondContact CA-O 3.28Å; L241-Y315 HydrophobicContact CB-CD2 4.4Å; L241-Y315 PolarHBondContact N-O 2.01Å; L241-Y315 PolarHBondContact O-N 3.11Å; I245-Y315 HydrophobicContact CB-CE2 4.44Å; T248-Y315 HydrophobicContact CG2-CE1 4.28Å; A251-Y315 HydrophobicContact CB-CD1 4.23Å; A251-Y315 HydrophobicContact CB-CD2 3.58Å; A251-Y315 HydrophobicContact CB-CE1 4.36Å; A251-Y315 HydrophobicContact CB-CE2 3.75Å; A251-Y315 HydrophobicContact CB-CG 3.84Å; F296-Y315 AromaticContact CE1-CD1 3.52Å; F296-Y315 HydrophobicContact CE1-CD1 3.52Å; F296-Y315 HydrophobicContact CE1-CE1 4.18Å; F296-Y315 HydrophobicContact CE1-CG 4.25Å; F296-Y315 HydrophobicContact CE2-CD1 4.47Å; F296-Y315 HydrophobicContact CE2-CG 4.44Å; F296-Y315 AromaticContact CZ-CD1 3.4Å; F296-Y315 HydrophobicContact CZ-CD1 3.4Å; F296-Y315 HydrophobicContact CZ-CE1 4.28Å; F296-Y315 AromaticContact CZ-CG 3.65Å; F296-Y315 HydrophobicContact CZ-CG 3.65Å; T297-Y315 CarbonylContact O-C 3.26Å; T297-Y315 WeakPolarHBondContact O-CA 3.49Å; R298-Y315 HydrophobicContact CB-CD1 3.89Å; R298-Y315 HydrophobicContact CB-CE1 3.99Å; R298-Y315 HydrophobicContact CG-CD1 3.97Å; R298-Y315 HydrophobicContact CG-CE1 3.84Å
316	V	82.4	Confident	71.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.5	172.8	-179.4	0	0	0	0	108	A221 I238 L240 F296 T297 C299 I302	A221-V316 HydrophobicContact CB-CG1 4.4Å; I238-V316 HydrophobicContact CG2-CG1 4.07Å; L240-V316 HydrophobicContact CD2-CB 4.45Å; L240-V316 HydrophobicContact CD2-CG1 4.28Å; L240-V316 HydrophobicContact CD2-CG2 3.85Å; F296-V316 WeakPolarHBondContact CA-O 3.21Å; T297-V316 PolarHBondContact N-O 3.42Å; T297-V316 PolarHBondContact O-N 2.64Å; C299-V316 HydrophobicContact CB-CG2 4.4Å; C299-V316 VanDerWaalsContact SG-CG2 3.52Å; I302-V316 HydrophobicContact CD1-CG2 4.04Å; I302-V316 HydrophobicContact CG1-CG2 4.26Å
317	L	79.5	Confident	70.4	Confident	0 Å²	0	46 Å²	46	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.5	168	176.7	71.5	0	0	0	108.5	I238 A239 F256 I259 C294 F296	I238-L317 CarbonylContact C-O 3.58Å; I238-L317 VanDerWaalsContact CA-O 3.24Å; I238-L317 WeakPolarHBondContact CA-O 3.47Å; A239-L317 HydrophobicContact CB-CB 4.3Å; A239-L317 PolarHBondContact N-O 2.89Å; A239-L317 PolarHBondContact O-N 3.13Å; F256-L317 HydrophobicContact CD1-CD2 3.65Å; F256-L317 HydrophobicContact CE1-CD1 3.99Å; F256-L317 HydrophobicContact CE1-CD2 3.94Å; F256-L317 HydrophobicContact CG-CD2 4.1Å; F256-L317 HydrophobicContact CZ-CD1 4.2Å; F256-L317 VanDerWaalsContact N-CD2 3.34Å; I259-L317 HydrophobicContact CD1-CD2 3.74Å; I259-L317 HydrophobicContact CD1-CG 4.24Å; C294-L317 HydrophobicContact CB-CD1 4.43Å; F296-L317 HydrophobicContact CB-CD1 4.25Å; F296-L317 HydrophobicContact CD2-CB 3.8Å; F296-L317 HydrophobicContact CD2-CD1 3.78Å; F296-L317 HydrophobicContact CD2-CG 4.39Å; F296-L317 HydrophobicContact CE2-CB 4.21Å; F296-L317 HydrophobicContact CG-CD1 4.48Å
318	A	79.1	Confident	69.4	Low	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.6	174.5	0	0	0	0	0	109.7	A217 F220 A221 V236 A237 C294 G295	A217-A318 HydrophobicContact CB-CB 4.29Å; A217-A318 WeakPolarHBondContact O-CB 3.33Å; F220-A318 HydrophobicContact CB-CB 4.43Å; F220-A318 HydrophobicContact CD1-CB 3.61Å; F220-A318 HydrophobicContact CE1-CB 4.45Å; F220-A318 HydrophobicContact CG-CB 4.49Å; A221-A318 HydrophobicContact CB-CB 4.19Å; V236-A318 HydrophobicContact CG1-CB 4.34Å; A237-A318 CarbonylContact O-C 3.48Å; A237-A318 WeakPolarHBondContact O-CA 3.48Å; C294-A318 CarbonylContact C-O 3.09Å; C294-A318 WeakPolarHBondContact CA-O 3.34Å; C294-A318 WeakPolarHBondContact CB-O 3.23Å; G295-A318 PolarHBondContact N-O 3.26Å; G295-A318 PolarHBondContact O-N 2.03Å
319	C	76.6	Confident	68.6	Low	3 Å²	3	50 Å²	50	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.7	174.8	-74.9	0	0	0	0	109.8	V236 A237 I259 C294 F321	V236-C319 CarbonylContact C-O 3.6Å; V236-C319 VanDerWaalsContact CA-O 3.24Å; V236-C319 WeakPolarHBondContact CA-O 3.44Å; A237-C319 PolarHBondContact N-O 3.36Å; A237-C319 PolarHBondContact O-N 2.82Å; I259-C319 HydrophobicContact CD1-CB 4.22Å; C294-C319 HydrophobicContact CB-CB 4.11Å; C294-C319 WeakPolarHBondContact CB-SG 3.49Å; C294-C319 VanDerWaalsContact SG-CA 3.54Å; C294-C319 WeakPolarHBondContact SG-CB 3.47Å; C294-C319 CovalentContact SG-SG 2.05Å; C294-C319 PolarHBondContact SG-SG 2.88Å; C319-F321 HydrophobicContact CB-CE2 4.39Å; C319-F321 HydrophobicContact CB-CZ 4.21Å; C319-F321 WeakPolarHBondContact O-CD2 3.3Å; C319-F321 WeakPolarHBondContact O-CE2 3.19Å
320	G	77.9	Confident	68	Low	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	155.4	173.1	0	0	0	0	0	112.8	I213 P235 T292 G293	I213-G320 VanDerWaalsContact CG2-CA 3.49Å; I213-G320 WeakPolarHBondContact CG2-O 2.98Å; P235-G320 CarbonylContact O-C 3.59Å; P235-G320 VanDerWaalsContact O-CA 3.23Å; P235-G320 WeakPolarHBondContact O-CA 3.22Å; T292-G320 WeakPolarHBondContact CA-O 3.21Å; T292-G320 PolarHBondContact OG1-O 3.07Å; G293-G320 PolarHBondContact N-O 3.05Å; G293-G320 PolarHBondContact O-N 3Å
321	F	73.4	Confident	67	Low	4 Å²	4	47.1 Å²	47.1	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.2	-177.5	-47.7	-105.5	0	0	0	110.2	Y234 P235 A237 C319 V323	Y234-F321 WeakPolarHBondContact CB-O 2.94Å; P235-F321 HydrophobicContact CB-CB 4.2Å; P235-F321 HydrophobicContact CB-CD2 4.24Å; P235-F321 VanDerWaalsContact CD-O 3.23Å; P235-F321 WeakPolarHBondContact CD-O 3.48Å; P235-F321 WeakPolarHBondContact O-CD2 3.18Å; P235-F321 PolarHBondContact O-N 3.19Å; A237-F321 HydrophobicContact CB-CE2 3.49Å; A237-F321 VanDerWaalsContact CB-CE2 3.49Å; A237-F321 HydrophobicContact CB-CZ 3.58Å; C319-F321 HydrophobicContact CB-CE2 4.39Å; C319-F321 HydrophobicContact CB-CZ 4.21Å; C319-F321 WeakPolarHBondContact O-CD2 3.3Å; C319-F321 WeakPolarHBondContact O-CE2 3.19Å; F321-V323 VanDerWaalsContact C-N 3.3Å; F321-V323 PolarHBondContact O-N 3.21Å
322	S	68.2	Low	65.8	Low	43 Å²	43	48.7 Å²	48.7	30%	0.301	26%	0.258	S	S	.	.	S	Bend	trans	-73.5	-17.8	176.9	58.5	0	0	0	0	114.7	N290 E291	N290-S322 PolarHBondContact N-OG 3.01Å; E291-S322 PolarHBondContact N-OG 3.11Å; E291-S322 PolarHBondContact O-N 3.07Å; E291-S322 VanDerWaalsContact O-N 3.08Å
323	V	61.7	Low	64.2	Low	75 Å²	75	46.7 Å²	46.7	46%	0.455	25%	0.252	S	S	.	.	S	Bend	trans	-140	139.9	-176	-165.4	0	0	0	0	109.9	F321	F321-V323 VanDerWaalsContact C-N 3.3Å; F321-V323 PolarHBondContact O-N 3.21Å
324	S	57.1	Low	62.3	Low	65 Å²	65	47.8 Å²	47.8	46%	0.455	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-90.9	148.6	173.5	-163.2	0	0	0	0	110.4
325	A	50.1	Low	60.3	Low	14 Å²	14	55 Å²	55	12%	0.116	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-65.5	138.7	159	0	0	0	0	0	109.5	R284 R287	R284-A325 WeakPolarHBondContact O-CB 3.22Å; R287-A325 HydrophobicContact CB-CB 3.7Å
326	A	49	Very low	58.2	Low	46 Å²	46	60.6 Å²	60.6	38%	0.38	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-73.8	132.2	163.7	0	0	0	0	0	108.9	Q328 F329	A326-Q328 HydrophobicContact CB-CG 4.41Å; A326-Q328 PolarHBondContact O-N 3.24Å; A326-F329 HydrophobicContact CB-CD2 3.83Å; A326-F329 HydrophobicContact CB-CE2 4.29Å; A326-F329 PolarHBondContact O-N 3.25Å
327	E	51.2	Low	56.2	Low	166 Å²	166	66 Å²	66	78%	0.776	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-24.9	-170.6	-66.2	179.1	177.5	0	0	114.4	R284	R284-E327 PolarHBondContact NH1-O 2.83Å
328	Q	44.9	Very low	54.1	Low	162 Å²	162	71.2 Å²	71.2	76%	0.757	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.9	-178.1	63.5	-150.5	-15.8	0	0	115	A326	A326-Q328 HydrophobicContact CB-CG 4.41Å; A326-Q328 PolarHBondContact O-N 3.24Å
329	F	47.2	Very low	52.1	Low	124 Å²	124	78.4 Å²	78.4	54%	0.544	42%	0.424	S	S	.	.	S	Bend	trans	-124	134.4	179.6	-59.5	-75.7	0	0	0	111.7	A326	A326-F329 HydrophobicContact CB-CD2 3.83Å; A326-F329 HydrophobicContact CB-CE2 4.29Å; A326-F329 PolarHBondContact O-N 3.25Å
330	R	50.7	Low	50.5	Low	93 Å²	93	80.5 Å²	80.5	35%	0.351	44%	0.438	S	S	.	.			trans	-51.2	150.6	170	-52.1	-156.3	169.6	177.9	-4.2	110.6	D268 R287 H332 P334	D268-R330 VanDerWaalsContact CG-CD 3.48Å; D268-R330 VanDerWaalsContact OD1-CG 3.3Å; D268-R330 WeakPolarHBondContact OD1-CG 3.13Å; D268-R330 IonicContact OD1-NE 2.94Å; D268-R330 WeakPolarHBondContact OD2-CD 3.11Å; D268-R330 VanDerWaalsContact OD2-CG 3.31Å; D268-R330 WeakPolarHBondContact OD2-CG 3.34Å; D268-R330 IonicContact OD2-CZ 2.7Å; D268-R330 IonicContact OD2-NE 3.59Å; D268-R330 PolarHBondContact OD2-NE 2.81Å; D268-R330 IonicContact OD2-NH2 3.1Å; D268-R330 PolarHBondContact OD2-NH2 3.06Å; R287-R330 PolarHBondContact NE-O 2.88Å; R287-R330 PolarHBondContact NH1-O 3.35Å; R287-R330 PolarHBondContact NH2-O 2.83Å; R330-H332 VanDerWaalsContact C-N 3.28Å; R330-H332 VanDerWaalsContact CB-O 3.25Å; R330-H332 WeakPolarHBondContact CB-O 3.48Å; R330-H332 PolarHBondContact O-N 2.9Å; R330-P334 VanDerWaalsContact NH1-CB 3.35Å
331	P	49.9	Very low	49	Very low	20 Å²	20	84.8 Å²	84.8	13%	0.13	47%	0.465	C	S	.	.	S	Bend	trans	-66.8	-19.5	172	-21.6	36.3	0	0	0	115	Y263 R287	Y263-P331 HydrophobicContact CD1-CG 4.27Å; Y263-P331 HydrophobicContact CD2-CG 3.73Å; Y263-P331 HydrophobicContact CE1-CG 4.06Å; Y263-P331 HydrophobicContact CE2-CG 3.52Å; Y263-P331 HydrophobicContact CG-CG 4.12Å; Y263-P331 WeakPolarHBondContact OH-CD 3.44Å; R287-P331 HydrophobicContact CB-CB 4.48Å; R287-P331 VanDerWaalsContact CD-CA 3.5Å; R287-P331 WeakPolarHBondContact CD-O 2.99Å; R287-P331 HydrophobicContact CG-CB 4.23Å; R287-P331 WeakPolarHBondContact CG-O 3.05Å; R287-P331 VanDerWaalsContact NE-CA 3.28Å; R287-P331 PolarHBondContact NE-O 2.86Å
332	H	50.9	Low	47.7	Very low	47 Å²	47	87.9 Å²	87.9	22%	0.218	49%	0.485	C	S	.	.	S	Bend	trans	-146.4	161.2	174.6	52.8	64.1	0	0	0	110.1	Y263 I265 R330	Y263-H332 AromaticContact CD1-NE2 3.59Å; Y263-H332 AromaticContact CE1-CE1 3.78Å; Y263-H332 AromaticContact CE1-NE2 3.14Å; Y263-H332 WeakPolarHBondContact CE1-NE2 3.34Å; I265-H332 VanDerWaalsContact CG1-NE2 3.33Å; I265-H332 WeakPolarHBondContact CG1-NE2 3.27Å; I265-H332 WeakPolarHBondContact CG2-CE1 3.33Å; R330-H332 VanDerWaalsContact C-N 3.28Å; R330-H332 VanDerWaalsContact CB-O 3.25Å; R330-H332 WeakPolarHBondContact CB-O 3.48Å; R330-H332 PolarHBondContact O-N 2.9Å
333	P	45	Very low	46.9	Very low	69 Å²	69	87.6 Å²	87.6	45%	0.448	48%	0.482	S	S	.	.			trans	-55.8	147	172.1	-20.5	31.5	0	0	0	111.3	T345	P333-T345 HydrophobicContact CG-CG2 4.44Å
334	P	45.6	Very low	46.2	Very low	62 Å²	62	90.7 Å²	90.7	40%	0.403	50%	0.496	S	S	.	.			trans	-58.7	142.8	174.1	-16.7	27	0	0	0	111.9	R330 N336	R330-P334 VanDerWaalsContact NH1-CB 3.35Å; P334-N336 VanDerWaalsContact C-N 3.28Å; P334-N336 PolarHBondContact O-N 3.03Å
335	H	44	Very low	46	Very low	152 Å²	152	91.7 Å²	91.7	70%	0.704	50%	0.499	S	S	*	.			trans	-79.5	76.5	167	-136	63	0	0	0	109.2	S340	H335-S340 PolarHBondContact CE1-OG 2.63Å; H335-S340 PolarHBondContact ND1-OG 3.17Å
336	N	37.5	Very low	46	Very low	128 Å²	128	92.8 Å²	92.8	68%	0.684	51%	0.506	S	S	*	.			trans	-85.3	125.6	172.5	-110.1	3.8	0	0	0	109.7	P334	P334-N336 VanDerWaalsContact C-N 3.28Å; P334-N336 PolarHBondContact O-N 3.03Å
337	P	40.2	Very low	46.1	Very low	113 Å²	113	95.9 Å²	95.9	73%	0.734	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	154.3	-172.4	31.8	-33.6	0	0	0	112.6
338	P	36.1	Very low	45.7	Very low	109 Å²	109	94.2 Å²	94.2	71%	0.708	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	cis	-110.4	23.9	-1.9	37.9	-24.9	0	0	0	114
339	H	36.6	Very low	45.9	Very low	152 Å²	152	88.5 Å²	88.5	70%	0.704	51%	0.505	S	S	*	.			trans	-136.4	44.7	-174.1	-59	-54.8	0	0	0	113.8	V341	H339-V341 PolarHBondContact O-N 2.05Å
340	S	42.8	Very low	46.2	Very low	46 Å²	46	84.6 Å²	84.6	32%	0.322	49%	0.488	S	S	.	.			trans	-67.6	78.4	160.9	46	0	0	0	0	108.3	H335 P342	H335-S340 PolarHBondContact CE1-OG 2.63Å; H335-S340 PolarHBondContact ND1-OG 3.17Å; S340-P342 WeakPolarHBondContact O-CD 3.24Å
341	V	46.2	Very low	46.5	Very low	91 Å²	91	86.2 Å²	86.2	55%	0.552	50%	0.503	S	S	*	.			trans	-65.7	116.8	171.8	-161.6	0	0	0	0	104.8	H339	H339-V341 PolarHBondContact O-N 2.05Å
342	P	46.4	Very low	46.8	Very low	68 Å²	68	88.9 Å²	88.9	44%	0.442	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	153.4	166.5	-25.5	36.7	0	0	0	109	S340 L344 N359	S340-P342 WeakPolarHBondContact O-CD 3.24Å; P342-L344 VanDerWaalsContact C-N 3.32Å; P342-L344 PolarHBondContact O-N 3.47Å; P342-N359 HydrophobicContact CB-CB 3.28Å; P342-N359 HydrophobicContact CG-CB 3.86Å
343	C	51.5	Low	46.9	Very low	37 Å²	37	87.7 Å²	87.7	25%	0.25	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	81	-7.3	176	-42.7	0	0	0	0	118	T345 C346 C353	C343-T345 PolarHBondContact O-N 2.82Å; C343-T345 VanDerWaalsContact O-N 3.1Å; C343-C346 PolarHBondContact O-N 2.88Å; C343-C346 PolarHBondContact O-SG 2.94Å; C343-C353 WeakPolarHBondContact CA-SG 3.43Å; C343-C353 HydrophobicContact CB-CB 3.23Å; C343-C353 WeakPolarHBondContact CB-SG 3.23Å; C343-C353 WeakPolarHBondContact SG-CA 3.37Å; C343-C353 WeakPolarHBondContact SG-CB 3.22Å; C343-C353 PolarHBondContact SG-O 2.94Å; C343-C353 CovalentContact SG-SG 1.97Å; C343-C353 PolarHBondContact SG-SG 3.41Å
344	L	48.4	Very low	47.4	Very low	141 Å²	141	87.2 Å²	87.2	74%	0.738	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.2	-176.1	-159.7	76.9	0	0	0	113.6	P342	P342-L344 VanDerWaalsContact C-N 3.32Å; P342-L344 PolarHBondContact O-N 3.47Å
345	T	51.8	Low	47.5	Very low	86 Å²	86	88.2 Å²	88.2	53%	0.528	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	25.1	-173.7	61.2	0	0	0	0	113.4	P333 C343 M347	P333-T345 HydrophobicContact CG-CG2 4.44Å; C343-T345 PolarHBondContact O-N 2.82Å; C343-T345 VanDerWaalsContact O-N 3.1Å; T345-M347 PolarHBondContact O-N 3.14Å
346	C	51.1	Low	47.4	Very low	37 Å²	37	83 Å²	83	25%	0.25	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-66.1	134	176.7	-60.7	0	0	0	0	111.2	C343 K350 C353 C361	C343-C346 PolarHBondContact O-N 2.88Å; C343-C346 PolarHBondContact O-SG 2.94Å; C346-K350 VanDerWaalsContact CB-O 3.29Å; C346-K350 WeakPolarHBondContact CB-O 3.4Å; C346-C353 VanDerWaalsContact SG-CB 3.53Å; C346-C361 WeakPolarHBondContact CA-SG 3.43Å; C346-C361 HydrophobicContact CB-CB 3.65Å; C346-C361 WeakPolarHBondContact CB-SG 3.14Å; C346-C361 WeakPolarHBondContact SG-CA 3.41Å; C346-C361 WeakPolarHBondContact SG-CB 3.43Å; C346-C361 CovalentContact SG-SG 2.03Å; C346-C361 PolarHBondContact SG-SG 2.93Å
347	M	49.3	Very low	47.7	Very low	111 Å²	111	77 Å²	77	55%	0.547	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-66.4	150.9	173.7	-60.8	-168.9	-53.1	0	0	109.9	T345 G349 K350	T345-M347 PolarHBondContact O-N 3.14Å; M347-G349 PolarHBondContact O-N 2.87Å; M347-K350 HydrophobicContact CE-CD 4.24Å; M347-K350 PolarHBondContact O-N 3.2Å
348	S	42.8	Very low	47.9	Very low	130 Å²	130	74.8 Å²	74.8	91%	0.909	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	120.8	171.3	54.1	0	0	0	0	110.1
349	G	49.1	Very low	48.6	Very low	42 Å²	42	73.1 Å²	73.1	43%	0.433	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.9	-1.8	-173.7	0	0	0	0	0	115	M347 D351	M347-G349 PolarHBondContact O-N 2.87Å; G349-D351 VanDerWaalsContact C-OD1 3.23Å; G349-D351 WeakPolarHBondContact CA-OD1 3.31Å
350	K	55.2	Low	49.3	Very low	43 Å²	43	68.3 Å²	68.3	19%	0.187	41%	0.411	C	S	.	.			trans	-123.2	45.6	172.8	-67.9	-171.3	175.6	-167.8	0	111.5	N290 C346 M347 Q352 C361 C362	N290-K350 PolarHBondContact OD1-NZ 2.84Å; C346-K350 VanDerWaalsContact CB-O 3.29Å; C346-K350 WeakPolarHBondContact CB-O 3.4Å; M347-K350 HydrophobicContact CE-CD 4.24Å; M347-K350 PolarHBondContact O-N 3.2Å; K350-Q352 VanDerWaalsContact C-N 3.34Å; K350-Q352 PolarHBondContact O-N 3.24Å; K350-C361 HydrophobicContact CB-CB 4.15Å; K350-C362 CarbonylContact C-O 3.28Å; K350-C362 VanDerWaalsContact CA-O 3.26Å; K350-C362 WeakPolarHBondContact CA-O 3.49Å
351	D	55.4	Low	49.8	Very low	127 Å²	127	67.5 Å²	67.5	68%	0.679	41%	0.405	S	S	*	.			trans	-79.8	-8.6	-169	32.1	-58.6	0	0	0	114.3	G349 C353 C362	G349-D351 VanDerWaalsContact C-OD1 3.23Å; G349-D351 WeakPolarHBondContact CA-OD1 3.31Å; D351-C353 PolarHBondContact O-N 3.19Å; D351-C362 PolarHBondContact N-O 2.93Å
352	Q	56.5	Low	49.9	Very low	76 Å²	76	64.3 Å²	64.3	36%	0.355	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-82.8	95.7	171.6	-66.7	-65.8	-23.3	0	0	109.8	K350 N354 T357 C362	K350-Q352 VanDerWaalsContact C-N 3.34Å; K350-Q352 PolarHBondContact O-N 3.24Å; Q352-N354 PolarHBondContact OE1-ND2 3.49Å; Q352-T357 HydrophobicContact CB-CG2 3.97Å; Q352-T357 WeakPolarHBondContact O-CG2 3.49Å; Q352-T357 PolarHBondContact O-OG1 3.22Å; Q352-C362 HydrophobicContact CB-CB 4.39Å; Q352-C362 WeakPolarHBondContact CB-O 3.29Å; Q352-C362 PolarHBondContact N-O 3.42Å; Q352-C362 PolarHBondContact O-N 2.87Å
353	C	53.4	Low	50	Low	22 Å²	22	68.7 Å²	68.7	15%	0.149	40%	0.401	C	S	.	.			trans	-140.6	96.3	176.7	-168.1	0	0	0	0	110.3	C343 C346 D351 T357 N359 L360	C343-C353 WeakPolarHBondContact CA-SG 3.43Å; C343-C353 HydrophobicContact CB-CB 3.23Å; C343-C353 WeakPolarHBondContact CB-SG 3.23Å; C343-C353 WeakPolarHBondContact SG-CA 3.37Å; C343-C353 WeakPolarHBondContact SG-CB 3.22Å; C343-C353 PolarHBondContact SG-O 2.94Å; C343-C353 CovalentContact SG-SG 1.97Å; C343-C353 PolarHBondContact SG-SG 3.41Å; C346-C353 VanDerWaalsContact SG-CB 3.53Å; D351-C353 PolarHBondContact O-N 3.19Å; C353-T357 VanDerWaalsContact CA-OG1 3.26Å; C353-T357 WeakPolarHBondContact CA-OG1 3.38Å; C353-N359 PolarHBondContact SG-O 2.76Å; C353-L360 WeakPolarHBondContact CA-O 3.25Å; C353-L360 WeakPolarHBondContact CB-O 3.06Å; C353-L360 PolarHBondContact SG-O 3.29Å
354	N	55.2	Low	49.8	Very low	58 Å²	58	68.7 Å²	68.7	31%	0.31	41%	0.407	S	S	.	.	S	Bend	trans	-158.8	-174.9	-176.7	61.3	49	0	0	0	109.6	Q352 T356 T357 L358 N359	Q352-N354 PolarHBondContact OE1-ND2 3.49Å; N354-T356 PolarHBondContact O-N 2.85Å; N354-T356 WeakPolarHBondContact OD1-CA 3.3Å; N354-T356 VanDerWaalsContact OD1-CB 3.27Å; N354-T356 WeakPolarHBondContact OD1-CB 3.38Å; N354-T356 PolarHBondContact OD1-N 2.77Å; N354-T356 PolarHBondContact OD1-OG1 2.88Å; N354-T357 PolarHBondContact N-OG1 3.33Å; N354-T357 CarbonylContact O-C 3.47Å; N354-T357 WeakPolarHBondContact O-CA 3.28Å; N354-T357 PolarHBondContact O-N 3.04Å; N354-T357 PolarHBondContact O-OG1 2.95Å; N354-T357 VanDerWaalsContact O-OG1 3.1Å; N354-L358 PolarHBondContact O-N 3.32Å; N354-N359 VanDerWaalsContact C-OD1 3.26Å; N354-N359 WeakPolarHBondContact O-CA 3.24Å; N354-N359 PolarHBondContact O-N 2.93Å
355	A	48.6	Very low	49.4	Very low	83 Å²	83	64.6 Å²	64.6	69%	0.686	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-56.5	-26.3	179.9	0	0	0	0	0	114.4	T357 L358 N359	A355-T357 VanDerWaalsContact C-N 3.29Å; A355-L358 PolarHBondContact O-N 2.87Å; A355-N359 PolarHBondContact N-OD1 2.86Å
356	T	41.6	Very low	48.7	Very low	44 Å²	44	62.6 Å²	62.6	27%	0.27	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-75.8	-15.9	175.3	72.3	0	0	0	0	113.7	N354	N354-T356 PolarHBondContact O-N 2.85Å; N354-T356 WeakPolarHBondContact OD1-CA 3.3Å; N354-T356 VanDerWaalsContact OD1-CB 3.27Å; N354-T356 WeakPolarHBondContact OD1-CB 3.38Å; N354-T356 PolarHBondContact OD1-N 2.77Å; N354-T356 PolarHBondContact OD1-OG1 2.88Å
357	T	42.6	Very low	47.7	Very low	0 Å²	0	62.3 Å²	62.3	0%	0	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-111.7	20.9	171.5	66	0	0	0	0	112.3	Q352 C353 N354 A355 N359 L360 C362 I366	Q352-T357 HydrophobicContact CB-CG2 3.97Å; Q352-T357 WeakPolarHBondContact O-CG2 3.49Å; Q352-T357 PolarHBondContact O-OG1 3.22Å; C353-T357 VanDerWaalsContact CA-OG1 3.26Å; C353-T357 WeakPolarHBondContact CA-OG1 3.38Å; N354-T357 PolarHBondContact N-OG1 3.33Å; N354-T357 CarbonylContact O-C 3.47Å; N354-T357 WeakPolarHBondContact O-CA 3.28Å; N354-T357 PolarHBondContact O-N 3.04Å; N354-T357 PolarHBondContact O-OG1 2.95Å; N354-T357 VanDerWaalsContact O-OG1 3.1Å; A355-T357 VanDerWaalsContact C-N 3.29Å; T357-N359 PolarHBondContact O-N 3.3Å; T357-L360 WeakPolarHBondContact CB-O 3.35Å; T357-L360 WeakPolarHBondContact O-CB 3.39Å; T357-L360 WeakPolarHBondContact O-CG 3.34Å; T357-L360 PolarHBondContact O-N 3.41Å; T357-L360 PolarHBondContact OG1-O 2.84Å; T357-C362 HydrophobicContact CG2-CB 3.91Å; T357-I366 VanDerWaalsContact CA-CD1 3.47Å; T357-I366 HydrophobicContact CG2-CG1 4.41Å; T357-I366 WeakPolarHBondContact O-CD1 3.39Å
358	L	45.3	Very low	46.8	Very low	67 Å²	67	59.5 Å²	59.5	35%	0.351	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	27.1	-175.1	-60.6	171.8	0	0	0	113	N354 A355 L360 I366	N354-L358 PolarHBondContact O-N 3.32Å; A355-L358 PolarHBondContact O-N 2.87Å; L358-L360 HydrophobicContact CB-CD1 4.24Å; L358-L360 HydrophobicContact CB-CG 4.25Å; L358-L360 PolarHBondContact O-N 3.07Å; L358-I366 HydrophobicContact CB-CD1 4.31Å; L358-I366 HydrophobicContact CD1-CD1 4.29Å; L358-I366 HydrophobicContact CG-CD1 4.26Å
359	N	51.8	Low	46	Very low	75 Å²	75	58.1 Å²	58.1	40%	0.401	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	32.9	-171.6	-49.5	-57.4	0	0	0	114.8	P342 C353 N354 A355 T357	P342-N359 HydrophobicContact CB-CB 3.28Å; P342-N359 HydrophobicContact CG-CB 3.86Å; C353-N359 PolarHBondContact SG-O 2.76Å; N354-N359 VanDerWaalsContact C-OD1 3.26Å; N354-N359 WeakPolarHBondContact O-CA 3.24Å; N354-N359 PolarHBondContact O-N 2.93Å; A355-N359 PolarHBondContact N-OD1 2.86Å; T357-N359 PolarHBondContact O-N 3.3Å
360	L	50.1	Low	45	Very low	51 Å²	51	62 Å²	62	27%	0.267	35%	0.348	S	S	.	.			trans	-98	148.9	171.5	-53.9	172.1	0	0	0	109.8	E206 C353 T357 L358 C362 I366	E206-L360 HydrophobicContact CG-CD1 3.87Å; E206-L360 WeakPolarHBondContact OE1-CD2 3.28Å; C353-L360 WeakPolarHBondContact CA-O 3.25Å; C353-L360 WeakPolarHBondContact CB-O 3.06Å; C353-L360 PolarHBondContact SG-O 3.29Å; T357-L360 WeakPolarHBondContact CB-O 3.35Å; T357-L360 WeakPolarHBondContact O-CB 3.39Å; T357-L360 WeakPolarHBondContact O-CG 3.34Å; T357-L360 PolarHBondContact O-N 3.41Å; T357-L360 PolarHBondContact OG1-O 2.84Å; L358-L360 HydrophobicContact CB-CD1 4.24Å; L358-L360 HydrophobicContact CB-CG 4.25Å; L358-L360 PolarHBondContact O-N 3.07Å; L360-C362 PolarHBondContact O-N 2.83Å; L360-I366 HydrophobicContact CD1-CD1 4.02Å
361	C	53.8	Low	43.7	Very low	29 Å²	29	63.3 Å²	63.3	20%	0.196	36%	0.359	C	S	.	.			trans	-76.9	97.7	179.2	-63.4	0	0	0	0	110.7	C346 K350	C346-C361 WeakPolarHBondContact CA-SG 3.43Å; C346-C361 HydrophobicContact CB-CB 3.65Å; C346-C361 WeakPolarHBondContact CB-SG 3.14Å; C346-C361 WeakPolarHBondContact SG-CA 3.41Å; C346-C361 WeakPolarHBondContact SG-CB 3.43Å; C346-C361 CovalentContact SG-SG 2.03Å; C346-C361 PolarHBondContact SG-SG 2.93Å; K350-C361 HydrophobicContact CB-CB 4.15Å
362	C	48.5	Very low	42.4	Very low	23 Å²	23	62.2 Å²	62.2	16%	0.155	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-114.3	152	-175.9	-56.9	0	0	0	0	112.1	K350 D351 Q352 T357 L360 G364	K350-C362 CarbonylContact C-O 3.28Å; K350-C362 VanDerWaalsContact CA-O 3.26Å; K350-C362 WeakPolarHBondContact CA-O 3.49Å; D351-C362 PolarHBondContact N-O 2.93Å; Q352-C362 HydrophobicContact CB-CB 4.39Å; Q352-C362 WeakPolarHBondContact CB-O 3.29Å; Q352-C362 PolarHBondContact N-O 3.42Å; Q352-C362 PolarHBondContact O-N 2.87Å; T357-C362 HydrophobicContact CG2-CB 3.91Å; L360-C362 PolarHBondContact O-N 2.83Å; C362-G364 WeakPolarHBondContact CB-O 3.28Å
363	E	48	Very low	41	Very low	161 Å²	161	63 Å²	63	75%	0.752	36%	0.363	S	S	*	.	S	Bend	trans	-75.6	-17.2	167.4	-170.2	175.4	-179.4	0	0	111.2
364	G	47.9	Very low	39.8	Very low	37 Å²	37	67.2 Å²	67.2	38%	0.381	39%	0.393	S	S	.	.	S	Bend	trans	-161.8	176.5	179.9	0	0	0	0	0	113.8	C362	C362-G364 WeakPolarHBondContact CB-O 3.28Å
365	V	39.9	Very low	38.6	Very low	55 Å²	55	73.9 Å²	73.9	33%	0.333	42%	0.422	S	S	.	.			trans	-64.6	136.5	-176.9	-171.7	0	0	0	0	111.3	G367	V365-G367 PolarHBondContact O-N 3.43Å
366	I	37.2	Very low	37.6	Very low	43 Å²	43	73.4 Å²	73.4	22%	0.221	43%	0.425	C	S	.	.	S	Bend	trans	-67.6	105.2	175	-64.3	-179.3	0	0	0	108.9	T357 L358 L360	T357-I366 VanDerWaalsContact CA-CD1 3.47Å; T357-I366 HydrophobicContact CG2-CG1 4.41Å; T357-I366 WeakPolarHBondContact O-CD1 3.39Å; L358-I366 HydrophobicContact CB-CD1 4.31Å; L358-I366 HydrophobicContact CD1-CD1 4.29Å; L358-I366 HydrophobicContact CG-CD1 4.26Å; L360-I366 HydrophobicContact CD1-CD1 4.02Å
367	G	29.9	Very low	36.8	Very low	32 Å²	32	78.2 Å²	78.2	33%	0.33	46%	0.455	S	S	.	.			trans	-165.9	-4.9	177.6	0	0	0	0	0	115.5	V365	V365-G367 PolarHBondContact O-N 3.43Å
368	N	29.3	Very low	36.2	Very low	52 Å²	52	87.4 Å²	87.4	28%	0.278	50%	0.495	S	S	.	.			trans	-135.2	100.2	-171.7	-56.3	-26.7	0	0	0	111	E60 R66 R370	E60-N368 PolarHBondContact OE1-ND2 2.98Å; E60-N368 PolarHBondContact OE1-OD1 2.91Å; R66-N368 PolarHBondContact NH1-OD1 3.37Å; N368-R370 VanDerWaalsContact C-N 3.27Å; N368-R370 HydrophobicContact CB-CG 3.99Å; N368-R370 PolarHBondContact O-N 3.25Å
369	L	27.2	Very low	35.2	Very low	101 Å²	101	94 Å²	94	53%	0.529	52%	0.521	S	S	.	.			trans	-69	94.5	152.6	-105.9	151.5	0	0	0	106.1	L205 W209	L205-L369 HydrophobicContact CD2-CD1 4.16Å; W209-L369 HydrophobicContact CB-CD2 4.22Å
370	R	28.2	Very low	34.2	Very low	124 Å²	124	95.1 Å²	95.1	47%	0.468	53%	0.526	S	S	.	.			trans	-82	121.2	171.9	-71.3	-173.8	169.6	176.2	-3.6	108.4	F208 N368	F208-R370 HydrophobicContact CD1-CB 4.08Å; F208-R370 HydrophobicContact CE1-CB 4.05Å; N368-R370 VanDerWaalsContact C-N 3.27Å; N368-R370 HydrophobicContact CB-CG 3.99Å; N368-R370 PolarHBondContact O-N 3.25Å
371	V	27.2	Very low	33.7	Very low	69 Å²	69	94.4 Å²	94.4	42%	0.418	53%	0.527	S	S	.	.	B	Isolated β-bridge	trans	-76.2	129.4	160.2	-171.4	0	0	0	0	106.1	D373	V371-D373 WeakPolarHBondContact CG1-OD1 3.42Å
372	V	27.5	Very low	33.6	Very low	105 Å²	105	93.5 Å²	93.5	64%	0.636	52%	0.521	S	S	*	.			trans	-101.5	114.7	176.6	-172.4	0	0	0	0	107.5	F208	F208-V372 HydrophobicContact CD1-CG2 4.26Å
373	D	28.5	Very low	34.2	Very low	92 Å²	92	92.7 Å²	92.7	49%	0.492	52%	0.517	S	S	.	.			trans	-110.5	127.8	177.6	-48.8	36.7	0	0	0	107.3	V371	V371-D373 WeakPolarHBondContact CG1-OD1 3.42Å
374	S	28	Very low	35.2	Very low	111 Å²	111	90.3 Å²	90.3	78%	0.776	51%	0.506	S	S	*	.			trans	-86	128	168.8	52.7	0	0	0	0	110.4
375	E	29.5	Very low	36.8	Very low	197 Å²	197	92.7 Å²	92.7	92%	0.921	51%	0.507	S	S	*	.			trans	83.7	130.7	162.4	-56.9	-170.7	157.5	0	0	120
376	G	28	Very low	38.8	Very low	73 Å²	73	90.1 Å²	90.1	75%	0.753	49%	0.492	S	S	*	.			trans	114.7	77	137.7	0	0	0	0	0	118.3	K378	G376-K378 PolarHBondContact O-N 2.72Å
377	T	23.9	Very low	41	Very low	146 Å²	146	94.1 Å²	94.1	90%	0.896	51%	0.509	S	S	*	.			trans	-44.9	114.4	166.7	37.3	0	0	0	0	115.1
378	K	29.5	Very low	43.6	Very low	193 Å²	193	98.5 Å²	98.5	84%	0.839	53%	0.525	S	S	*	.			trans	-136.9	120	147.8	-80.6	-171.1	179.4	177.6	0	110.3	G376	G376-K378 PolarHBondContact O-N 2.72Å
379	K	25.2	Very low	46.4	Very low	205 Å²	205	96.8 Å²	96.8	89%	0.891	52%	0.516	S	S	*	.			trans	-69.3	119.7	176	-77.7	176.1	168.5	-179.1	0	110.3
380	L	31.1	Very low	49.5	Very low	98 Å²	98	93.3 Å²	93.3	51%	0.513	50%	0.499	S	S	.	.			trans	-135	138.5	160.3	-100.1	94.6	0	0	0	109.3	D56	D56-L380 VanDerWaalsContact CB-O 3.22Å; D56-L380 WeakPolarHBondContact CB-O 3.43Å
381	A	39	Very low	52.3	Low	36 Å²	36	87.5 Å²	87.5	30%	0.298	48%	0.477	S	S	.	.			trans	-50.6	172.7	170.9	0	0	0	0	0	112	D56 G383	D56-A381 WeakPolarHBondContact OD2-CA 2.88Å; A381-G383 PolarHBondContact O-N 2.84Å
382	C	52.9	Low	55.2	Low	10 Å²	10	84.3 Å²	84.3	7%	0.068	46%	0.458	C	S	.	.	S	Bend	trans	-69	46.9	-179.5	-153.2	0	0	0	0	113.8	C57 C495	C57-C382 WeakPolarHBondContact CA-SG 3.31Å; C57-C382 HydrophobicContact CB-CB 4.2Å; C57-C382 WeakPolarHBondContact CB-SG 3.39Å; C57-C382 WeakPolarHBondContact SG-CA 3.48Å; C57-C382 WeakPolarHBondContact SG-CB 3.38Å; C57-C382 CovalentContact SG-SG 2.05Å; C57-C382 PolarHBondContact SG-SG 2.88Å; C382-C495 PolarHBondContact O-N 3.39Å
383	G	59.7	Low	57.9	Low	6 Å²	6	79.6 Å²	79.6	6%	0.062	43%	0.429	C	S	.	.			trans	70.3	145	-157.4	0	0	0	0	0	112.7	A381 E444	A381-G383 PolarHBondContact O-N 2.84Å; G383-E444 CarbonylContact C-O 3.59Å; G383-E444 WeakPolarHBondContact CA-O 3.3Å
384	Q	69.8	Low	60.4	Low	112 Å²	112	76.3 Å²	76.3	52%	0.523	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-80.5	154.5	157.2	-67.7	-60.3	-36.4	0	0	109	P386 E444 C495	Q384-P386 WeakPolarHBondContact O-CD 3.45Å; Q384-E444 PolarHBondContact N-O 3.45Å; Q384-C495 WeakPolarHBondContact O-CB 3.39Å
385	Q	80.4	Confident	63.1	Low	86 Å²	86	71 Å²	71	40%	0.402	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-60.1	124.1	169.9	179.3	170.2	-34.7	0	0	109.1	L389 C495 N496	Q385-L389 HydrophobicContact CG-CD1 4.17Å; Q385-L389 VanDerWaalsContact NE2-CD1 3.28Å; Q385-C495 VanDerWaalsContact CA-O 3.27Å; Q385-C495 WeakPolarHBondContact CA-O 3.17Å; Q385-N496 HydrophobicContact CB-CB 4.15Å
386	P	83.5	Confident	65.6	Low	2 Å²	2	64.3 Å²	64.3	1%	0.013	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-57.8	142.4	174.9	-25.1	35.6	0	0	0	111.5	Q384 L389 V435 Y439 C445 L448 W541	Q384-P386 WeakPolarHBondContact O-CD 3.45Å; P386-L389 HydrophobicContact CB-CD2 4.27Å; P386-L389 WeakPolarHBondContact O-CG 3.19Å; P386-V435 HydrophobicContact CB-CG2 3.55Å; P386-V435 HydrophobicContact CG-CG2 3.6Å; P386-Y439 WeakPolarHBondContact CA-OH 3.48Å; P386-Y439 HydrophobicContact CB-CE1 4.1Å; P386-Y439 HydrophobicContact CB-CE2 4.37Å; P386-Y439 WeakPolarHBondContact CB-OH 3.4Å; P386-C445 HydrophobicContact CG-CB 3.71Å; P386-L448 HydrophobicContact CG-CD1 4.46Å; P386-L448 HydrophobicContact CG-CD2 4.34Å; P386-W541 HydrophobicContact CG-CH2 4.29Å; P386-W541 HydrophobicContact CG-CZ2 3.93Å
387	E	83.4	Confident	68.3	Low	127 Å²	127	60.9 Å²	60.9	59%	0.593	30%	0.304	S	S	*	.	S	Bend	trans	-74.6	169	168.8	-63.7	-170.5	168.9	0	0	111.5	L389 Y439	E387-L389 VanDerWaalsContact C-N 3.33Å; E387-L389 PolarHBondContact O-N 3.24Å; E387-Y439 PolarHBondContact N-OH 3.15Å; E387-Y439 VanDerWaalsContact O-CE2 3.32Å; E387-Y439 WeakPolarHBondContact O-CE2 3.43Å
388	N	84.5	Confident	71.1	Confident	124 Å²	124	57.2 Å²	57.2	66%	0.663	28%	0.279	S	S	*	.	S	Bend	trans	57.8	38.5	173.3	-57.5	-44.5	0	0	0	115.3	P436	N388-P436 VanDerWaalsContact O-CD 3.26Å; N388-P436 WeakPolarHBondContact O-CD 2.96Å
389	L	88.3	Confident	73.5	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.079	27%	0.27	C	S	.	.			trans	-60.8	144.6	172.9	-61.4	174.7	0	0	0	111.3	Q385 P386 E387 I434 V435 W541 V544	Q385-L389 HydrophobicContact CG-CD1 4.17Å; Q385-L389 VanDerWaalsContact NE2-CD1 3.28Å; P386-L389 HydrophobicContact CB-CD2 4.27Å; P386-L389 WeakPolarHBondContact O-CG 3.19Å; E387-L389 VanDerWaalsContact C-N 3.33Å; E387-L389 PolarHBondContact O-N 3.24Å; L389-I434 WeakPolarHBondContact CA-O 3.34Å; L389-V435 HydrophobicContact CD2-CG2 3.85Å; L389-W541 HydrophobicContact CD1-CB 3.5Å; L389-W541 HydrophobicContact CD1-CD2 4.14Å; L389-W541 HydrophobicContact CD1-CG 3.62Å; L389-W541 HydrophobicContact CD2-CD2 3.87Å; L389-W541 HydrophobicContact CD2-CE3 3.71Å; L389-W541 HydrophobicContact CD2-CG 4.26Å; L389-W541 HydrophobicContact CD2-CZ3 4.25Å; L389-V544 HydrophobicContact CB-CG1 3.93Å
390	T	90.4	Very high	76	Confident	29 Å²	29	47 Å²	47	18%	0.178	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.9	178.3	57.2	0	0	0	0	110.2	S433 I434 P436	T390-S433 CarbonylContact O-C 3.28Å; T390-S433 WeakPolarHBondContact O-CA 3.26Å; T390-S433 WeakPolarHBondContact O-CB 3.39Å; T390-I434 PolarHBondContact N-O 3.21Å; T390-I434 PolarHBondContact O-N 3.24Å; T390-P436 HydrophobicContact CG2-CB 3.99Å; T390-P436 HydrophobicContact CG2-CG 4.08Å
391	N	88.6	Confident	78.2	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.011	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	140.1	-176.1	-68.9	-32.4	0	0	0	111.7	F393 D408 S433 P543 V544	N391-F393 HydrophobicContact CB-CD2 4.17Å; N391-F393 HydrophobicContact CB-CE2 3.5Å; N391-F393 HydrophobicContact CB-CZ 3.84Å; N391-D408 WeakPolarHBondContact CB-OD2 3.39Å; N391-D408 PolarHBondContact O-N 2.82Å; N391-S433 PolarHBondContact OD1-OG 2.77Å; N391-P543 WeakPolarHBondContact OD1-CA 3.21Å; N391-V544 PolarHBondContact ND2-O 2.67Å; N391-V544 WeakPolarHBondContact OD1-CG2 3.3Å; N391-V544 PolarHBondContact OD1-N 3.47Å
392	A	87.3	Confident	80	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.008	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.8	161.9	0	0	0	0	0	108.1	A406 F407 P430 A431 G432 I434	A392-A406 CarbonylContact C-O 3.52Å; A392-A406 VanDerWaalsContact CA-O 3.28Å; A392-A406 WeakPolarHBondContact CA-O 3.48Å; A392-F407 HydrophobicContact CB-CD1 3.73Å; A392-F407 HydrophobicContact CB-CE1 3.79Å; A392-P430 CarbonylContact O-C 3.56Å; A392-P430 WeakPolarHBondContact O-CA 3.32Å; A392-A431 PolarHBondContact O-N 3Å; A392-G432 PolarHBondContact N-O 3.21Å; A392-I434 HydrophobicContact CB-CG2 4.35Å
393	F	84.3	Confident	81.4	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.8	177.9	-72	-84	0	0	0	110.9	N391 F395 L405 A406 D408 F414 P430 I550	N391-F393 HydrophobicContact CB-CD2 4.17Å; N391-F393 HydrophobicContact CB-CE2 3.5Å; N391-F393 HydrophobicContact CB-CZ 3.84Å; F393-F395 HydrophobicContact CB-CD2 4.35Å; F393-F395 HydrophobicContact CB-CE2 3.59Å; F393-F395 HydrophobicContact CB-CZ 4.24Å; F393-L405 CarbonylContact O-C 3.49Å; F393-L405 WeakPolarHBondContact O-CA 3.24Å; F393-A406 PolarHBondContact N-O 3.48Å; F393-A406 PolarHBondContact O-N 3.39Å; F393-D408 WeakPolarHBondContact CE2-OD1 3.49Å; F393-D408 WeakPolarHBondContact CE2-OD2 3.39Å; F393-F414 HydrophobicContact CD2-CE1 4.37Å; F393-F414 HydrophobicContact CD2-CZ 4.14Å; F393-P430 HydrophobicContact CD1-CB 4.21Å; F393-P430 HydrophobicContact CE1-CB 3.92Å; F393-P430 HydrophobicContact CE1-CG 4.36Å; F393-P430 HydrophobicContact CZ-CB 4.47Å; F393-I550 HydrophobicContact CD1-CD1 3.62Å; F393-I550 HydrophobicContact CE1-CD1 3.44Å; F393-I550 VanDerWaalsContact CE1-CD1 3.44Å; F393-I550 HydrophobicContact CG-CD1 4.27Å; F393-I550 HydrophobicContact CZ-CD1 3.93Å
394	R	81.6	Confident	82.6	Confident	23 Å²	23	48.1 Å²	48.1	9%	0.087	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.4	173.4	-174.9	179.3	161.6	-128.2	-8.1	110.1	N403 L405 L428 G429 A431 Q513 L514 D519	R394-N403 PolarHBondContact NE-ND2 3.02Å; R394-N403 PolarHBondContact NE-OD1 2.87Å; R394-N403 VanDerWaalsContact NE-OD1 3.14Å; R394-N403 PolarHBondContact NH2-ND2 3.28Å; R394-N403 PolarHBondContact NH2-OD1 2.73Å; R394-L405 HydrophobicContact CB-CD2 3.99Å; R394-L405 HydrophobicContact CG-CD2 4.18Å; R394-L428 HydrophobicContact CB-CB 4.31Å; R394-L428 HydrophobicContact CG-CB 4.37Å; R394-L428 HydrophobicContact CG-CD1 4.01Å; R394-L428 WeakPolarHBondContact O-CB 3.43Å; R394-L428 PolarHBondContact O-N 2.82Å; R394-G429 PolarHBondContact N-O 3.37Å; R394-A431 HydrophobicContact CB-CB 4.27Å; R394-Q513 PolarHBondContact NE-O 2.92Å; R394-L514 VanDerWaalsContact NH1-CD2 3.26Å; R394-D519 IonicContact NH1-OD2 3.85Å; R394-D519 PolarHBondContact NH1-OD2 3.11Å
395	F	84.9	Confident	83.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.4	169.1	-61.7	-98.4	0	0	0	108.9	F393 N403 I404 A406 F414 L418 T426 I427	F393-F395 HydrophobicContact CB-CD2 4.35Å; F393-F395 HydrophobicContact CB-CE2 3.59Å; F393-F395 HydrophobicContact CB-CZ 4.24Å; F395-N403 CarbonylContact O-C 3.55Å; F395-N403 VanDerWaalsContact O-CA 3.3Å; F395-N403 WeakPolarHBondContact O-CA 3.41Å; F395-I404 HydrophobicContact CB-CB 4.34Å; F395-I404 PolarHBondContact N-O 3.49Å; F395-I404 PolarHBondContact O-N 3.17Å; F395-A406 HydrophobicContact CD2-CB 4.02Å; F395-A406 HydrophobicContact CE2-CB 3.63Å; F395-F414 AromaticContact CE2-CD1 3.87Å; F395-F414 HydrophobicContact CE2-CD1 3.87Å; F395-F414 AromaticContact CE2-CE1 3.93Å; F395-F414 HydrophobicContact CE2-CE1 3.93Å; F395-F414 AromaticContact CZ-CD1 3.71Å; F395-F414 HydrophobicContact CZ-CD1 3.71Å; F395-F414 AromaticContact CZ-CE1 3.84Å; F395-F414 HydrophobicContact CZ-CE1 3.84Å; F395-L418 HydrophobicContact CD1-CD1 3.92Å; F395-L418 HydrophobicContact CE1-CD1 3.78Å; F395-L418 HydrophobicContact CE1-CD2 3.7Å; F395-L418 HydrophobicContact CE1-CG 4.42Å; F395-L418 HydrophobicContact CZ-CD2 4.12Å; F395-T426 CarbonylContact C-O 3.57Å; F395-T426 WeakPolarHBondContact CA-O 3.47Å; F395-I427 HydrophobicContact CD1-CB 4.37Å; F395-I427 HydrophobicContact CD1-CG1 3.95Å; F395-I427 HydrophobicContact CD1-CG2 4.41Å; F395-I427 HydrophobicContact CE1-CB 4.22Å; F395-I427 HydrophobicContact CE1-CD1 4.05Å; F395-I427 HydrophobicContact CE1-CG1 3.69Å; F395-I427 HydrophobicContact CE1-CG2 3.95Å; F395-I427 HydrophobicContact CZ-CG2 4.41Å
396	Y	81.1	Confident	83.8	Confident	56 Å²	56	38.8 Å²	38.8	22%	0.22	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.7	167.6	-175.7	-105.7	0	0	0	109.1	N398 R401 N403 Y425 T426	Y396-N398 WeakPolarHBondContact CD1-OD1 3.18Å; Y396-N398 PolarHBondContact O-N 3.1Å; Y396-R401 WeakPolarHBondContact OH-CA 3.21Å; Y396-R401 WeakPolarHBondContact OH-CB 3.29Å; Y396-N403 WeakPolarHBondContact CD2-OD1 3.37Å; Y396-Y425 WeakPolarHBondContact O-CA 3.08Å; Y396-T426 PolarHBondContact N-O 3.45Å; Y396-T426 PolarHBondContact O-N 3.23Å
397	D	84.4	Confident	83.9	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	103.6	171.2	-173.4	-31.7	0	0	0	107.8	F399 L400 R401 T402 I404 R424 Y425	D397-F399 PolarHBondContact O-N 3.13Å; D397-F399 WeakPolarHBondContact OD1-CA 3.48Å; D397-F399 VanDerWaalsContact OD1-CB 3.27Å; D397-F399 WeakPolarHBondContact OD1-CB 3.09Å; D397-F399 PolarHBondContact OD1-N 2.91Å; D397-L400 HydrophobicContact CB-CB 4.18Å; D397-L400 PolarHBondContact O-N 3.45Å; D397-L400 PolarHBondContact OD1-N 3.25Å; D397-L400 WeakPolarHBondContact OD2-CD1 3.3Å; D397-R401 VanDerWaalsContact O-CA 3.26Å; D397-R401 WeakPolarHBondContact O-CA 3.46Å; D397-R401 PolarHBondContact O-N 3.41Å; D397-T402 HydrophobicContact CB-CG2 4.44Å; D397-T402 PolarHBondContact N-O 3.31Å; D397-T402 PolarHBondContact O-N 2.9Å; D397-I404 HydrophobicContact CB-CD1 4.18Å; D397-R424 IonicContact OD1-NE 2.95Å; D397-R424 PolarHBondContact OD1-NE 3.35Å; D397-R424 IonicContact OD2-CZ 2.84Å; D397-R424 IonicContact OD2-NE 2.77Å; D397-R424 PolarHBondContact OD2-NE 2.85Å; D397-R424 VanDerWaalsContact OD2-NE 3.11Å; D397-R424 IonicContact OD2-NH2 3.11Å; D397-R424 PolarHBondContact OD2-NH2 2.79Å; D397-Y425 HydrophobicContact CB-CD1 4.12Å; D397-Y425 HydrophobicContact CB-CE1 3.86Å; D397-Y425 WeakPolarHBondContact OD2-CE1 3.4Å
398	N	82.2	Confident	83.9	Confident	69 Å²	69	35.8 Å²	35.8	37%	0.369	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.9	-179.2	-68.7	-72	0	0	0	112.6	Y396 R424 T426	Y396-N398 WeakPolarHBondContact CD1-OD1 3.18Å; Y396-N398 PolarHBondContact O-N 3.1Å; N398-R424 VanDerWaalsContact CB-O 3.25Å; N398-R424 WeakPolarHBondContact CB-O 3.43Å; N398-R424 PolarHBondContact N-O 3.5Å; N398-R424 PolarHBondContact ND2-O 3.27Å; N398-T426 PolarHBondContact ND2-N 3.28Å; N398-T426 PolarHBondContact ND2-OG1 2.92Å
399	F	81	Confident	83.6	Confident	150 Å²	150	31.8 Å²	31.8	66%	0.658	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-47.7	179.6	-177.5	-97.7	0	0	0	111.2	D397 R401 R424	D397-F399 PolarHBondContact O-N 3.13Å; D397-F399 WeakPolarHBondContact OD1-CA 3.48Å; D397-F399 VanDerWaalsContact OD1-CB 3.27Å; D397-F399 WeakPolarHBondContact OD1-CB 3.09Å; D397-F399 PolarHBondContact OD1-N 2.91Å; F399-R401 VanDerWaalsContact C-N 3.34Å; F399-R424 HydrophobicContact CB-CG 4.1Å
400	L	78.1	Confident	83.4	Confident	33 Å²	33	32.4 Å²	32.4	17%	0.173	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.3	178.9	-63.9	-177.2	0	0	0	113.8	D397 T402 R460 N510	D397-L400 HydrophobicContact CB-CB 4.18Å; D397-L400 PolarHBondContact O-N 3.45Å; D397-L400 PolarHBondContact OD1-N 3.25Å; D397-L400 WeakPolarHBondContact OD2-CD1 3.3Å; L400-T402 VanDerWaalsContact C-N 3.26Å; L400-T402 HydrophobicContact CB-CG2 3.78Å; L400-T402 PolarHBondContact O-N 3.41Å; L400-R460 HydrophobicContact CD2-CB 4.21Å; L400-N510 PolarHBondContact O-ND2 2.8Å
401	R	76.6	Confident	82.8	Confident	147 Å²	147	36 Å²	36	56%	0.555	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	43.8	-175.9	-55.5	-176.8	176.8	-167.2	-1.9	112.7	Y396 D397 F399 I509	Y396-R401 WeakPolarHBondContact OH-CA 3.21Å; Y396-R401 WeakPolarHBondContact OH-CB 3.29Å; D397-R401 VanDerWaalsContact O-CA 3.26Å; D397-R401 WeakPolarHBondContact O-CA 3.46Å; D397-R401 PolarHBondContact O-N 3.41Å; F399-R401 VanDerWaalsContact C-N 3.34Å; R401-I509 HydrophobicContact CB-CG2 3.66Å
402	T	77.1	Confident	82.5	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	157.6	-177	-166.6	0	0	0	0	110.5	D397 L400	D397-T402 HydrophobicContact CB-CG2 4.44Å; D397-T402 PolarHBondContact N-O 3.31Å; D397-T402 PolarHBondContact O-N 2.9Å; L400-T402 VanDerWaalsContact C-N 3.26Å; L400-T402 HydrophobicContact CB-CG2 3.78Å; L400-T402 PolarHBondContact O-N 3.41Å
403	N	81.3	Confident	82.2	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.032	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	148.9	173.2	-70.9	-25	0	0	0	110.8	R394 F395 Y396 V512 Q513	R394-N403 PolarHBondContact NE-ND2 3.02Å; R394-N403 PolarHBondContact NE-OD1 2.87Å; R394-N403 VanDerWaalsContact NE-OD1 3.14Å; R394-N403 PolarHBondContact NH2-ND2 3.28Å; R394-N403 PolarHBondContact NH2-OD1 2.73Å; F395-N403 CarbonylContact O-C 3.55Å; F395-N403 VanDerWaalsContact O-CA 3.3Å; F395-N403 WeakPolarHBondContact O-CA 3.41Å; Y396-N403 WeakPolarHBondContact CD2-OD1 3.37Å; N403-V512 VanDerWaalsContact ND2-CB 3.31Å; N403-V512 WeakPolarHBondContact ND2-CB 3.45Å; N403-Q513 PolarHBondContact ND2-N 3.43Å; N403-Q513 VanDerWaalsContact ND2-N 3.2Å; N403-Q513 PolarHBondContact ND2-O 3.14Å
404	I	86.7	Confident	82	Confident	20 Å²	20	45.1 Å²	45.1	10%	0.103	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.6	168.4	-54.6	175.5	0	0	0	106	F395 D397 P415 Y425	F395-I404 HydrophobicContact CB-CB 4.34Å; F395-I404 PolarHBondContact N-O 3.49Å; F395-I404 PolarHBondContact O-N 3.17Å; D397-I404 HydrophobicContact CB-CD1 4.18Å; I404-P415 HydrophobicContact CD1-CG 4.03Å; I404-Y425 HydrophobicContact CD1-CD1 4.49Å; I404-Y425 HydrophobicContact CD1-CE1 3.91Å
405	L	88.3	Confident	81.9	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122	165.2	-60.5	-178	0	0	0	107.8	F393 R394 F407 A431 Y464 M501	F393-L405 CarbonylContact O-C 3.49Å; F393-L405 WeakPolarHBondContact O-CA 3.24Å; R394-L405 HydrophobicContact CB-CD2 3.99Å; R394-L405 HydrophobicContact CG-CD2 4.18Å; L405-F407 HydrophobicContact CB-CE1 4.41Å; L405-F407 HydrophobicContact CB-CE2 3.98Å; L405-F407 HydrophobicContact CB-CZ 3.67Å; L405-F407 HydrophobicContact CD1-CZ 4.44Å; L405-F407 VanDerWaalsContact O-CE2 3.26Å; L405-F407 WeakPolarHBondContact O-CE2 3.25Å; L405-A431 HydrophobicContact CD2-CB 4.36Å; L405-Y464 HydrophobicContact CB-CD1 4.44Å; L405-Y464 HydrophobicContact CB-CD2 4.01Å; L405-Y464 HydrophobicContact CB-CE1 4.06Å; L405-Y464 HydrophobicContact CB-CE2 3.63Å; L405-Y464 HydrophobicContact CB-CG 4.42Å; L405-Y464 HydrophobicContact CD1-CD2 3.63Å; L405-Y464 HydrophobicContact CD1-CE2 4.1Å; L405-Y464 HydrophobicContact CD1-CG 3.89Å; L405-Y464 HydrophobicContact CG-CD2 3.77Å; L405-Y464 HydrophobicContact CG-CE2 3.71Å; L405-Y464 HydrophobicContact CG-CG 4.39Å; L405-Y464 PolarHBondContact N-OH 2.65Å; L405-Y464 PolarHBondContact O-OH 3.14Å; L405-M501 HydrophobicContact CD1-CE 3.98Å; L405-M501 HydrophobicContact CD2-CE 4.35Å
406	A	85.9	Confident	81.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	153.5	168.1	0	0	0	0	0	108.9	A392 F393 F395 S413 F414	A392-A406 CarbonylContact C-O 3.52Å; A392-A406 VanDerWaalsContact CA-O 3.28Å; A392-A406 WeakPolarHBondContact CA-O 3.48Å; F393-A406 PolarHBondContact N-O 3.48Å; F393-A406 PolarHBondContact O-N 3.39Å; F395-A406 HydrophobicContact CD2-CB 4.02Å; F395-A406 HydrophobicContact CE2-CB 3.63Å; A406-S413 WeakPolarHBondContact CA-OG 3.26Å; A406-F414 HydrophobicContact CB-CB 4.38Å; A406-F414 HydrophobicContact CB-CD1 3.64Å; A406-F414 HydrophobicContact CB-CD2 3.94Å; A406-F414 HydrophobicContact CB-CE1 3.79Å; A406-F414 HydrophobicContact CB-CE2 4.08Å; A406-F414 HydrophobicContact CB-CG 3.73Å; A406-F414 HydrophobicContact CB-CZ 4.01Å
407	F	86.8	Confident	81.5	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.3	-171.3	-54.9	-88.1	0	0	0	108.1	A392 L405 S409 I410 S413 F414 I434 Y464 V485	A392-F407 HydrophobicContact CB-CD1 3.73Å; A392-F407 HydrophobicContact CB-CE1 3.79Å; L405-F407 HydrophobicContact CB-CE1 4.41Å; L405-F407 HydrophobicContact CB-CE2 3.98Å; L405-F407 HydrophobicContact CB-CZ 3.67Å; L405-F407 HydrophobicContact CD1-CZ 4.44Å; L405-F407 VanDerWaalsContact O-CE2 3.26Å; L405-F407 WeakPolarHBondContact O-CE2 3.25Å; F407-S409 PolarHBondContact O-N 2.99Å; F407-I410 HydrophobicContact CB-CB 4.38Å; F407-I410 HydrophobicContact CB-CG1 4.49Å; F407-I410 CarbonylContact O-C 3.57Å; F407-I410 VanDerWaalsContact O-C 3.28Å; F407-I410 WeakPolarHBondContact O-CA 3.31Å; F407-I410 PolarHBondContact O-N 3.2Å; F407-I410 VanDerWaalsContact O-O 3.06Å; F407-S413 PolarHBondContact N-OG 3.1Å; F407-S413 PolarHBondContact O-OG 3.49Å; F407-F414 WeakPolarHBondContact O-CE2 3.48Å; F407-I434 HydrophobicContact CB-CD1 4.32Å; F407-I434 HydrophobicContact CD1-CD1 3.38Å; F407-I434 HydrophobicContact CD1-CG1 4.05Å; F407-I434 HydrophobicContact CE1-CD1 4.05Å; F407-I434 HydrophobicContact CG-CD1 4.17Å; F407-Y464 HydrophobicContact CE2-CD1 4.14Å; F407-Y464 AromaticContact CE2-CE1 3.71Å; F407-Y464 HydrophobicContact CE2-CE1 3.71Å; F407-Y464 AromaticContact CZ-CD1 3.92Å; F407-Y464 HydrophobicContact CZ-CD1 3.92Å; F407-Y464 AromaticContact CZ-CE1 3.94Å; F407-Y464 HydrophobicContact CZ-CE1 3.94Å; F407-V485 HydrophobicContact CD1-CG2 4.45Å; F407-V485 HydrophobicContact CD2-CB 3.67Å; F407-V485 HydrophobicContact CD2-CG1 4.1Å; F407-V485 HydrophobicContact CD2-CG2 4.06Å; F407-V485 HydrophobicContact CE1-CB 4.37Å; F407-V485 HydrophobicContact CE1-CG2 3.85Å; F407-V485 HydrophobicContact CE2-CB 3.52Å; F407-V485 HydrophobicContact CE2-CG1 3.86Å; F407-V485 HydrophobicContact CE2-CG2 3.43Å; F407-V485 VanDerWaalsContact CE2-CG2 3.43Å; F407-V485 HydrophobicContact CG-CB 4.19Å; F407-V485 HydrophobicContact CZ-CB 3.9Å; F407-V485 HydrophobicContact CZ-CG2 3.3Å
408	D	82	Confident	81.1	Confident	64 Å²	64	50.6 Å²	50.6	34%	0.342	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.6	179.9	-82.4	-15.2	0	0	0	112.4	N391 F393 I410	N391-D408 WeakPolarHBondContact CB-OD2 3.39Å; N391-D408 PolarHBondContact O-N 2.82Å; F393-D408 WeakPolarHBondContact CE2-OD1 3.49Å; F393-D408 WeakPolarHBondContact CE2-OD2 3.39Å; D408-I410 PolarHBondContact O-N 3.23Å; D408-I410 VanDerWaalsContact O-N 3.15Å
409	S	78.3	Confident	80.8	Confident	40 Å²	40	55.5 Å²	55.5	28%	0.28	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-8.8	177.1	58.2	0	0	0	0	114.2	F407	F407-S409 PolarHBondContact O-N 2.99Å
410	I	84.1	Confident	80.7	Confident	27 Å²	27	53 Å²	53	14%	0.138	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-136.3	85	-176.4	-52.7	-179.8	0	0	0	108.9	F407 D408 T412 S413 L437 V485	F407-I410 HydrophobicContact CB-CB 4.38Å; F407-I410 HydrophobicContact CB-CG1 4.49Å; F407-I410 CarbonylContact O-C 3.57Å; F407-I410 VanDerWaalsContact O-C 3.28Å; F407-I410 WeakPolarHBondContact O-CA 3.31Å; F407-I410 PolarHBondContact O-N 3.2Å; F407-I410 VanDerWaalsContact O-O 3.06Å; D408-I410 PolarHBondContact O-N 3.23Å; D408-I410 VanDerWaalsContact O-N 3.15Å; I410-T412 WeakPolarHBondContact CG2-OG1 3.47Å; I410-T412 PolarHBondContact O-N 2.86Å; I410-S413 VanDerWaalsContact O-CB 3.28Å; I410-S413 WeakPolarHBondContact O-CB 3.37Å; I410-S413 PolarHBondContact O-N 3.32Å; I410-S413 PolarHBondContact O-OG 2.8Å; I410-L437 HydrophobicContact CD1-CD1 3.66Å; I410-L437 HydrophobicContact CD1-CG 4.25Å; I410-L437 HydrophobicContact CG1-CD1 4.25Å; I410-V485 VanDerWaalsContact CD1-CA 3.45Å; I410-V485 HydrophobicContact CD1-CB 3.9Å; I410-V485 HydrophobicContact CD1-CG1 4.19Å; I410-V485 VanDerWaalsContact CD1-O 3.23Å; I410-V485 WeakPolarHBondContact CD1-O 3.49Å
411	P	79.3	Confident	80.8	Confident	104 Å²	104	55.5 Å²	55.5	68%	0.675	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-55.5	-28.9	-178.3	-28.6	35.7	0	0	0	114.3	S413 F414	P411-S413 PolarHBondContact O-N 3.16Å; P411-F414 PolarHBondContact O-N 3.36Å
412	T	81.4	Confident	80.7	Confident	129 Å²	129	55.4 Å²	55.4	79%	0.791	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-74.2	-9.7	177.4	53.2	0	0	0	0	114.2	I410 F414	I410-T412 WeakPolarHBondContact CG2-OG1 3.47Å; I410-T412 PolarHBondContact O-N 2.86Å; T412-F414 VanDerWaalsContact C-N 3.32Å
413	S	81.9	Confident	80.8	Confident	25 Å²	25	65.1 Å²	65.1	18%	0.175	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-78.8	-18.9	174.9	69.2	0	0	0	0	112.7	A406 F407 I410 P411	A406-S413 WeakPolarHBondContact CA-OG 3.26Å; F407-S413 PolarHBondContact N-OG 3.1Å; F407-S413 PolarHBondContact O-OG 3.49Å; I410-S413 VanDerWaalsContact O-CB 3.28Å; I410-S413 WeakPolarHBondContact O-CB 3.37Å; I410-S413 PolarHBondContact O-N 3.32Å; I410-S413 PolarHBondContact O-OG 2.8Å; P411-S413 PolarHBondContact O-N 3.16Å
414	F	79.6	Confident	81	Confident	48 Å²	48	67.8 Å²	67.8	21%	0.211	37%	0.369	C	S	.	.	S	Bend	trans	-71.5	140.7	171.8	-68.7	-96.8	0	0	0	109.7	F393 F395 A406 F407 P411 T412 A416	F393-F414 HydrophobicContact CD2-CE1 4.37Å; F393-F414 HydrophobicContact CD2-CZ 4.14Å; F395-F414 AromaticContact CE2-CD1 3.87Å; F395-F414 HydrophobicContact CE2-CD1 3.87Å; F395-F414 AromaticContact CE2-CE1 3.93Å; F395-F414 HydrophobicContact CE2-CE1 3.93Å; F395-F414 AromaticContact CZ-CD1 3.71Å; F395-F414 HydrophobicContact CZ-CD1 3.71Å; F395-F414 AromaticContact CZ-CE1 3.84Å; F395-F414 HydrophobicContact CZ-CE1 3.84Å; A406-F414 HydrophobicContact CB-CB 4.38Å; A406-F414 HydrophobicContact CB-CD1 3.64Å; A406-F414 HydrophobicContact CB-CD2 3.94Å; A406-F414 HydrophobicContact CB-CE1 3.79Å; A406-F414 HydrophobicContact CB-CE2 4.08Å; A406-F414 HydrophobicContact CB-CG 3.73Å; A406-F414 HydrophobicContact CB-CZ 4.01Å; F407-F414 WeakPolarHBondContact O-CE2 3.48Å; P411-F414 PolarHBondContact O-N 3.36Å; T412-F414 VanDerWaalsContact C-N 3.32Å; F414-A416 PolarHBondContact O-N 2.85Å; F414-A416 VanDerWaalsContact O-N 3.12Å
415	P	78.4	Confident	80.9	Confident	17 Å²	17	67.7 Å²	67.7	11%	0.11	37%	0.368	C	S	.	.			trans	-54.4	121.6	174.2	-23.6	32.9	0	0	0	110.6	I404 D417 L418 Y425	I404-P415 HydrophobicContact CD1-CG 4.03Å; P415-D417 PolarHBondContact O-N 3Å; P415-L418 HydrophobicContact CB-CB 4.26Å; P415-L418 WeakPolarHBondContact O-CB 3.35Å; P415-L418 PolarHBondContact O-N 2.91Å; P415-Y425 HydrophobicContact CB-CD1 4.32Å; P415-Y425 HydrophobicContact CB-CD2 4.31Å; P415-Y425 HydrophobicContact CB-CE1 3.85Å; P415-Y425 HydrophobicContact CB-CE2 3.84Å; P415-Y425 HydrophobicContact CG-CD1 4.04Å; P415-Y425 HydrophobicContact CG-CE1 3.86Å; P415-Y425 HydrophobicContact CG-CG 4.48Å
416	A	77.8	Confident	80.5	Confident	112 Å²	112	70.3 Å²	70.3	93%	0.926	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.5	-174	0	0	0	0	0	112.8	F414	F414-A416 PolarHBondContact O-N 2.85Å; F414-A416 VanDerWaalsContact O-N 3.12Å
417	D	80.7	Confident	80.2	Confident	34 Å²	34	74 Å²	74	18%	0.182	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	10.3	176.9	60	-28.3	0	0	0	113.3	P415 K419 S420 Q421 R424 Y425	P415-D417 PolarHBondContact O-N 3Å; D417-K419 PolarHBondContact O-N 3.45Å; D417-K419 VanDerWaalsContact O-N 3.16Å; D417-S420 WeakPolarHBondContact CA-OG 3.37Å; D417-S420 WeakPolarHBondContact CB-OG 3.12Å; D417-S420 PolarHBondContact O-N 3.28Å; D417-S420 PolarHBondContact O-OG 2.9Å; D417-Q421 HydrophobicContact CB-CG 4.23Å; D417-Q421 PolarHBondContact O-N 3.16Å; D417-Q421 PolarHBondContact OD2-OE1 3.41Å; D417-R424 IonicContact OD2-CZ 3.18Å; D417-R424 IonicContact OD2-NH1 2.8Å; D417-R424 PolarHBondContact OD2-NH1 2.79Å; D417-Y425 WeakPolarHBondContact OD1-CE2 3.32Å; D417-Y425 PolarHBondContact OD1-OH 3.29Å; D417-Y425 PolarHBondContact OD2-OH 3.4Å
418	L	76.7	Confident	79.6	Confident	33 Å²	33	77.3 Å²	77.3	17%	0.173	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-42.3	-179.8	-177.2	65.6	0	0	0	112.3	F395 P415 Y425	F395-L418 HydrophobicContact CD1-CD1 3.92Å; F395-L418 HydrophobicContact CE1-CD1 3.78Å; F395-L418 HydrophobicContact CE1-CD2 3.7Å; F395-L418 HydrophobicContact CE1-CG 4.42Å; F395-L418 HydrophobicContact CZ-CD2 4.12Å; P415-L418 HydrophobicContact CB-CB 4.26Å; P415-L418 WeakPolarHBondContact O-CB 3.35Å; P415-L418 PolarHBondContact O-N 2.91Å; L418-Y425 HydrophobicContact CD1-CD2 4.03Å; L418-Y425 HydrophobicContact CD1-CG 3.96Å
419	K	75.3	Confident	79.3	Confident	171 Å²	171	75.2 Å²	75.2	74%	0.743	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-30.2	178.8	-67.2	-173	175.5	-174.7	0	113.9	D417	D417-K419 PolarHBondContact O-N 3.45Å; D417-K419 VanDerWaalsContact O-N 3.16Å
420	S	78.6	Confident	79.2	Confident	98 Å²	98	76.3 Å²	76.3	69%	0.685	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-18.3	-177.6	58.9	0	0	0	0	112.9	D417	D417-S420 WeakPolarHBondContact CA-OG 3.37Å; D417-S420 WeakPolarHBondContact CB-OG 3.12Å; D417-S420 PolarHBondContact O-N 3.28Å; D417-S420 PolarHBondContact O-OG 2.9Å
421	Q	80.7	Confident	78.9	Confident	85 Å²	85	75.3 Å²	75.3	40%	0.397	42%	0.416	S	S	.	.			trans	-128.9	52.9	-179.8	-59.4	-163.2	2	0	0	111.6	D417 K423 R424 Y425	D417-Q421 HydrophobicContact CB-CG 4.23Å; D417-Q421 PolarHBondContact O-N 3.16Å; D417-Q421 PolarHBondContact OD2-OE1 3.41Å; Q421-K423 PolarHBondContact O-N 3.08Å; Q421-R424 HydrophobicContact CB-CB 3.85Å; Q421-R424 WeakPolarHBondContact O-CB 3.39Å; Q421-R424 PolarHBondContact O-N 3.21Å; Q421-Y425 HydrophobicContact CB-CE2 4.49Å
422	E	73.3	Confident	79.2	Confident	146 Å²	146	70.4 Å²	70.4	68%	0.682	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-32.1	179.4	-67	-179.5	174	0	0	113.2	R424 Y425	E422-R424 VanDerWaalsContact C-N 3.3Å; E422-R424 PolarHBondContact O-N 3.45Å; E422-Y425 VanDerWaalsContact O-O 3.11Å
423	K	80.3	Confident	79.5	Confident	204 Å²	204	64.2 Å²	64.2	89%	0.887	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.3	176.9	-65.7	-173.9	-179.2	-179.9	0	114	Q421	Q421-K423 PolarHBondContact O-N 3.08Å
424	R	85.9	Confident	80	Confident	62 Å²	62	63.1 Å²	63.1	23%	0.234	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-34.7	178.9	179.2	173.1	174.1	-165.3	-6.5	111.2	D397 N398 F399 D417 Q421 E422	D397-R424 IonicContact OD1-NE 2.95Å; D397-R424 PolarHBondContact OD1-NE 3.35Å; D397-R424 IonicContact OD2-CZ 2.84Å; D397-R424 IonicContact OD2-NE 2.77Å; D397-R424 PolarHBondContact OD2-NE 2.85Å; D397-R424 VanDerWaalsContact OD2-NE 3.11Å; D397-R424 IonicContact OD2-NH2 3.11Å; D397-R424 PolarHBondContact OD2-NH2 2.79Å; N398-R424 VanDerWaalsContact CB-O 3.25Å; N398-R424 WeakPolarHBondContact CB-O 3.43Å; N398-R424 PolarHBondContact N-O 3.5Å; N398-R424 PolarHBondContact ND2-O 3.27Å; F399-R424 HydrophobicContact CB-CG 4.1Å; D417-R424 IonicContact OD2-CZ 3.18Å; D417-R424 IonicContact OD2-NH1 2.8Å; D417-R424 PolarHBondContact OD2-NH1 2.79Å; Q421-R424 HydrophobicContact CB-CB 3.85Å; Q421-R424 WeakPolarHBondContact O-CB 3.39Å; Q421-R424 PolarHBondContact O-N 3.21Å; E422-R424 VanDerWaalsContact C-N 3.3Å; E422-R424 PolarHBondContact O-N 3.45Å
425	Y	83.2	Confident	80.6	Confident	17 Å²	17	60.8 Å²	60.8	7%	0.067	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.9	-172.8	-60.9	-72.9	0	0	0	111.7	Y396 D397 I404 P415 D417 L418 Q421 E422	Y396-Y425 WeakPolarHBondContact O-CA 3.08Å; D397-Y425 HydrophobicContact CB-CD1 4.12Å; D397-Y425 HydrophobicContact CB-CE1 3.86Å; D397-Y425 WeakPolarHBondContact OD2-CE1 3.4Å; I404-Y425 HydrophobicContact CD1-CD1 4.49Å; I404-Y425 HydrophobicContact CD1-CE1 3.91Å; P415-Y425 HydrophobicContact CB-CD1 4.32Å; P415-Y425 HydrophobicContact CB-CD2 4.31Å; P415-Y425 HydrophobicContact CB-CE1 3.85Å; P415-Y425 HydrophobicContact CB-CE2 3.84Å; P415-Y425 HydrophobicContact CG-CD1 4.04Å; P415-Y425 HydrophobicContact CG-CE1 3.86Å; P415-Y425 HydrophobicContact CG-CG 4.48Å; D417-Y425 WeakPolarHBondContact OD1-CE2 3.32Å; D417-Y425 PolarHBondContact OD1-OH 3.29Å; D417-Y425 PolarHBondContact OD2-OH 3.4Å; L418-Y425 HydrophobicContact CD1-CD2 4.03Å; L418-Y425 HydrophobicContact CD1-CG 3.96Å; Q421-Y425 HydrophobicContact CB-CE2 4.49Å; E422-Y425 VanDerWaalsContact O-O 3.11Å
426	T	81.6	Confident	81.2	Confident	58 Å²	58	61 Å²	61	36%	0.356	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.5	167	-58.3	0	0	0	0	108.6	F395 Y396 N398 L428	F395-T426 CarbonylContact C-O 3.57Å; F395-T426 WeakPolarHBondContact CA-O 3.47Å; Y396-T426 PolarHBondContact N-O 3.45Å; Y396-T426 PolarHBondContact O-N 3.23Å; N398-T426 PolarHBondContact ND2-N 3.28Å; N398-T426 PolarHBondContact ND2-OG1 2.92Å; T426-L428 HydrophobicContact CG2-CD2 3.88Å; T426-L428 HydrophobicContact CG2-CG 4.3Å; T426-L428 PolarHBondContact O-N 2.76Å
427	I	78.8	Confident	81.7	Confident	79 Å²	79	59.4 Å²	59.4	41%	0.405	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.6	173.9	-47	-172.2	0	0	0	107.8	F395 I550	F395-I427 HydrophobicContact CD1-CB 4.37Å; F395-I427 HydrophobicContact CD1-CG1 3.95Å; F395-I427 HydrophobicContact CD1-CG2 4.41Å; F395-I427 HydrophobicContact CE1-CB 4.22Å; F395-I427 HydrophobicContact CE1-CD1 4.05Å; F395-I427 HydrophobicContact CE1-CG1 3.69Å; F395-I427 HydrophobicContact CE1-CG2 3.95Å; F395-I427 HydrophobicContact CZ-CG2 4.41Å; I427-I550 HydrophobicContact CD1-CG2 3.87Å
428	L	74.3	Confident	81.6	Confident	71 Å²	71	61.3 Å²	61.3	37%	0.372	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-0.9	-176.6	-63.3	166.6	0	0	0	112.6	R394 T426	R394-L428 HydrophobicContact CB-CB 4.31Å; R394-L428 HydrophobicContact CG-CB 4.37Å; R394-L428 HydrophobicContact CG-CD1 4.01Å; R394-L428 WeakPolarHBondContact O-CB 3.43Å; R394-L428 PolarHBondContact O-N 2.82Å; T426-L428 HydrophobicContact CG2-CD2 3.88Å; T426-L428 HydrophobicContact CG2-CG 4.3Å; T426-L428 PolarHBondContact O-N 2.76Å
429	G	75.4	Confident	81.7	Confident	19 Å²	19	61 Å²	61	20%	0.196	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	90.1	-173	178	0	0	0	0	0	113.5	R394 A431	R394-G429 PolarHBondContact N-O 3.37Å; G429-A431 PolarHBondContact O-N 2.94Å
430	P	76.9	Confident	81	Confident	64 Å²	64	57.2 Å²	57.2	42%	0.416	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	128	179.8	28.4	-32.9	0	0	0	110.1	A392 F393 P543	A392-P430 CarbonylContact O-C 3.56Å; A392-P430 WeakPolarHBondContact O-CA 3.32Å; F393-P430 HydrophobicContact CD1-CB 4.21Å; F393-P430 HydrophobicContact CE1-CB 3.92Å; F393-P430 HydrophobicContact CE1-CG 4.36Å; F393-P430 HydrophobicContact CZ-CB 4.47Å; P430-P543 HydrophobicContact CB-CB 3.97Å; P430-P543 HydrophobicContact CB-CG 3.99Å; P430-P543 HydrophobicContact CG-CB 4.1Å; P430-P543 HydrophobicContact CG-CG 4.11Å
431	A	78	Confident	80.5	Confident	6 Å²	6	56.3 Å²	56.3	5%	0.05	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-24.3	172.1	0	0	0	0	0	112.2	A392 R394 L405 G429 I499 M501 S515	A392-A431 PolarHBondContact O-N 3Å; R394-A431 HydrophobicContact CB-CB 4.27Å; L405-A431 HydrophobicContact CD2-CB 4.36Å; G429-A431 PolarHBondContact O-N 2.94Å; A431-I499 WeakPolarHBondContact O-CG2 3.27Å; A431-M501 HydrophobicContact CB-CE 3.86Å; A431-S515 VanDerWaalsContact CA-OG 3.23Å; A431-S515 WeakPolarHBondContact CA-OG 3.43Å; A431-S515 WeakPolarHBondContact CB-OG 3.15Å; A431-S515 VanDerWaalsContact O-CB 3.26Å; A431-S515 WeakPolarHBondContact O-CB 3.3Å; A431-S515 PolarHBondContact O-OG 3.07Å
432	G	85	Confident	79.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.8	-173.5	-176.6	0	0	0	0	0	109.3	A392 W541	A392-G432 PolarHBondContact N-O 3.21Å; G432-W541 CarbonylContact C-O 3.54Å; G432-W541 WeakPolarHBondContact CA-O 3.05Å
433	S	88.2	Confident	79.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	153.4	168.8	-53.6	0	0	0	0	112	T390 N391 W541 Q542 P543 V544	T390-S433 CarbonylContact O-C 3.28Å; T390-S433 WeakPolarHBondContact O-CA 3.26Å; T390-S433 WeakPolarHBondContact O-CB 3.39Å; N391-S433 PolarHBondContact OD1-OG 2.77Å; S433-W541 PolarHBondContact N-O 3.05Å; S433-W541 PolarHBondContact O-N 3.29Å; S433-W541 VanDerWaalsContact O-N 3.13Å; S433-Q542 PolarHBondContact OG-O 2.96Å; S433-Q542 VanDerWaalsContact OG-O 3.06Å; S433-P543 VanDerWaalsContact OG-CA 3.24Å; S433-P543 WeakPolarHBondContact OG-CA 2.97Å; S433-V544 PolarHBondContact OG-N 2.96Å
434	I	92.5	Very high	79.1	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	163.5	177.1	55.5	147.6	0	0	0	109.9	L389 T390 A392 F407 I451 V485 L540	L389-I434 WeakPolarHBondContact CA-O 3.34Å; T390-I434 PolarHBondContact N-O 3.21Å; T390-I434 PolarHBondContact O-N 3.24Å; A392-I434 HydrophobicContact CB-CG2 4.35Å; F407-I434 HydrophobicContact CB-CD1 4.32Å; F407-I434 HydrophobicContact CD1-CD1 3.38Å; F407-I434 HydrophobicContact CD1-CG1 4.05Å; F407-I434 HydrophobicContact CE1-CD1 4.05Å; F407-I434 HydrophobicContact CG-CD1 4.17Å; I434-I451 HydrophobicContact CB-CD1 4.25Å; I434-I451 HydrophobicContact CG2-CD1 3.5Å; I434-V485 WeakPolarHBondContact CD1-O 3.3Å; I434-L540 HydrophobicContact CG2-CD2 3.42Å; I434-L540 VanDerWaalsContact CG2-CD2 3.42Å
435	V	91.8	Very high	78.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-79.2	126.3	165.9	175.3	0	0	0	0	108.7	P386 L389 Y439 L448 G486 Y487 W541	P386-V435 HydrophobicContact CB-CG2 3.55Å; P386-V435 HydrophobicContact CG-CG2 3.6Å; L389-V435 HydrophobicContact CD2-CG2 3.85Å; V435-Y439 HydrophobicContact CG1-CD1 3.67Å; V435-Y439 HydrophobicContact CG1-CD2 3.76Å; V435-Y439 HydrophobicContact CG1-CE1 4.38Å; V435-Y439 HydrophobicContact CG1-CE2 4.47Å; V435-Y439 HydrophobicContact CG1-CG 3.3Å; V435-L448 HydrophobicContact CB-CD2 4.37Å; V435-L448 HydrophobicContact CG1-CD1 4.34Å; V435-L448 HydrophobicContact CG2-CD1 4.24Å; V435-L448 HydrophobicContact CG2-CD2 3.76Å; V435-G486 CarbonylContact O-C 3.55Å; V435-G486 VanDerWaalsContact O-CA 3.29Å; V435-G486 WeakPolarHBondContact O-CA 3.38Å; V435-Y487 HydrophobicContact CB-CD2 4.45Å; V435-Y487 HydrophobicContact CG1-CD2 4.17Å; V435-Y487 PolarHBondContact N-O 3.44Å; V435-Y487 PolarHBondContact O-N 2.84Å; V435-W541 HydrophobicContact CG2-CH2 3.95Å; V435-W541 HydrophobicContact CG2-CZ3 3.93Å
436	P	91.5	Very high	77.9	Confident	22 Å²	22	52.1 Å²	52.1	14%	0.143	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-68.2	163.6	-178.4	29.3	-36.1	0	0	0	112.4	N388 T390	N388-P436 VanDerWaalsContact O-CD 3.26Å; N388-P436 WeakPolarHBondContact O-CD 2.96Å; T390-P436 HydrophobicContact CG2-CB 3.99Å; T390-P436 HydrophobicContact CG2-CG 4.08Å
437	L	87.5	Confident	77.5	Confident	77 Å²	77	50.9 Å²	50.9	40%	0.403	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	145.9	168.3	-63.3	178	0	0	0	110.6	I410 Y439 V484 Y487	I410-L437 HydrophobicContact CD1-CD1 3.66Å; I410-L437 HydrophobicContact CD1-CG 4.25Å; I410-L437 HydrophobicContact CG1-CD1 4.25Å; L437-Y439 VanDerWaalsContact C-N 3.33Å; L437-V484 HydrophobicContact CD2-CB 4.19Å; L437-V484 HydrophobicContact CD2-CG1 3.79Å; L437-Y487 HydrophobicContact CD2-CE2 4.28Å
438	G	78.5	Confident	77.7	Confident	75 Å²	75	48.3 Å²	48.3	77%	0.773	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	5.9	-179.9	0	0	0	0	0	115.1	A440	G438-A440 PolarHBondContact O-N 3.43Å; G438-A440 VanDerWaalsContact O-N 3.15Å
439	Y	77.9	Confident	78.3	Confident	26 Å²	26	47.3 Å²	47.3	10%	0.102	28%	0.275	C	S	.	.			trans	-57.6	116.9	173.7	-169.1	-108.8	0	0	0	111.9	P386 E387 V435 L437 N441 E444 L448	P386-Y439 WeakPolarHBondContact CA-OH 3.48Å; P386-Y439 HydrophobicContact CB-CE1 4.1Å; P386-Y439 HydrophobicContact CB-CE2 4.37Å; P386-Y439 WeakPolarHBondContact CB-OH 3.4Å; E387-Y439 PolarHBondContact N-OH 3.15Å; E387-Y439 VanDerWaalsContact O-CE2 3.32Å; E387-Y439 WeakPolarHBondContact O-CE2 3.43Å; V435-Y439 HydrophobicContact CG1-CD1 3.67Å; V435-Y439 HydrophobicContact CG1-CD2 3.76Å; V435-Y439 HydrophobicContact CG1-CE1 4.38Å; V435-Y439 HydrophobicContact CG1-CE2 4.47Å; V435-Y439 HydrophobicContact CG1-CG 3.3Å; L437-Y439 VanDerWaalsContact C-N 3.33Å; Y439-N441 HydrophobicContact CE1-CB 3.82Å; Y439-N441 WeakPolarHBondContact CE1-O 3.44Å; Y439-E444 VanDerWaalsContact OH-CD 3.3Å; Y439-E444 PolarHBondContact OH-OE2 3.29Å; Y439-L448 HydrophobicContact CD1-CD1 4.21Å; Y439-L448 HydrophobicContact CE1-CD1 4.38Å
440	A	62.3	Low	79.1	Confident	91 Å²	91	48.3 Å²	48.3	75%	0.752	28%	0.278	S	S	*	.			trans	-82.7	-30.1	-174.8	0	0	0	0	0	113	G438 R442	G438-A440 PolarHBondContact O-N 3.43Å; G438-A440 VanDerWaalsContact O-N 3.15Å; A440-R442 VanDerWaalsContact C-N 3.31Å; A440-R442 PolarHBondContact O-N 2.91Å; A440-R442 VanDerWaalsContact O-N 3.09Å
441	N	68.1	Low	79.9	Confident	79 Å²	79	45.3 Å²	45.3	42%	0.422	26%	0.258	S	S	.	.			trans	-91.3	49.3	-169.1	-64.4	-0.3	0	0	0	113.1	Y439 E443 E444	Y439-N441 HydrophobicContact CE1-CB 3.82Å; Y439-N441 WeakPolarHBondContact CE1-O 3.44Å; N441-E443 PolarHBondContact O-N 3.01Å; N441-E444 HydrophobicContact CB-CG 4.19Å; N441-E444 VanDerWaalsContact CB-OE1 3.27Å; N441-E444 WeakPolarHBondContact CB-OE1 3.28Å; N441-E444 PolarHBondContact ND2-OE1 2.91Å; N441-E444 PolarHBondContact O-N 2.9Å
442	R	65.9	Low	80.6	Confident	136 Å²	136	45.6 Å²	45.6	51%	0.513	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.9	178.7	-71.6	-170.1	-179.5	170.5	0.5	113.8	A440 E444 C445 Y487	A440-R442 VanDerWaalsContact C-N 3.31Å; A440-R442 PolarHBondContact O-N 2.91Å; A440-R442 VanDerWaalsContact O-N 3.09Å; R442-E444 PolarHBondContact O-N 2.75Å; R442-C445 CarbonylContact O-C 3.53Å; R442-C445 VanDerWaalsContact O-C 3.26Å; R442-C445 PolarHBondContact O-N 3.09Å; R442-Y487 VanDerWaalsContact NH2-CZ 3.33Å; R442-Y487 PolarHBondContact NH2-OH 2.89Å
443	E	66.6	Low	81	Confident	171 Å²	171	47.1 Å²	47.1	80%	0.799	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.4	174.9	-61.7	-173.7	178.9	0	0	113.3	N441 C445	N441-E443 PolarHBondContact O-N 3.01Å; E443-C445 VanDerWaalsContact C-N 3.34Å; E443-C445 PolarHBondContact O-N 3.38Å
444	E	71.6	Confident	81.1	Confident	44 Å²	44	47.1 Å²	47.1	21%	0.206	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-37.9	179.1	-70.2	171.6	-154.9	0	0	111.8	G383 Q384 Y439 N441 R442	G383-E444 CarbonylContact C-O 3.59Å; G383-E444 WeakPolarHBondContact CA-O 3.3Å; Q384-E444 PolarHBondContact N-O 3.45Å; Y439-E444 VanDerWaalsContact OH-CD 3.3Å; Y439-E444 PolarHBondContact OH-OE2 3.29Å; N441-E444 HydrophobicContact CB-CG 4.19Å; N441-E444 VanDerWaalsContact CB-OE1 3.27Å; N441-E444 WeakPolarHBondContact CB-OE1 3.28Å; N441-E444 PolarHBondContact ND2-OE1 2.91Å; N441-E444 PolarHBondContact O-N 2.9Å; R442-E444 PolarHBondContact O-N 2.75Å
445	C	71.8	Confident	81	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.007	27%	0.274	C	S	.	.			trans	-133.1	90.8	-179.9	-179.9	0	0	0	0	109.8	P386 R442 E443 F447 L448 C495	P386-C445 HydrophobicContact CG-CB 3.71Å; R442-C445 CarbonylContact O-C 3.53Å; R442-C445 VanDerWaalsContact O-C 3.26Å; R442-C445 PolarHBondContact O-N 3.09Å; E443-C445 VanDerWaalsContact C-N 3.34Å; E443-C445 PolarHBondContact O-N 3.38Å; C445-F447 PolarHBondContact O-N 3.34Å; C445-F447 VanDerWaalsContact O-N 3.11Å; C445-L448 HydrophobicContact CB-CD1 4.08Å; C445-L448 HydrophobicContact CB-CD2 4.32Å; C445-L448 HydrophobicContact CB-CG 3.83Å; C445-L448 VanDerWaalsContact O-CG 3.32Å; C445-L448 WeakPolarHBondContact O-CG 3.47Å; C445-L448 PolarHBondContact O-N 2.82Å; C445-L448 VanDerWaalsContact SG-CG 3.6Å; C445-C495 VanDerWaalsContact CA-SG 3.53Å; C445-C495 HydrophobicContact CB-CB 3.77Å; C445-C495 WeakPolarHBondContact CB-SG 3.32Å; C445-C495 WeakPolarHBondContact SG-CB 3.26Å; C445-C495 CovalentContact SG-SG 2.01Å; C445-C495 PolarHBondContact SG-SG 2.86Å
446	P	72.5	Confident	80.8	Confident	74 Å²	74	49.1 Å²	49.1	48%	0.481	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-8.8	-178.2	28.3	-35	0	0	0	113.3
447	F	73.6	Confident	80.5	Confident	32 Å²	32	52.7 Å²	52.7	14%	0.14	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	7.5	-178.4	-52	-69	0	0	0	113.6	C57 C445 E449 V489 M494	C57-F447 WeakPolarHBondContact SG-CE2 3.48Å; C57-F447 WeakPolarHBondContact SG-CZ 3.13Å; C445-F447 PolarHBondContact O-N 3.34Å; C445-F447 VanDerWaalsContact O-N 3.11Å; F447-E449 PolarHBondContact O-N 3.41Å; F447-V489 HydrophobicContact CB-CG1 4.25Å; F447-M494 HydrophobicContact CB-SD 3.86Å; F447-M494 HydrophobicContact CD1-SD 4.44Å; F447-M494 HydrophobicContact CG-SD 4.09Å
448	L	82.7	Confident	80.2	Confident	25 Å²	25	55.1 Å²	55.1	13%	0.131	31%	0.311	C	S	.	.			trans	-66.3	120.7	178.6	-71.8	174.7	0	0	0	111.2	P386 V435 Y439 C445 A488 V489 W541	P386-L448 HydrophobicContact CG-CD1 4.46Å; P386-L448 HydrophobicContact CG-CD2 4.34Å; V435-L448 HydrophobicContact CB-CD2 4.37Å; V435-L448 HydrophobicContact CG1-CD1 4.34Å; V435-L448 HydrophobicContact CG2-CD1 4.24Å; V435-L448 HydrophobicContact CG2-CD2 3.76Å; Y439-L448 HydrophobicContact CD1-CD1 4.21Å; Y439-L448 HydrophobicContact CE1-CD1 4.38Å; C445-L448 HydrophobicContact CB-CD1 4.08Å; C445-L448 HydrophobicContact CB-CD2 4.32Å; C445-L448 HydrophobicContact CB-CG 3.83Å; C445-L448 VanDerWaalsContact O-CG 3.32Å; C445-L448 WeakPolarHBondContact O-CG 3.47Å; C445-L448 PolarHBondContact O-N 2.82Å; C445-L448 VanDerWaalsContact SG-CG 3.6Å; L448-A488 WeakPolarHBondContact CA-O 3.44Å; L448-V489 HydrophobicContact CD2-CG1 4.2Å; L448-W541 HydrophobicContact CD2-CH2 3.66Å; L448-W541 HydrophobicContact CD2-CZ2 4.41Å
449	E	85.4	Confident	80.3	Confident	50 Å²	50	54.3 Å²	54.3	23%	0.234	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.6	173.9	-65.6	-172.8	159.5	0	0	110.4	F447 I451 I466 Y487 A488	F447-E449 PolarHBondContact O-N 3.41Å; E449-I451 PolarHBondContact O-N 3.08Å; E449-I466 HydrophobicContact CB-CB 3.81Å; E449-I466 HydrophobicContact CB-CD1 4.25Å; E449-I466 HydrophobicContact CB-CG1 4.46Å; E449-I466 HydrophobicContact CB-CG2 4.31Å; E449-I466 VanDerWaalsContact OE2-CD1 3.24Å; E449-I466 WeakPolarHBondContact OE2-CD1 3.45Å; E449-I466 WeakPolarHBondContact OE2-CG1 3.49Å; E449-Y487 VanDerWaalsContact O-CA 3.28Å; E449-Y487 WeakPolarHBondContact O-CA 3.23Å; E449-A488 PolarHBondContact N-O 3.03Å; E449-A488 PolarHBondContact O-N 3.46Å
450	P	92.7	Very high	80.5	Confident	41 Å²	41	59.8 Å²	59.8	27%	0.266	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	128.5	-178.6	28.4	-33.7	0	0	0	110.9	V452 I466 V484 Y487	P450-V452 PolarHBondContact O-N 3.44Å; P450-I466 WeakPolarHBondContact O-CA 3.44Å; P450-V484 HydrophobicContact CB-CB 4.45Å; P450-V484 HydrophobicContact CB-CG1 3.59Å; P450-V484 HydrophobicContact CB-CG2 3.92Å; P450-Y487 HydrophobicContact CB-CD1 4.13Å; P450-Y487 HydrophobicContact CB-CE1 4.03Å
451	I	93.5	Very high	81.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	109.4	170.2	-52.5	167.3	0	0	0	107.4	I434 E449 Y464 L465 I466 V484 V485 G486 A488 F538	I434-I451 HydrophobicContact CB-CD1 4.25Å; I434-I451 HydrophobicContact CG2-CD1 3.5Å; E449-I451 PolarHBondContact O-N 3.08Å; I451-Y464 HydrophobicContact CG2-CD1 4.49Å; I451-L465 CarbonylContact C-O 3.14Å; I451-I466 HydrophobicContact CB-CG2 4.35Å; I451-I466 HydrophobicContact CG1-CG2 3.82Å; I451-V484 CarbonylContact O-C 3.47Å; I451-V484 VanDerWaalsContact O-CA 3.3Å; I451-V484 WeakPolarHBondContact O-CA 3.35Å; I451-V485 HydrophobicContact CB-CG2 3.82Å; I451-V485 HydrophobicContact CG2-CG2 3.62Å; I451-V485 WeakPolarHBondContact O-CG2 3.47Å; I451-V485 PolarHBondContact O-N 3.38Å; I451-G486 PolarHBondContact N-O 3.19Å; I451-A488 HydrophobicContact CD1-CB 3.73Å; I451-A488 HydrophobicContact CG1-CB 3.77Å; I451-F538 HydrophobicContact CG2-CE1 4.12Å; I451-F538 HydrophobicContact CG2-CZ 4.27Å
452	V	93.1	Very high	82.6	Confident	12 Å²	12	53.6 Å²	53.6	7%	0.073	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125.6	176.6	-179	0	0	0	0	109.6	P450 L454 Y464 L465 I471 N481 V484	P450-V452 PolarHBondContact O-N 3.44Å; V452-L454 HydrophobicContact CG1-CD2 3.72Å; V452-L454 HydrophobicContact CG1-CG 4.24Å; V452-Y464 WeakPolarHBondContact O-CA 3.13Å; V452-L465 PolarHBondContact N-O 3.1Å; V452-L465 PolarHBondContact O-N 3.14Å; V452-I471 HydrophobicContact CB-CD1 3.81Å; V452-I471 HydrophobicContact CB-CG1 4.23Å; V452-I471 HydrophobicContact CG1-CG2 4.22Å; V452-I471 HydrophobicContact CG2-CD1 3.65Å; V452-N481 WeakPolarHBondContact CG1-OD1 3.11Å; V452-V484 HydrophobicContact CG2-CG2 4.33Å
453	H	93	Very high	83.7	Confident	32 Å²	32	47.6 Å²	47.6	15%	0.148	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	117.2	172.4	175.8	-158.8	0	0	0	109.7	N462 Y464 R482 G483 V485	H453-N462 PolarHBondContact CE1-OD1 3.03Å; H453-N462 PolarHBondContact NE2-OD1 2.85Å; H453-Y464 HydrophobicContact CB-CD1 3.91Å; H453-Y464 HydrophobicContact CB-CE1 3.82Å; H453-Y464 AromaticContact CD2-CE1 3.53Å; H453-Y464 AromaticContact CD2-CZ 3.79Å; H453-Y464 AromaticContact CG-CE1 3.59Å; H453-R482 HydrophobicContact CB-CB 4.02Å; H453-R482 WeakPolarHBondContact ND1-CB 3.32Å; H453-R482 WeakPolarHBondContact O-CA 3.5Å; H453-R482 WeakPolarHBondContact O-CB 3.49Å; H453-R482 PolarHBondContact O-N 3.47Å; H453-G483 PolarHBondContact N-O 2.64Å; H453-V485 HydrophobicContact CB-CG1 3.83Å
454	L	91.5	Very high	85	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	142.6	173.7	-57.8	-176.8	0	0	0	110	V452 N462 L463 L465 I471 R474 I475 H479 I480 N481	V452-L454 HydrophobicContact CG1-CD2 3.72Å; V452-L454 HydrophobicContact CG1-CG 4.24Å; L454-N462 WeakPolarHBondContact O-CA 3.5Å; L454-L463 HydrophobicContact CB-CB 4.34Å; L454-L463 PolarHBondContact N-O 3.15Å; L454-L463 PolarHBondContact O-N 3.18Å; L454-L465 HydrophobicContact CD1-CD1 3.99Å; L454-I471 HydrophobicContact CD1-CG2 4.45Å; L454-I471 HydrophobicContact CD2-CG2 4.42Å; L454-R474 HydrophobicContact CD1-CB 3.51Å; L454-R474 HydrophobicContact CD1-CG 4.09Å; L454-I475 HydrophobicContact CD2-CD1 4.43Å; L454-I475 HydrophobicContact CD2-CG1 4.13Å; L454-H479 HydrophobicContact CB-CB 4.16Å; L454-I480 CarbonylContact C-O 3.52Å; L454-I480 WeakPolarHBondContact CA-O 3.41Å; L454-N481 HydrophobicContact CD2-CB 3.89Å
455	Y	90	Very high	85.8	Confident	39 Å²	39	37.7 Å²	37.7	15%	0.153	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126	176.1	-179.1	-103.6	0	0	0	111.1	N457 Q461 N462 H479 I480	Y455-N457 WeakPolarHBondContact CE1-OD1 3.24Å; Y455-Q461 WeakPolarHBondContact CA-O 3.27Å; Y455-Q461 VanDerWaalsContact CD2-O 3.24Å; Y455-Q461 WeakPolarHBondContact CD2-O 3.34Å; Y455-N462 WeakPolarHBondContact CD2-OD1 3.27Å; Y455-H479 CarbonylContact O-C 3.59Å; Y455-H479 WeakPolarHBondContact O-CA 3.25Å; Y455-I480 PolarHBondContact N-O 3.31Å; Y455-I480 PolarHBondContact O-N 3.31Å
456	S	88	Confident	86.4	Confident	4 Å²	4	37.8 Å²	37.8	3%	0.028	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.8	171.5	-175.5	0	0	0	0	110.1	V458 L459 R460 Q461	S456-V458 VanDerWaalsContact C-N 3.27Å; S456-V458 PolarHBondContact OG-N 2.88Å; S456-L459 PolarHBondContact OG-N 2.61Å; S456-R460 WeakPolarHBondContact O-CA 3.01Å; S456-R460 PolarHBondContact O-N 2.82Å; S456-Q461 PolarHBondContact N-O 2.88Å; S456-Q461 PolarHBondContact O-N 3.09Å
457	N	84.2	Confident	86.5	Confident	97 Å²	97	36.3 Å²	36.3	52%	0.519	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-35.4	169.3	-77.8	-21.3	0	0	0	111.8	Y455 I480	Y455-N457 WeakPolarHBondContact CE1-OD1 3.24Å; N457-I480 VanDerWaalsContact ND2-CD1 3.29Å; N457-I480 WeakPolarHBondContact ND2-CD1 3.48Å
458	V	81.3	Confident	86.6	Confident	129 Å²	129	38.6 Å²	38.6	78%	0.782	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-48.4	-177.3	178.8	0	0	0	0	110.4	S456	S456-V458 VanDerWaalsContact C-N 3.27Å; S456-V458 PolarHBondContact OG-N 2.88Å
459	L	80.2	Confident	85.9	Confident	58 Å²	58	40.7 Å²	40.7	30%	0.304	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-10.6	-178	-57.7	173.6	0	0	0	112.4	S456 Q461 N510	S456-L459 PolarHBondContact OG-N 2.61Å; L459-Q461 HydrophobicContact CB-CB 4.37Å; L459-Q461 HydrophobicContact CB-CG 3.81Å; L459-Q461 PolarHBondContact O-N 3.34Å; L459-N510 VanDerWaalsContact O-CG 3.24Å; L459-N510 PolarHBondContact O-ND2 2.87Å; L459-N510 PolarHBondContact O-OD1 2.75Å
460	R	82.9	Confident	85.2	Confident	141 Å²	141	39.5 Å²	39.5	53%	0.532	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	41.9	-173.9	-56.5	-176.8	178.6	-178.5	-1.5	112.8	L400 S456	L400-R460 HydrophobicContact CD2-CB 4.21Å; S456-R460 WeakPolarHBondContact O-CA 3.01Å; S456-R460 PolarHBondContact O-N 2.82Å
461	Q	85.9	Confident	84.5	Confident	15 Å²	15	38.3 Å²	38.3	7%	0.07	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.1	-173.5	75.7	-177.9	-4	0	0	111.8	Y455 S456 L459 N510	Y455-Q461 WeakPolarHBondContact CA-O 3.27Å; Y455-Q461 VanDerWaalsContact CD2-O 3.24Å; Y455-Q461 WeakPolarHBondContact CD2-O 3.34Å; S456-Q461 PolarHBondContact N-O 2.88Å; S456-Q461 PolarHBondContact O-N 3.09Å; L459-Q461 HydrophobicContact CB-CB 4.37Å; L459-Q461 HydrophobicContact CB-CG 3.81Å; L459-Q461 PolarHBondContact O-N 3.34Å; Q461-N510 HydrophobicContact CB-CB 4.4Å
462	N	88.3	Confident	83.8	Confident	24 Å²	24	41.4 Å²	41.4	13%	0.128	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	139.4	169.1	-58.2	-76.8	0	0	0	109.4	H453 L454 Y455 Y464	H453-N462 PolarHBondContact CE1-OD1 3.03Å; H453-N462 PolarHBondContact NE2-OD1 2.85Å; L454-N462 WeakPolarHBondContact O-CA 3.5Å; Y455-N462 WeakPolarHBondContact CD2-OD1 3.27Å; N462-Y464 HydrophobicContact CB-CE2 3.75Å
463	L	89.1	Confident	82.7	Confident	11 Å²	11	43.2 Å²	43.2	6%	0.058	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129	176.8	-178	66.2	0	0	0	108.8	L454 L465 R474	L454-L463 HydrophobicContact CB-CB 4.34Å; L454-L463 PolarHBondContact N-O 3.15Å; L454-L463 PolarHBondContact O-N 3.18Å; L463-L465 HydrophobicContact CD1-CD2 4.14Å; L463-L465 HydrophobicContact CD1-CG 4.47Å; L463-L465 HydrophobicContact CD2-CD1 3.74Å; L463-L465 HydrophobicContact CD2-CD2 4.33Å; L463-L465 HydrophobicContact CD2-CG 4.06Å; L463-L465 HydrophobicContact CG-CD1 4.14Å; L463-L465 HydrophobicContact CG-CD2 4.1Å; L463-L465 HydrophobicContact CG-CG 3.89Å; L463-R474 HydrophobicContact CD2-CG 3.95Å
464	Y	93.1	Very high	82	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.9	-180	-55.5	-91.7	0	0	0	108.5	L405 F407 I451 V452 H453 N462 V485 Q513 F538	L405-Y464 HydrophobicContact CB-CD1 4.44Å; L405-Y464 HydrophobicContact CB-CD2 4.01Å; L405-Y464 HydrophobicContact CB-CE1 4.06Å; L405-Y464 HydrophobicContact CB-CE2 3.63Å; L405-Y464 HydrophobicContact CB-CG 4.42Å; L405-Y464 HydrophobicContact CD1-CD2 3.63Å; L405-Y464 HydrophobicContact CD1-CE2 4.1Å; L405-Y464 HydrophobicContact CD1-CG 3.89Å; L405-Y464 HydrophobicContact CG-CD2 3.77Å; L405-Y464 HydrophobicContact CG-CE2 3.71Å; L405-Y464 HydrophobicContact CG-CG 4.39Å; L405-Y464 PolarHBondContact N-OH 2.65Å; L405-Y464 PolarHBondContact O-OH 3.14Å; F407-Y464 HydrophobicContact CE2-CD1 4.14Å; F407-Y464 AromaticContact CE2-CE1 3.71Å; F407-Y464 HydrophobicContact CE2-CE1 3.71Å; F407-Y464 AromaticContact CZ-CD1 3.92Å; F407-Y464 HydrophobicContact CZ-CD1 3.92Å; F407-Y464 AromaticContact CZ-CE1 3.94Å; F407-Y464 HydrophobicContact CZ-CE1 3.94Å; I451-Y464 HydrophobicContact CG2-CD1 4.49Å; V452-Y464 WeakPolarHBondContact O-CA 3.13Å; H453-Y464 HydrophobicContact CB-CD1 3.91Å; H453-Y464 HydrophobicContact CB-CE1 3.82Å; H453-Y464 AromaticContact CD2-CE1 3.53Å; H453-Y464 AromaticContact CD2-CZ 3.79Å; H453-Y464 AromaticContact CG-CE1 3.59Å; N462-Y464 HydrophobicContact CB-CE2 3.75Å; Y464-V485 HydrophobicContact CD1-CG2 4.18Å; Y464-Q513 PolarHBondContact O-NE2 2.8Å; Y464-F538 WeakPolarHBondContact O-CE1 3.27Å
465	L	89.1	Confident	81.7	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	151.6	-174.5	-61.3	176.8	0	0	0	111.2	I451 V452 L454 L463 E470 I471 R474	I451-L465 CarbonylContact C-O 3.14Å; V452-L465 PolarHBondContact N-O 3.1Å; V452-L465 PolarHBondContact O-N 3.14Å; L454-L465 HydrophobicContact CD1-CD1 3.99Å; L463-L465 HydrophobicContact CD1-CD2 4.14Å; L463-L465 HydrophobicContact CD1-CG 4.47Å; L463-L465 HydrophobicContact CD2-CD1 3.74Å; L463-L465 HydrophobicContact CD2-CD2 4.33Å; L463-L465 HydrophobicContact CD2-CG 4.06Å; L463-L465 HydrophobicContact CG-CD1 4.14Å; L463-L465 HydrophobicContact CG-CD2 4.1Å; L463-L465 HydrophobicContact CG-CG 3.89Å; L465-E470 HydrophobicContact CD1-CB 4.22Å; L465-E470 HydrophobicContact CD1-CG 3.73Å; L465-I471 HydrophobicContact CB-CD1 4.17Å; L465-I471 HydrophobicContact CB-CG1 3.65Å; L465-I471 HydrophobicContact CD1-CG1 4.15Å; L465-R474 HydrophobicContact CD1-CG 3.95Å
466	I	84	Confident	81.1	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	26%	0.257	C	S	.	.			trans	-110.5	-24.7	169.3	63	174.1	0	0	0	112.6	E449 P450 I451 K468 A488 F538	E449-I466 HydrophobicContact CB-CB 3.81Å; E449-I466 HydrophobicContact CB-CD1 4.25Å; E449-I466 HydrophobicContact CB-CG1 4.46Å; E449-I466 HydrophobicContact CB-CG2 4.31Å; E449-I466 VanDerWaalsContact OE2-CD1 3.24Å; E449-I466 WeakPolarHBondContact OE2-CD1 3.45Å; E449-I466 WeakPolarHBondContact OE2-CG1 3.49Å; P450-I466 WeakPolarHBondContact O-CA 3.44Å; I451-I466 HydrophobicContact CB-CG2 4.35Å; I451-I466 HydrophobicContact CG1-CG2 3.82Å; I466-K468 PolarHBondContact O-N 3.28Å; I466-A488 HydrophobicContact CG2-CB 4.34Å; I466-F538 HydrophobicContact CD1-CB 3.43Å; I466-F538 VanDerWaalsContact CD1-CB 3.43Å; I466-F538 HydrophobicContact CG1-CB 3.92Å; I466-F538 HydrophobicContact CG2-CB 4.1Å; I466-F538 HydrophobicContact CG2-CD1 4.01Å; I466-F538 HydrophobicContact CG2-CG 4.25Å
467	N	75.5	Confident	80.5	Confident	43 Å²	43	57.5 Å²	57.5	23%	0.23	28%	0.28	C	S	.	.			trans	-72.2	114.4	-176.4	-175.3	-77.1	0	0	0	111.2	Y178 L469 E470 I471	Y178-N467 WeakPolarHBondContact CE1-ND2 3.28Å; Y178-N467 PolarHBondContact OH-ND2 3.28Å; N467-L469 PolarHBondContact O-N 2.9Å; N467-L469 PolarHBondContact OD1-N 3.09Å; N467-E470 HydrophobicContact CB-CB 4.16Å; N467-E470 PolarHBondContact O-N 2.89Å; N467-E470 PolarHBondContact OD1-N 2.84Å; N467-I471 WeakPolarHBondContact O-CD1 3.47Å; N467-I471 VanDerWaalsContact O-CG1 3.25Å; N467-I471 WeakPolarHBondContact O-CG1 3.15Å; N467-I471 PolarHBondContact O-N 2.99Å
468	K	76.1	Confident	80.5	Confident	79 Å²	79	55.2 Å²	55.2	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-56.5	-47	-176.9	-66	-176.2	176.8	-173.7	0	113.4	L47 V49 I466 E470 I471 E472	L47-K468 HydrophobicContact CD2-CD 3.99Å; V49-K468 HydrophobicContact CG2-CD 4.42Å; V49-K468 VanDerWaalsContact CG2-NZ 3.32Å; I466-K468 PolarHBondContact O-N 3.28Å; K468-E470 VanDerWaalsContact C-N 3.33Å; K468-E470 PolarHBondContact O-N 2.82Å; K468-I471 WeakPolarHBondContact O-CB 3.22Å; K468-I471 PolarHBondContact O-N 3.39Å; K468-E472 WeakPolarHBondContact O-CG 3.4Å; K468-E472 PolarHBondContact O-N 2.88Å
469	L	66.8	Low	80.9	Confident	70 Å²	70	49.6 Å²	49.6	37%	0.366	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-43.7	-179.9	177.4	62.4	0	0	0	111.1	Y178 N467 E472 I473	Y178-L469 HydrophobicContact CE2-CD2 4.14Å; N467-L469 PolarHBondContact O-N 2.9Å; N467-L469 PolarHBondContact OD1-N 3.09Å; L469-E472 PolarHBondContact O-N 3.26Å; L469-I473 HydrophobicContact CD1-CD1 4.14Å; L469-I473 HydrophobicContact CG-CD1 4.04Å; L469-I473 VanDerWaalsContact O-CG1 3.29Å; L469-I473 WeakPolarHBondContact O-CG1 3.05Å; L469-I473 PolarHBondContact O-N 3.22Å; L469-I473 VanDerWaalsContact O-N 3.08Å
470	E	70.4	Confident	81.5	Confident	25 Å²	25	50 Å²	50	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-43.9	176.7	-168.7	175.1	179.8	0	0	111.5	L465 N467 K468 E472 I473 R474 R503	L465-E470 HydrophobicContact CD1-CB 4.22Å; L465-E470 HydrophobicContact CD1-CG 3.73Å; N467-E470 HydrophobicContact CB-CB 4.16Å; N467-E470 PolarHBondContact O-N 2.89Å; N467-E470 PolarHBondContact OD1-N 2.84Å; K468-E470 VanDerWaalsContact C-N 3.33Å; K468-E470 PolarHBondContact O-N 2.82Å; E470-E472 VanDerWaalsContact C-N 3.3Å; E470-E472 PolarHBondContact O-N 2.98Å; E470-I473 PolarHBondContact O-N 2.97Å; E470-R474 HydrophobicContact CG-CG 4.22Å; E470-R474 VanDerWaalsContact O-CG 3.3Å; E470-R474 WeakPolarHBondContact O-CG 3.43Å; E470-R474 PolarHBondContact O-N 3.31Å; E470-R474 IonicContact OE1-CZ 3.81Å; E470-R474 IonicContact OE1-NE 3.2Å; E470-R474 PolarHBondContact OE1-NE 3.32Å; E470-R474 IonicContact OE1-NH2 2.88Å; E470-R474 PolarHBondContact OE1-NH2 3Å; E470-R503 VanDerWaalsContact CD-NH2 3.26Å; E470-R503 IonicContact OE1-CZ 3.81Å; E470-R503 IonicContact OE1-NH1 3.94Å; E470-R503 PolarHBondContact OE1-NH1 3.05Å; E470-R503 IonicContact OE1-NH2 3.49Å; E470-R503 PolarHBondContact OE1-NH2 3.12Å; E470-R503 IonicContact OE2-CZ 3.42Å; E470-R503 IonicContact OE2-NH1 2.95Å; E470-R503 IonicContact OE2-NH2 2.72Å; E470-R503 PolarHBondContact OE2-NH2 3.17Å
471	I	79.4	Confident	81.9	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.082	24%	0.242	C	C	.	.	H	α-helix	trans	-55.2	-47.4	176.9	-70	157.9	0	0	0	110.8	V452 L454 L465 N467 K468 R474 I475	V452-I471 HydrophobicContact CB-CD1 3.81Å; V452-I471 HydrophobicContact CB-CG1 4.23Å; V452-I471 HydrophobicContact CG1-CG2 4.22Å; V452-I471 HydrophobicContact CG2-CD1 3.65Å; L454-I471 HydrophobicContact CD1-CG2 4.45Å; L454-I471 HydrophobicContact CD2-CG2 4.42Å; L465-I471 HydrophobicContact CB-CD1 4.17Å; L465-I471 HydrophobicContact CB-CG1 3.65Å; L465-I471 HydrophobicContact CD1-CG1 4.15Å; N467-I471 WeakPolarHBondContact O-CD1 3.47Å; N467-I471 VanDerWaalsContact O-CG1 3.25Å; N467-I471 WeakPolarHBondContact O-CG1 3.15Å; N467-I471 PolarHBondContact O-N 2.99Å; K468-I471 WeakPolarHBondContact O-CB 3.22Å; K468-I471 PolarHBondContact O-N 3.39Å; I471-R474 PolarHBondContact O-N 2.97Å; I471-I475 HydrophobicContact CG2-CD1 3.81Å; I471-I475 VanDerWaalsContact O-CG1 3.31Å; I471-I475 WeakPolarHBondContact O-CG1 3.36Å; I471-I475 PolarHBondContact O-N 3.4Å
472	E	77.1	Confident	82.2	Confident	64 Å²	64	53.8 Å²	53.8	30%	0.299	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-47	178.1	-73	168.9	-163.5	0	0	111.9	K468 L469 E470 R474 I475 Q476	K468-E472 WeakPolarHBondContact O-CG 3.4Å; K468-E472 PolarHBondContact O-N 2.88Å; L469-E472 PolarHBondContact O-N 3.26Å; E470-E472 VanDerWaalsContact C-N 3.3Å; E470-E472 PolarHBondContact O-N 2.98Å; E472-R474 PolarHBondContact O-N 2.81Å; E472-I475 PolarHBondContact O-N 3.38Å; E472-Q476 WeakPolarHBondContact O-CG 3.39Å; E472-Q476 PolarHBondContact O-N 2.92Å
473	I	70.8	Confident	82.4	Confident	50 Å²	50	54 Å²	54	26%	0.256	27%	0.274	S	S	.	.	H	α-helix	trans	-60.2	-44.7	176.8	-67.9	166.5	0	0	0	110.7	L469 E470 I475 Q476 E477	L469-I473 HydrophobicContact CD1-CD1 4.14Å; L469-I473 HydrophobicContact CG-CD1 4.04Å; L469-I473 VanDerWaalsContact O-CG1 3.29Å; L469-I473 WeakPolarHBondContact O-CG1 3.05Å; L469-I473 PolarHBondContact O-N 3.22Å; L469-I473 VanDerWaalsContact O-N 3.08Å; E470-I473 PolarHBondContact O-N 2.97Å; I473-I475 VanDerWaalsContact C-N 3.33Å; I473-I475 PolarHBondContact O-N 3.26Å; I473-Q476 WeakPolarHBondContact O-CB 3.12Å; I473-Q476 PolarHBondContact O-N 3.4Å; I473-Q476 VanDerWaalsContact O-N 3.16Å; I473-E477 HydrophobicContact CG2-CG 4.48Å; I473-E477 WeakPolarHBondContact O-CG 3.42Å; I473-E477 PolarHBondContact O-N 3.02Å
474	R	78.3	Confident	82.5	Confident	43 Å²	43	56 Å²	56	16%	0.162	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-36.4	180	-64.8	-43.7	-179.5	167.2	2.5	112.7	L454 L463 L465 E470 I471 E472 Q476 E477 G478 H479	L454-R474 HydrophobicContact CD1-CB 3.51Å; L454-R474 HydrophobicContact CD1-CG 4.09Å; L463-R474 HydrophobicContact CD2-CG 3.95Å; L465-R474 HydrophobicContact CD1-CG 3.95Å; E470-R474 HydrophobicContact CG-CG 4.22Å; E470-R474 VanDerWaalsContact O-CG 3.3Å; E470-R474 WeakPolarHBondContact O-CG 3.43Å; E470-R474 PolarHBondContact O-N 3.31Å; E470-R474 IonicContact OE1-CZ 3.81Å; E470-R474 IonicContact OE1-NE 3.2Å; E470-R474 PolarHBondContact OE1-NE 3.32Å; E470-R474 IonicContact OE1-NH2 2.88Å; E470-R474 PolarHBondContact OE1-NH2 3Å; I471-R474 PolarHBondContact O-N 2.97Å; E472-R474 PolarHBondContact O-N 2.81Å; R474-Q476 VanDerWaalsContact C-N 3.34Å; R474-E477 WeakPolarHBondContact CD-OE2 3.24Å; R474-E477 IonicContact CZ-OE2 2.61Å; R474-E477 IonicContact NE-OE2 2.81Å; R474-E477 IonicContact NH1-OE1 3.36Å; R474-E477 IonicContact NH1-OE2 3.11Å; R474-E477 PolarHBondContact NH1-OE2 3Å; R474-E477 WeakPolarHBondContact O-CB 3.5Å; R474-E477 PolarHBondContact O-N 3.11Å; R474-G478 PolarHBondContact O-N 2.76Å; R474-H479 HydrophobicContact CB-CB 4.3Å; R474-H479 WeakPolarHBondContact O-CB 3.27Å; R474-H479 PolarHBondContact O-N 3.08Å; R474-H479 PolarHBondContact O-ND1 3.24Å
475	I	84.4	Confident	82.5	Confident	73 Å²	73	56.3 Å²	56.3	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-64.4	-42.3	174	-68.7	167	0	0	0	110.1	L454 I471 E472 I473 E477 G478 N481	L454-I475 HydrophobicContact CD2-CD1 4.43Å; L454-I475 HydrophobicContact CD2-CG1 4.13Å; I471-I475 HydrophobicContact CG2-CD1 3.81Å; I471-I475 VanDerWaalsContact O-CG1 3.31Å; I471-I475 WeakPolarHBondContact O-CG1 3.36Å; I471-I475 PolarHBondContact O-N 3.4Å; E472-I475 PolarHBondContact O-N 3.38Å; I473-I475 VanDerWaalsContact C-N 3.33Å; I473-I475 PolarHBondContact O-N 3.26Å; I475-E477 VanDerWaalsContact C-N 3.28Å; I475-E477 PolarHBondContact O-N 3.2Å; I475-G478 PolarHBondContact O-N 2.83Å; I475-N481 HydrophobicContact CD1-CB 4.15Å; I475-N481 HydrophobicContact CG1-CB 4.48Å
476	Q	78.1	Confident	82.6	Confident	150 Å²	150	56.2 Å²	56.2	70%	0.701	29%	0.289	S	S	*	.	H	α-helix	trans	-63	-33.2	173.9	-67.8	172.4	9	0	0	112.6	E472 I473 R474 G478	E472-Q476 WeakPolarHBondContact O-CG 3.39Å; E472-Q476 PolarHBondContact O-N 2.92Å; I473-Q476 WeakPolarHBondContact O-CB 3.12Å; I473-Q476 PolarHBondContact O-N 3.4Å; I473-Q476 VanDerWaalsContact O-N 3.16Å; R474-Q476 VanDerWaalsContact C-N 3.34Å; Q476-G478 PolarHBondContact O-N 2.58Å
477	E	76.4	Confident	83	Confident	109 Å²	109	57.5 Å²	57.5	51%	0.509	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-0.4	171.7	-68.4	175.6	168.6	0	0	113.6	I473 R474 I475 H479	I473-E477 HydrophobicContact CG2-CG 4.48Å; I473-E477 WeakPolarHBondContact O-CG 3.42Å; I473-E477 PolarHBondContact O-N 3.02Å; R474-E477 WeakPolarHBondContact CD-OE2 3.24Å; R474-E477 IonicContact CZ-OE2 2.61Å; R474-E477 IonicContact NE-OE2 2.81Å; R474-E477 IonicContact NH1-OE1 3.36Å; R474-E477 IonicContact NH1-OE2 3.11Å; R474-E477 PolarHBondContact NH1-OE2 3Å; R474-E477 WeakPolarHBondContact O-CB 3.5Å; R474-E477 PolarHBondContact O-N 3.11Å; I475-E477 VanDerWaalsContact C-N 3.28Å; I475-E477 PolarHBondContact O-N 3.2Å; E477-H479 IonicContact OE2-CE1 3.98Å
478	G	83.9	Confident	83.7	Confident	49 Å²	49	55.4 Å²	55.4	51%	0.505	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	15.5	177.4	0	0	0	0	0	115	R474 I475 Q476	R474-G478 PolarHBondContact O-N 2.76Å; I475-G478 PolarHBondContact O-N 2.83Å; Q476-G478 PolarHBondContact O-N 2.58Å
479	H	88.6	Confident	83.8	Confident	11 Å²	11	51.7 Å²	51.7	5%	0.051	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	138.9	169	-64.2	69.9	0	0	0	110.6	L454 Y455 R474 E477	L454-H479 HydrophobicContact CB-CB 4.16Å; Y455-H479 CarbonylContact O-C 3.59Å; Y455-H479 WeakPolarHBondContact O-CA 3.25Å; R474-H479 HydrophobicContact CB-CB 4.3Å; R474-H479 WeakPolarHBondContact O-CB 3.27Å; R474-H479 PolarHBondContact O-N 3.08Å; R474-H479 PolarHBondContact O-ND1 3.24Å; E477-H479 IonicContact OE2-CE1 3.98Å
480	I	92.6	Very high	84.1	Confident	68 Å²	68	49.7 Å²	49.7	35%	0.349	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.4	175.6	-60.9	174.3	0	0	0	108.6	L454 Y455 N457 R482	L454-I480 CarbonylContact C-O 3.52Å; L454-I480 WeakPolarHBondContact CA-O 3.41Å; Y455-I480 PolarHBondContact N-O 3.31Å; Y455-I480 PolarHBondContact O-N 3.31Å; N457-I480 VanDerWaalsContact ND2-CD1 3.29Å; N457-I480 WeakPolarHBondContact ND2-CD1 3.48Å; I480-R482 PolarHBondContact O-N 3.04Å
481	N	92.7	Very high	83.7	Confident	82 Å²	82	48.5 Å²	48.5	44%	0.439	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	117.9	170.2	-172.6	-13.5	0	0	0	110.5	V452 L454 I475 G483	V452-N481 WeakPolarHBondContact CG1-OD1 3.11Å; L454-N481 HydrophobicContact CD2-CB 3.89Å; I475-N481 HydrophobicContact CD1-CB 4.15Å; I475-N481 HydrophobicContact CG1-CB 4.48Å; N481-G483 WeakPolarHBondContact OD1-CA 3.48Å; N481-G483 PolarHBondContact OD1-N 2.88Å
482	R	91.8	Very high	82.9	Confident	152 Å²	152	52.3 Å²	52.3	57%	0.574	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	-0.1	179.1	-67	-80.6	-175.2	171.2	-0.6	112.9	H453 I480	H453-R482 HydrophobicContact CB-CB 4.02Å; H453-R482 WeakPolarHBondContact ND1-CB 3.32Å; H453-R482 WeakPolarHBondContact O-CA 3.5Å; H453-R482 WeakPolarHBondContact O-CB 3.49Å; H453-R482 PolarHBondContact O-N 3.47Å; I480-R482 PolarHBondContact O-N 3.04Å
483	G	91.5	Very high	82.2	Confident	28 Å²	28	50.4 Å²	50.4	29%	0.289	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	103.9	180	177.8	0	0	0	0	0	113.8	H453 N481	H453-G483 PolarHBondContact N-O 2.64Å; N481-G483 WeakPolarHBondContact OD1-CA 3.48Å; N481-G483 PolarHBondContact OD1-N 2.88Å
484	V	92.1	Very high	82.1	Confident	55 Å²	55	48 Å²	48	33%	0.333	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.4	177.1	-177	0	0	0	0	109.2	L437 P450 I451 V452 G486	L437-V484 HydrophobicContact CD2-CB 4.19Å; L437-V484 HydrophobicContact CD2-CG1 3.79Å; P450-V484 HydrophobicContact CB-CB 4.45Å; P450-V484 HydrophobicContact CB-CG1 3.59Å; P450-V484 HydrophobicContact CB-CG2 3.92Å; I451-V484 CarbonylContact O-C 3.47Å; I451-V484 VanDerWaalsContact O-CA 3.3Å; I451-V484 WeakPolarHBondContact O-CA 3.35Å; V452-V484 HydrophobicContact CG2-CG2 4.33Å; V484-G486 WeakPolarHBondContact CG1-O 3.37Å
485	V	91.9	Very high	82	Confident	10 Å²	10	46 Å²	46	6%	0.061	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-7.9	-178.7	-65.7	0	0	0	0	114	F407 I410 I434 I451 H453 Y464	F407-V485 HydrophobicContact CD1-CG2 4.45Å; F407-V485 HydrophobicContact CD2-CB 3.67Å; F407-V485 HydrophobicContact CD2-CG1 4.1Å; F407-V485 HydrophobicContact CD2-CG2 4.06Å; F407-V485 HydrophobicContact CE1-CB 4.37Å; F407-V485 HydrophobicContact CE1-CG2 3.85Å; F407-V485 HydrophobicContact CE2-CB 3.52Å; F407-V485 HydrophobicContact CE2-CG1 3.86Å; F407-V485 HydrophobicContact CE2-CG2 3.43Å; F407-V485 VanDerWaalsContact CE2-CG2 3.43Å; F407-V485 HydrophobicContact CG-CB 4.19Å; F407-V485 HydrophobicContact CZ-CB 3.9Å; F407-V485 HydrophobicContact CZ-CG2 3.3Å; I410-V485 VanDerWaalsContact CD1-CA 3.45Å; I410-V485 HydrophobicContact CD1-CB 3.9Å; I410-V485 HydrophobicContact CD1-CG1 4.19Å; I410-V485 VanDerWaalsContact CD1-O 3.23Å; I410-V485 WeakPolarHBondContact CD1-O 3.49Å; I434-V485 WeakPolarHBondContact CD1-O 3.3Å; I451-V485 HydrophobicContact CB-CG2 3.82Å; I451-V485 HydrophobicContact CG2-CG2 3.62Å; I451-V485 WeakPolarHBondContact O-CG2 3.47Å; I451-V485 PolarHBondContact O-N 3.38Å; H453-V485 HydrophobicContact CB-CG1 3.83Å; Y464-V485 HydrophobicContact CD1-CG2 4.18Å
486	G	92	Very high	81.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.9	-164	-178.7	0	0	0	0	0	110.9	V435 I451 V484	V435-G486 CarbonylContact O-C 3.55Å; V435-G486 VanDerWaalsContact O-CA 3.29Å; V435-G486 WeakPolarHBondContact O-CA 3.38Å; I451-G486 PolarHBondContact N-O 3.19Å; V484-G486 WeakPolarHBondContact CG1-O 3.37Å
487	Y	91.9	Very high	80.8	Confident	30 Å²	30	39.6 Å²	39.6	12%	0.118	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146	176.1	-48.8	-99.6	0	0	0	111.8	V435 L437 R442 E449 P450	V435-Y487 HydrophobicContact CB-CD2 4.45Å; V435-Y487 HydrophobicContact CG1-CD2 4.17Å; V435-Y487 PolarHBondContact N-O 3.44Å; V435-Y487 PolarHBondContact O-N 2.84Å; L437-Y487 HydrophobicContact CD2-CE2 4.28Å; R442-Y487 VanDerWaalsContact NH2-CZ 3.33Å; R442-Y487 PolarHBondContact NH2-OH 2.89Å; E449-Y487 VanDerWaalsContact O-CA 3.28Å; E449-Y487 WeakPolarHBondContact O-CA 3.23Å; P450-Y487 HydrophobicContact CB-CD1 4.13Å; P450-Y487 HydrophobicContact CB-CE1 4.03Å
488	A	90.4	Very high	80.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	-174.9	175.6	0	0	0	0	0	109.1	L448 E449 I451 I466 F538 Y539 L540	L448-A488 WeakPolarHBondContact CA-O 3.44Å; E449-A488 PolarHBondContact N-O 3.03Å; E449-A488 PolarHBondContact O-N 3.46Å; I451-A488 HydrophobicContact CD1-CB 3.73Å; I451-A488 HydrophobicContact CG1-CB 3.77Å; I466-A488 HydrophobicContact CG2-CB 4.34Å; A488-F538 HydrophobicContact CB-CB 4.11Å; A488-F538 HydrophobicContact CB-CD2 3.92Å; A488-F538 HydrophobicContact CB-CG 4.15Å; A488-Y539 WeakPolarHBondContact CB-O 3.41Å; A488-L540 HydrophobicContact CB-CD2 4.2Å
489	V	77.9	Confident	79.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-123.7	154.5	177.3	-59.2	0	0	0	0	110.9	F447 L448 M494 A497 Y539 W541	F447-V489 HydrophobicContact CB-CG1 4.25Å; L448-V489 HydrophobicContact CD2-CG1 4.2Å; V489-M494 HydrophobicContact CB-CB 3.9Å; V489-M494 HydrophobicContact CB-SD 4.21Å; V489-M494 HydrophobicContact CG1-CB 4.28Å; V489-M494 HydrophobicContact CG2-CB 3.79Å; V489-A497 HydrophobicContact CG2-CB 3.3Å; V489-Y539 PolarHBondContact N-O 3.36Å; V489-Y539 PolarHBondContact O-N 3.48Å; V489-W541 HydrophobicContact CG1-CH2 4.05Å; V489-W541 HydrophobicContact CG1-CZ2 4.15Å
490	S	73.8	Confident	79.1	Confident	29 Å²	29	36.1 Å²	36.1	20%	0.203	19%	0.19	C	C	.	.	S	Bend	trans	-83.3	-17.4	-176.5	61.2	0	0	0	0	114.3	Y539	S490-Y539 WeakPolarHBondContact O-CD2 2.9Å; S490-Y539 VanDerWaalsContact O-CE2 3.31Å; S490-Y539 WeakPolarHBondContact O-CE2 3.26Å
491	G	61.5	Low	78.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-121.2	146.9	-173.5	0	0	0	0	0	114.8	M494	G491-M494 PolarHBondContact N-SD 3.11Å; G491-M494 WeakPolarHBondContact O-CB 3.11Å; G491-M494 PolarHBondContact O-N 2.77Å
492	Y	62.8	Low	77.9	Confident	96 Å²	96	30.1 Å²	30.1	38%	0.376	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	136.6	168.3	-178.9	-99.9	0	0	0	110.8	T166 M494 T498 Y539	T166-Y492 WeakPolarHBondContact OG1-CB 3.37Å; T166-Y492 PolarHBondContact OG1-N 2.81Å; Y492-M494 PolarHBondContact O-N 3.49Å; Y492-M494 VanDerWaalsContact O-N 3.1Å; Y492-T498 HydrophobicContact CE2-CG2 4.14Å; Y492-Y539 HydrophobicContact CD2-CD1 4.15Å; Y492-Y539 AromaticContact CD2-CE1 3.86Å; Y492-Y539 HydrophobicContact CD2-CE1 3.86Å; Y492-Y539 HydrophobicContact CG-CE1 4.2Å; Y492-Y539 VanDerWaalsContact N-CE2 3.29Å
493	A	62.8	Low	77.5	Confident	24 Å²	24	23.7 Å²	23.7	20%	0.198	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	2.1	-178.7	0	0	0	0	0	116.1	Y123 C495 N496 A497	Y123-A493 HydrophobicContact CE1-CB 4.42Å; A493-C495 PolarHBondContact O-N 2.77Å; A493-N496 PolarHBondContact O-N 3.46Å; A493-A497 VanDerWaalsContact CA-O 3.3Å; A493-A497 WeakPolarHBondContact CA-O 3.43Å; A493-A497 PolarHBondContact N-O 3.29Å
494	M	69.9	Low	76.9	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-61.6	123.8	167	-72.1	-177.4	176.8	0	0	108.7	H168 I170 F447 V489 G491 Y492 N496 A497	H168-M494 WeakPolarHBondContact O-CE 3.46Å; I170-M494 HydrophobicContact CD1-CE 3.7Å; I170-M494 HydrophobicContact CD1-CG 4.05Å; I170-M494 HydrophobicContact CG1-CE 3.38Å; I170-M494 HydrophobicContact CG1-CG 4.31Å; F447-M494 HydrophobicContact CB-SD 3.86Å; F447-M494 HydrophobicContact CD1-SD 4.44Å; F447-M494 HydrophobicContact CG-SD 4.09Å; V489-M494 HydrophobicContact CB-CB 3.9Å; V489-M494 HydrophobicContact CB-SD 4.21Å; V489-M494 HydrophobicContact CG1-CB 4.28Å; V489-M494 HydrophobicContact CG2-CB 3.79Å; G491-M494 PolarHBondContact N-SD 3.11Å; G491-M494 WeakPolarHBondContact O-CB 3.11Å; G491-M494 PolarHBondContact O-N 2.77Å; Y492-M494 PolarHBondContact O-N 3.49Å; Y492-M494 VanDerWaalsContact O-N 3.1Å; M494-N496 PolarHBondContact O-N 3.02Å; M494-N496 VanDerWaalsContact O-N 3.11Å; M494-A497 WeakPolarHBondContact O-CB 3.43Å; M494-A497 PolarHBondContact O-N 2.79Å
495	C	75.3	Confident	76.2	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	52.9	33.1	-177.6	-44.8	0	0	0	0	112.9	C382 Q384 Q385 C445 A493 A497 W541	C382-C495 PolarHBondContact O-N 3.39Å; Q384-C495 WeakPolarHBondContact O-CB 3.39Å; Q385-C495 VanDerWaalsContact CA-O 3.27Å; Q385-C495 WeakPolarHBondContact CA-O 3.17Å; C445-C495 VanDerWaalsContact CA-SG 3.53Å; C445-C495 HydrophobicContact CB-CB 3.77Å; C445-C495 WeakPolarHBondContact CB-SG 3.32Å; C445-C495 WeakPolarHBondContact SG-CB 3.26Å; C445-C495 CovalentContact SG-SG 2.01Å; C445-C495 PolarHBondContact SG-SG 2.86Å; A493-C495 PolarHBondContact O-N 2.77Å; C495-A497 PolarHBondContact O-N 3.12Å; C495-W541 HydrophobicContact CB-CZ2 4.04Å; C495-W541 PolarHBondContact O-NE1 3.02Å
496	N	69.7	Low	75.4	Confident	88 Å²	88	22.4 Å²	22.4	47%	0.471	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	60.8	17.7	-173.1	-58.3	-22.3	0	0	0	116.3	Q385 A493 M494 T498	Q385-N496 HydrophobicContact CB-CB 4.15Å; A493-N496 PolarHBondContact O-N 3.46Å; M494-N496 PolarHBondContact O-N 3.02Å; M494-N496 VanDerWaalsContact O-N 3.11Å; N496-T498 PolarHBondContact O-N 3.06Å
497	A	68.1	Low	74.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.			trans	-71.2	123.6	171.3	0	0	0	0	0	110.2	V489 A493 M494 C495 L540 W541	V489-A497 HydrophobicContact CG2-CB 3.3Å; A493-A497 VanDerWaalsContact CA-O 3.3Å; A493-A497 WeakPolarHBondContact CA-O 3.43Å; A493-A497 PolarHBondContact N-O 3.29Å; M494-A497 WeakPolarHBondContact O-CB 3.43Å; M494-A497 PolarHBondContact O-N 2.79Å; C495-A497 PolarHBondContact O-N 3.12Å; A497-L540 CarbonylContact C-O 3.53Å; A497-L540 WeakPolarHBondContact CA-O 2.98Å; A497-W541 HydrophobicContact CB-CD2 4.28Å; A497-W541 HydrophobicContact CB-CZ2 4.19Å
498	T	67.2	Low	73.3	Confident	53 Å²	53	35.9 Å²	35.9	33%	0.325	17%	0.168	S	C	.	.			trans	-126.9	-11.4	-172.6	49.4	0	0	0	0	113.7	Y492 N496 L540	Y492-T498 HydrophobicContact CE2-CG2 4.14Å; N496-T498 PolarHBondContact O-N 3.06Å; T498-L540 PolarHBondContact N-O 2.8Å
499	I	73.7	Confident	72.3	Confident	34 Å²	34	37.8 Å²	37.8	17%	0.174	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	109.8	-177.1	-61	-58.9	0	0	0	109.5	A431 Y539 L540 Q542	A431-I499 WeakPolarHBondContact O-CG2 3.27Å; I499-Y539 CarbonylContact O-C 3.5Å; I499-Y539 VanDerWaalsContact O-CA 3.3Å; I499-Y539 WeakPolarHBondContact O-CA 3.31Å; I499-L540 HydrophobicContact CB-CB 4.02Å; I499-L540 WeakPolarHBondContact CB-O 3.19Å; I499-L540 HydrophobicContact CG2-CB 4.24Å; I499-L540 PolarHBondContact N-O 2.96Å; I499-L540 PolarHBondContact O-N 2.04Å; I499-Q542 VanDerWaalsContact CD1-NE2 3.35Å
500	A	72.6	Confident	72.1	Confident	10 Å²	10	38.8 Å²	38.8	8%	0.083	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	134.6	177.1	0	0	0	0	0	111.5	Y502 S515 I536 Y539	A500-Y502 HydrophobicContact CB-CD2 4.11Å; A500-Y502 HydrophobicContact CB-CE2 3.6Å; A500-S515 WeakPolarHBondContact O-CA 3.21Å; A500-S515 WeakPolarHBondContact O-CB 2.99Å; A500-I536 HydrophobicContact CB-CD1 3.89Å; A500-I536 HydrophobicContact CB-CG1 4.15Å; A500-I536 HydrophobicContact CB-CG2 3.98Å; A500-Y539 HydrophobicContact CB-CD1 4.03Å; A500-Y539 HydrophobicContact CB-CE1 3.8Å
501	M	83.7	Confident	72.3	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	95.1	166.9	-174.9	63.7	68.7	0	0	109.1	L405 A431 Q513 S537 F538 L540	L405-M501 HydrophobicContact CD1-CE 3.98Å; L405-M501 HydrophobicContact CD2-CE 4.35Å; A431-M501 HydrophobicContact CB-CE 3.86Å; M501-Q513 HydrophobicContact CG-CB 4.03Å; M501-Q513 HydrophobicContact SD-CB 3.73Å; M501-S537 PolarHBondContact O-N 3.42Å; M501-F538 HydrophobicContact CB-CD2 3.81Å; M501-F538 HydrophobicContact CB-CE2 3.61Å; M501-F538 HydrophobicContact CB-CG 4.38Å; M501-F538 HydrophobicContact CB-CZ 4.06Å; M501-F538 WeakPolarHBondContact CB-O 3.06Å; M501-F538 HydrophobicContact CE-CE2 4.26Å; M501-F538 HydrophobicContact CG-CD2 4.48Å; M501-F538 HydrophobicContact CG-CE1 4.41Å; M501-F538 HydrophobicContact CG-CE2 3.86Å; M501-F538 HydrophobicContact CG-CZ 3.83Å; M501-F538 PolarHBondContact N-O 3.16Å; M501-L540 HydrophobicContact CE-CD1 3.57Å
502	Y	75.8	Confident	73.1	Confident	23 Å²	23	38.3 Å²	38.3	9%	0.09	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	143.8	176	-65.1	-90.4	0	0	0	110.8	D143 F145 A500 F504 Q513 L514 V520 F524 I536	D143-Y502 PolarHBondContact OD2-OH 3.02Å; F145-Y502 HydrophobicContact CD1-CE1 4.3Å; F145-Y502 HydrophobicContact CD1-CE2 4.47Å; F145-Y502 AromaticContact CD1-CZ 3.94Å; A500-Y502 HydrophobicContact CB-CD2 4.11Å; A500-Y502 HydrophobicContact CB-CE2 3.6Å; Y502-F504 HydrophobicContact CG-CE2 4.46Å; Y502-Q513 CarbonylContact O-C 3.4Å; Y502-Q513 WeakPolarHBondContact O-CA 3.37Å; Y502-L514 WeakPolarHBondContact CB-O 3.46Å; Y502-L514 PolarHBondContact N-O 3.2Å; Y502-L514 PolarHBondContact O-N 3.43Å; Y502-V520 HydrophobicContact CD1-CG1 4.06Å; Y502-V520 HydrophobicContact CD2-CB 4.23Å; Y502-V520 HydrophobicContact CD2-CG1 3.47Å; Y502-V520 VanDerWaalsContact CD2-CG1 3.47Å; Y502-V520 HydrophobicContact CD2-CG2 3.71Å; Y502-V520 HydrophobicContact CE1-CG1 4.47Å; Y502-V520 HydrophobicContact CE2-CG1 3.93Å; Y502-V520 HydrophobicContact CE2-CG2 4.36Å; Y502-V520 HydrophobicContact CG-CG1 3.53Å; Y502-V520 HydrophobicContact CG-CG2 4.35Å; Y502-F524 HydrophobicContact CD1-CE2 4.17Å; Y502-F524 HydrophobicContact CD1-CZ 4.24Å; Y502-F524 HydrophobicContact CE1-CE2 4.24Å; Y502-F524 HydrophobicContact CE1-CZ 4.45Å; Y502-I536 HydrophobicContact CD1-CG1 3.79Å; Y502-I536 HydrophobicContact CE1-CD1 3.98Å; Y502-I536 HydrophobicContact CE1-CG1 3.72Å; Y502-I536 HydrophobicContact CG-CG1 4.46Å
503	R	83.6	Confident	74.1	Confident	17 Å²	17	34.1 Å²	34.1	6%	0.064	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.3	173.5	-177.8	172.2	55.8	176.7	-6.7	110.3	E470 Q513 E534 G535	E470-R503 VanDerWaalsContact CD-NH2 3.26Å; E470-R503 IonicContact OE1-CZ 3.81Å; E470-R503 IonicContact OE1-NH1 3.94Å; E470-R503 PolarHBondContact OE1-NH1 3.05Å; E470-R503 IonicContact OE1-NH2 3.49Å; E470-R503 PolarHBondContact OE1-NH2 3.12Å; E470-R503 IonicContact OE2-CZ 3.42Å; E470-R503 IonicContact OE2-NH1 2.95Å; E470-R503 IonicContact OE2-NH2 2.72Å; E470-R503 PolarHBondContact OE2-NH2 3.17Å; R503-Q513 HydrophobicContact CB-CG 4.22Å; R503-Q513 HydrophobicContact CG-CG 4.18Å; R503-E534 HydrophobicContact CB-CB 4.35Å; R503-E534 WeakPolarHBondContact CD-OE2 3.4Å; R503-E534 HydrophobicContact CG-CB 4.18Å; R503-E534 WeakPolarHBondContact CG-OE2 3.32Å; R503-E534 IonicContact CZ-OE2 3.82Å; R503-E534 IonicContact NE-OE2 2.85Å; R503-E534 PolarHBondContact NE-OE2 2.86Å; R503-E534 PolarHBondContact O-N 3.47Å; R503-G535 PolarHBondContact N-O 2.02Å
504	F	78.2	Confident	74.9	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	144.2	173.9	-57.7	-95.1	0	0	0	109.9	Y502 G511 V512 L514 V520 V523 F524 Y531 E532	Y502-F504 HydrophobicContact CG-CE2 4.46Å; F504-G511 CarbonylContact O-C 3.5Å; F504-G511 VanDerWaalsContact O-CA 3.22Å; F504-G511 WeakPolarHBondContact O-CA 3.47Å; F504-V512 HydrophobicContact CB-CG2 3.77Å; F504-V512 HydrophobicContact CD2-CG2 4.36Å; F504-V512 HydrophobicContact CG-CG2 4.49Å; F504-V512 PolarHBondContact N-O 3.41Å; F504-V512 PolarHBondContact O-N 3.36Å; F504-L514 HydrophobicContact CD2-CD1 3.67Å; F504-L514 HydrophobicContact CD2-CG 4.02Å; F504-L514 HydrophobicContact CE2-CB 4.28Å; F504-L514 HydrophobicContact CE2-CD1 3.67Å; F504-L514 HydrophobicContact CE2-CG 4.15Å; F504-V520 HydrophobicContact CE2-CG1 3.74Å; F504-V520 HydrophobicContact CZ-CG1 3.5Å; F504-V520 VanDerWaalsContact CZ-CG1 3.5Å; F504-V523 HydrophobicContact CB-CG1 4.02Å; F504-V523 HydrophobicContact CD1-CB 4.27Å; F504-V523 HydrophobicContact CD1-CG1 3.37Å; F504-V523 HydrophobicContact CD2-CG1 4.1Å; F504-V523 HydrophobicContact CE1-CB 4.2Å; F504-V523 HydrophobicContact CE1-CG1 3.76Å; F504-V523 HydrophobicContact CE2-CG1 4.44Å; F504-V523 HydrophobicContact CG-CB 4.45Å; F504-V523 HydrophobicContact CG-CG1 3.56Å; F504-V523 HydrophobicContact CZ-CB 4.34Å; F504-V523 HydrophobicContact CZ-CG1 4.29Å; F504-F524 AromaticContact CE1-CD1 3.87Å; F504-F524 HydrophobicContact CE1-CD1 3.87Å; F504-F524 HydrophobicContact CE1-CD2 4.17Å; F504-F524 AromaticContact CE1-CE1 3.75Å; F504-F524 HydrophobicContact CE1-CE1 3.75Å; F504-F524 HydrophobicContact CE1-CE2 4.06Å; F504-F524 HydrophobicContact CE1-CG 4.06Å; F504-F524 AromaticContact CE1-CZ 3.84Å; F504-F524 HydrophobicContact CE1-CZ 3.84Å; F504-F524 HydrophobicContact CZ-CD1 4.42Å; F504-F524 AromaticContact CZ-CD2 3.92Å; F504-F524 HydrophobicContact CZ-CD2 3.92Å; F504-F524 HydrophobicContact CZ-CE1 4.2Å; F504-F524 AromaticContact CZ-CE2 3.67Å; F504-F524 HydrophobicContact CZ-CE2 3.67Å; F504-F524 HydrophobicContact CZ-CG 4.27Å; F504-F524 AromaticContact CZ-CZ 3.81Å; F504-F524 HydrophobicContact CZ-CZ 3.81Å; F504-Y531 HydrophobicContact CB-CD1 3.75Å; F504-Y531 HydrophobicContact CB-CG 4.42Å; F504-E532 CarbonylContact C-O 3.56Å; F504-E532 VanDerWaalsContact CA-O 3.24Å; F504-E532 WeakPolarHBondContact CA-O 3.25Å
505	Y	76.8	Confident	75.2	Confident	62 Å²	62	34 Å²	34	24%	0.243	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.2	177.3	177.9	-104.6	0	0	0	110.9	R507 E532	Y505-R507 HydrophobicContact CE1-CB 4.01Å; Y505-E532 PolarHBondContact N-O 2.77Å; Y505-E532 PolarHBondContact O-N 2.99Å
506	N	76.5	Confident	74.6	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	18%	0.184	C	C	.	.			trans	-122.3	119.4	168.4	-176.1	-38.9	0	0	0	108.8	F508 I509 N510 P529 G530 Y531	N506-F508 PolarHBondContact O-N 3.32Å; N506-F508 PolarHBondContact OD1-N 3.35Å; N506-I509 HydrophobicContact CB-CB 4.1Å; N506-I509 HydrophobicContact CB-CG1 4.43Å; N506-I509 WeakPolarHBondContact ND2-CD1 3.48Å; N506-I509 PolarHBondContact O-N 2.92Å; N506-I509 PolarHBondContact OD1-N 3.19Å; N506-N510 PolarHBondContact N-O 3.2Å; N506-N510 PolarHBondContact O-N 2.89Å; N506-N510 VanDerWaalsContact O-N 3.11Å; N506-P529 PolarHBondContact ND2-O 3.11Å; N506-G530 PolarHBondContact ND2-O 3.13Å; N506-Y531 HydrophobicContact CB-CD1 3.57Å; N506-Y531 HydrophobicContact CB-CD2 3.94Å; N506-Y531 HydrophobicContact CB-CE1 3.55Å; N506-Y531 HydrophobicContact CB-CE2 3.92Å; N506-Y531 HydrophobicContact CB-CG 3.78Å
507	R	70.2	Confident	74.3	Confident	156 Å²	156	39.9 Å²	39.9	59%	0.589	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.2	-178.7	62.6	173.9	-83.4	-172.7	-5.3	115	Y505	Y505-R507 HydrophobicContact CE1-CB 4.01Å
508	F	68.8	Low	74	Confident	156 Å²	156	43.2 Å²	43.2	68%	0.684	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-17.1	-177.3	-58.1	-68.5	0	0	0	113.4	N506	N506-F508 PolarHBondContact O-N 3.32Å; N506-F508 PolarHBondContact OD1-N 3.35Å
509	I	69	Low	74.1	Confident	41 Å²	41	43 Å²	43	21%	0.21	20%	0.203	C	C	.	.	S	Bend	trans	-110.8	-74.3	-175.1	-54.9	179	0	0	0	108.8	R401 N506 Y531	R401-I509 HydrophobicContact CB-CG2 3.66Å; N506-I509 HydrophobicContact CB-CB 4.1Å; N506-I509 HydrophobicContact CB-CG1 4.43Å; N506-I509 WeakPolarHBondContact ND2-CD1 3.48Å; N506-I509 PolarHBondContact O-N 2.92Å; N506-I509 PolarHBondContact OD1-N 3.19Å; I509-Y531 HydrophobicContact CD1-CE2 3.88Å; I509-Y531 VanDerWaalsContact CG2-OH 3.3Å; I509-Y531 WeakPolarHBondContact CG2-OH 3.35Å
510	N	75	Confident	73.7	Confident	20 Å²	20	41.4 Å²	41.4	11%	0.107	20%	0.195	C	C	.	.			trans	165.7	-178.5	172.2	-90.2	-31.1	0	0	0	108.8	L400 L459 Q461 N506 Y531	L400-N510 PolarHBondContact O-ND2 2.8Å; L459-N510 VanDerWaalsContact O-CG 3.24Å; L459-N510 PolarHBondContact O-ND2 2.87Å; L459-N510 PolarHBondContact O-OD1 2.75Å; Q461-N510 HydrophobicContact CB-CB 4.4Å; N506-N510 PolarHBondContact N-O 3.2Å; N506-N510 PolarHBondContact O-N 2.89Å; N506-N510 VanDerWaalsContact O-N 3.11Å; N510-Y531 WeakPolarHBondContact O-CE1 3.47Å
511	G	76.7	Confident	73.4	Confident	12 Å²	12	45.9 Å²	45.9	12%	0.124	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	147.8	167.7	0	0	0	0	0	113.7	F504	F504-G511 CarbonylContact O-C 3.5Å; F504-G511 VanDerWaalsContact O-CA 3.22Å; F504-G511 WeakPolarHBondContact O-CA 3.47Å
512	V	78.9	Confident	72.7	Confident	8 Å²	8	49.3 Å²	49.3	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.9	170.8	-66.5	0	0	0	0	110	N403 F504 L514 Y531	N403-V512 VanDerWaalsContact ND2-CB 3.31Å; N403-V512 WeakPolarHBondContact ND2-CB 3.45Å; F504-V512 HydrophobicContact CB-CG2 3.77Å; F504-V512 HydrophobicContact CD2-CG2 4.36Å; F504-V512 HydrophobicContact CG-CG2 4.49Å; F504-V512 PolarHBondContact N-O 3.41Å; F504-V512 PolarHBondContact O-N 3.36Å; V512-L514 HydrophobicContact CB-CD2 4.27Å; V512-L514 HydrophobicContact CG2-CD1 4.27Å; V512-L514 HydrophobicContact CG2-CD2 4.31Å; V512-L514 HydrophobicContact CG2-CG 4.2Å; V512-Y531 HydrophobicContact CB-CE1 4.23Å; V512-Y531 HydrophobicContact CG1-CE1 3.9Å; V512-Y531 HydrophobicContact CG2-CD1 3.8Å; V512-Y531 HydrophobicContact CG2-CE1 3.45Å; V512-Y531 VanDerWaalsContact CG2-CE1 3.45Å
513	Q	84.7	Confident	72.6	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.7	170.2	-68.4	-179.6	-79.3	0	0	110.2	R394 N403 Y464 M501 Y502 R503 S537	R394-Q513 PolarHBondContact NE-O 2.92Å; N403-Q513 PolarHBondContact ND2-N 3.43Å; N403-Q513 VanDerWaalsContact ND2-N 3.2Å; N403-Q513 PolarHBondContact ND2-O 3.14Å; Y464-Q513 PolarHBondContact O-NE2 2.8Å; M501-Q513 HydrophobicContact CG-CB 4.03Å; M501-Q513 HydrophobicContact SD-CB 3.73Å; Y502-Q513 CarbonylContact O-C 3.4Å; Y502-Q513 WeakPolarHBondContact O-CA 3.37Å; R503-Q513 HydrophobicContact CB-CG 4.22Å; R503-Q513 HydrophobicContact CG-CG 4.18Å; Q513-S537 PolarHBondContact NE2-OG 2.98Å
514	L	78.2	Confident	71.9	Confident	3 Å²	3	48 Å²	48	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.4	-168.7	-50.7	-179	0	0	0	110.4	R394 Y502 F504 V512 D519 V520 V523	R394-L514 VanDerWaalsContact NH1-CD2 3.26Å; Y502-L514 WeakPolarHBondContact CB-O 3.46Å; Y502-L514 PolarHBondContact N-O 3.2Å; Y502-L514 PolarHBondContact O-N 3.43Å; F504-L514 HydrophobicContact CD2-CD1 3.67Å; F504-L514 HydrophobicContact CD2-CG 4.02Å; F504-L514 HydrophobicContact CE2-CB 4.28Å; F504-L514 HydrophobicContact CE2-CD1 3.67Å; F504-L514 HydrophobicContact CE2-CG 4.15Å; V512-L514 HydrophobicContact CB-CD2 4.27Å; V512-L514 HydrophobicContact CG2-CD1 4.27Å; V512-L514 HydrophobicContact CG2-CD2 4.31Å; V512-L514 HydrophobicContact CG2-CG 4.2Å; L514-D519 HydrophobicContact CD1-CB 4.41Å; L514-V520 HydrophobicContact CB-CG2 3.56Å; L514-V523 HydrophobicContact CD1-CB 4.14Å; L514-V523 HydrophobicContact CD1-CG2 3.56Å
515	S	75.7	Confident	71.4	Confident	20 Å²	20	50.8 Å²	50.8	14%	0.14	24%	0.24	C	C	.	.			trans	-122.1	-21.1	172.1	59.8	0	0	0	0	113.6	A431 A500 Y517	A431-S515 VanDerWaalsContact CA-OG 3.23Å; A431-S515 WeakPolarHBondContact CA-OG 3.43Å; A431-S515 WeakPolarHBondContact CB-OG 3.15Å; A431-S515 VanDerWaalsContact O-CB 3.26Å; A431-S515 WeakPolarHBondContact O-CB 3.3Å; A431-S515 PolarHBondContact O-OG 3.07Å; A500-S515 WeakPolarHBondContact O-CA 3.21Å; A500-S515 WeakPolarHBondContact O-CB 2.99Å; S515-Y517 PolarHBondContact O-N 3.47Å
516	N	63.5	Low	71	Confident	81 Å²	81	49.1 Å²	49.1	43%	0.433	24%	0.242	S	C	.	.			trans	-68.2	119.1	178.4	-174.8	-70.4	0	0	0	110.1	T518 D519 V520	N516-T518 PolarHBondContact O-N 3.36Å; N516-T518 VanDerWaalsContact O-N 3.13Å; N516-T518 VanDerWaalsContact OD1-CB 3.29Å; N516-T518 WeakPolarHBondContact OD1-CB 3.29Å; N516-T518 PolarHBondContact OD1-N 2.03Å; N516-D519 HydrophobicContact CB-CB 4.26Å; N516-D519 PolarHBondContact O-N 3.49Å; N516-D519 VanDerWaalsContact O-N 3.13Å; N516-D519 PolarHBondContact OD1-N 3.28Å; N516-V520 WeakPolarHBondContact O-CG2 3.46Å; N516-V520 PolarHBondContact O-N 3.37Å
517	Y	63.2	Low	70.5	Confident	130 Å²	130	53.7 Å²	53.7	51%	0.51	27%	0.266	S	S	.	.	H	α-helix	trans	-48.5	-43	-179	173.7	-94.3	0	0	0	113.8	F145 S515 R521	F145-Y517 HydrophobicContact CD2-CD2 4.09Å; F145-Y517 AromaticContact CD2-CE2 3.52Å; F145-Y517 HydrophobicContact CD2-CE2 3.52Å; F145-Y517 AromaticContact CE2-CD2 3.62Å; F145-Y517 HydrophobicContact CE2-CD2 3.62Å; F145-Y517 AromaticContact CE2-CE2 3.11Å; F145-Y517 HydrophobicContact CE2-CE2 3.11Å; F145-Y517 AromaticContact CE2-CZ 3.72Å; F145-Y517 HydrophobicContact CZ-CD2 4.04Å; F145-Y517 AromaticContact CZ-CE2 3.96Å; F145-Y517 HydrophobicContact CZ-CE2 3.96Å; S515-Y517 PolarHBondContact O-N 3.47Å; Y517-R521 VanDerWaalsContact CE1-NH1 3.33Å; Y517-R521 WeakPolarHBondContact O-CB 2.96Å; Y517-R521 PolarHBondContact O-N 3.17Å; Y517-R521 PolarHBondContact OH-NH1 3.07Å
518	T	62.6	Low	70.3	Confident	70 Å²	70	49.1 Å²	49.1	43%	0.429	26%	0.256	S	S	.	.	H	α-helix	trans	-65.8	-47.9	-178.2	-51.8	0	0	0	0	111.2	N516 R521 L522	N516-T518 PolarHBondContact O-N 3.36Å; N516-T518 VanDerWaalsContact O-N 3.13Å; N516-T518 VanDerWaalsContact OD1-CB 3.29Å; N516-T518 WeakPolarHBondContact OD1-CB 3.29Å; N516-T518 PolarHBondContact OD1-N 2.03Å; T518-R521 PolarHBondContact O-N 2.95Å; T518-L522 HydrophobicContact CG2-CD1 4.38Å; T518-L522 WeakPolarHBondContact O-CG 3.41Å; T518-L522 PolarHBondContact O-N 2.53Å
519	D	68	Low	70.4	Confident	49 Å²	49	46.5 Å²	46.5	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-46.9	178.2	-74.6	2.9	0	0	0	111.1	R394 L514 N516 R521 L522 V523	R394-D519 IonicContact NH1-OD2 3.85Å; R394-D519 PolarHBondContact NH1-OD2 3.11Å; L514-D519 HydrophobicContact CD1-CB 4.41Å; N516-D519 HydrophobicContact CB-CB 4.26Å; N516-D519 PolarHBondContact O-N 3.49Å; N516-D519 VanDerWaalsContact O-N 3.13Å; N516-D519 PolarHBondContact OD1-N 3.28Å; D519-R521 VanDerWaalsContact C-N 3.28Å; D519-R521 PolarHBondContact O-N 3.23Å; D519-L522 PolarHBondContact O-N 2.75Å; D519-V523 WeakPolarHBondContact O-CG2 3.35Å; D519-V523 PolarHBondContact O-N 3.03Å
520	V	65.7	Low	70.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-42	-178.6	-171.7	0	0	0	0	109.2	F145 Y502 F504 L514 N516 L522 V523 F524	F145-V520 HydrophobicContact CD1-CG1 4.14Å; F145-V520 HydrophobicContact CE1-CB 3.8Å; F145-V520 HydrophobicContact CE1-CG1 3.41Å; F145-V520 VanDerWaalsContact CE1-CG1 3.41Å; F145-V520 HydrophobicContact CZ-CB 4.3Å; F145-V520 HydrophobicContact CZ-CG1 4.35Å; Y502-V520 HydrophobicContact CD1-CG1 4.06Å; Y502-V520 HydrophobicContact CD2-CB 4.23Å; Y502-V520 HydrophobicContact CD2-CG1 3.47Å; Y502-V520 VanDerWaalsContact CD2-CG1 3.47Å; Y502-V520 HydrophobicContact CD2-CG2 3.71Å; Y502-V520 HydrophobicContact CE1-CG1 4.47Å; Y502-V520 HydrophobicContact CE2-CG1 3.93Å; Y502-V520 HydrophobicContact CE2-CG2 4.36Å; Y502-V520 HydrophobicContact CG-CG1 3.53Å; Y502-V520 HydrophobicContact CG-CG2 4.35Å; F504-V520 HydrophobicContact CE2-CG1 3.74Å; F504-V520 HydrophobicContact CZ-CG1 3.5Å; F504-V520 VanDerWaalsContact CZ-CG1 3.5Å; L514-V520 HydrophobicContact CB-CG2 3.56Å; N516-V520 WeakPolarHBondContact O-CG2 3.46Å; N516-V520 PolarHBondContact O-N 3.37Å; V520-L522 PolarHBondContact O-N 3.15Å; V520-V523 PolarHBondContact O-N 3.42Å; V520-F524 HydrophobicContact CG1-CD2 3.7Å; V520-F524 HydrophobicContact CG1-CE2 3.48Å; V520-F524 VanDerWaalsContact CG1-CE2 3.48Å; V520-F524 WeakPolarHBondContact O-CB 3.15Å; V520-F524 WeakPolarHBondContact O-CD2 3.14Å; V520-F524 PolarHBondContact O-N 2.99Å
521	R	67.1	Low	70.5	Confident	104 Å²	104	46.5 Å²	46.5	39%	0.392	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-45.1	176.6	-161.1	171.2	62	-163.7	0.1	111.5	F145 Y517 T518 D519 V523 F524 T525	F145-R521 HydrophobicContact CE2-CB 4.12Å; F145-R521 HydrophobicContact CE2-CG 4.17Å; F145-R521 HydrophobicContact CZ-CB 3.61Å; F145-R521 HydrophobicContact CZ-CG 4.07Å; Y517-R521 VanDerWaalsContact CE1-NH1 3.33Å; Y517-R521 WeakPolarHBondContact O-CB 2.96Å; Y517-R521 PolarHBondContact O-N 3.17Å; Y517-R521 PolarHBondContact OH-NH1 3.07Å; T518-R521 PolarHBondContact O-N 2.95Å; D519-R521 VanDerWaalsContact C-N 3.28Å; D519-R521 PolarHBondContact O-N 3.23Å; R521-V523 PolarHBondContact O-N 3.14Å; R521-F524 WeakPolarHBondContact O-CB 3.34Å; R521-F524 PolarHBondContact O-N 3.43Å; R521-T525 WeakPolarHBondContact O-CG2 3.45Å; R521-T525 PolarHBondContact O-N 2.89Å; R521-T525 PolarHBondContact O-OG1 3.14Å
522	L	69.4	Low	70.1	Confident	72 Å²	72	49 Å²	49	38%	0.377	27%	0.272	S	S	.	.	H	α-helix	trans	-59.2	-48.8	178.4	-73.5	170.2	0	0	0	111.1	T518 D519 V520 F524 T525 G526 I527	T518-L522 HydrophobicContact CG2-CD1 4.38Å; T518-L522 WeakPolarHBondContact O-CG 3.41Å; T518-L522 PolarHBondContact O-N 2.53Å; D519-L522 PolarHBondContact O-N 2.75Å; V520-L522 PolarHBondContact O-N 3.15Å; L522-F524 VanDerWaalsContact C-N 3.29Å; L522-F524 PolarHBondContact O-N 2.75Å; L522-T525 WeakPolarHBondContact CA-OG1 3.17Å; L522-T525 CarbonylContact O-C 3.48Å; L522-T525 PolarHBondContact O-N 3.49Å; L522-T525 PolarHBondContact O-OG1 3.04Å; L522-G526 PolarHBondContact O-N 2.67Å; L522-I527 CarbonylContact C-O 3.57Å; L522-I527 HydrophobicContact CB-CB 4.46Å; L522-I527 HydrophobicContact CD2-CD1 4.5Å; L522-I527 WeakPolarHBondContact O-CA 3.47Å; L522-I527 PolarHBondContact O-N 3.16Å; L522-I527 VanDerWaalsContact O-O 3.13Å
523	V	73.8	Confident	69.8	Low	11 Å²	11	49 Å²	49	7%	0.067	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-40	179.6	-179	0	0	0	0	111.2	F504 L514 D519 V520 R521 T525 G526 I527 Y531	F504-V523 HydrophobicContact CB-CG1 4.02Å; F504-V523 HydrophobicContact CD1-CB 4.27Å; F504-V523 HydrophobicContact CD1-CG1 3.37Å; F504-V523 HydrophobicContact CD2-CG1 4.1Å; F504-V523 HydrophobicContact CE1-CB 4.2Å; F504-V523 HydrophobicContact CE1-CG1 3.76Å; F504-V523 HydrophobicContact CE2-CG1 4.44Å; F504-V523 HydrophobicContact CG-CB 4.45Å; F504-V523 HydrophobicContact CG-CG1 3.56Å; F504-V523 HydrophobicContact CZ-CB 4.34Å; F504-V523 HydrophobicContact CZ-CG1 4.29Å; L514-V523 HydrophobicContact CD1-CB 4.14Å; L514-V523 HydrophobicContact CD1-CG2 3.56Å; D519-V523 WeakPolarHBondContact O-CG2 3.35Å; D519-V523 PolarHBondContact O-N 3.03Å; V520-V523 PolarHBondContact O-N 3.42Å; R521-V523 PolarHBondContact O-N 3.14Å; V523-T525 PolarHBondContact O-N 2.86Å; V523-G526 PolarHBondContact O-N 3.12Å; V523-I527 VanDerWaalsContact CA-O 3.25Å; V523-I527 WeakPolarHBondContact CA-O 3.43Å; V523-I527 PolarHBondContact N-O 3.24Å; V523-I527 VanDerWaalsContact N-O 3.16Å; V523-Y531 VanDerWaalsContact CG1-CB 3.4Å; V523-Y531 HydrophobicContact CG1-CG 3.94Å
524	F	67.9	Low	69.1	Low	2 Å²	2	51 Å²	51	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-39.2	171.8	-90.9	-50.4	0	0	0	113.5	F145 E146 A149 Q153 Y502 F504 V520 R521 L522 G526	F145-F524 AromaticContact CD1-CD2 3.85Å; F145-F524 HydrophobicContact CD1-CD2 3.85Å; F145-F524 AromaticContact CD1-CE2 3.59Å; F145-F524 HydrophobicContact CD1-CE2 3.59Å; F145-F524 AromaticContact CE1-CD2 3.4Å; F145-F524 HydrophobicContact CE1-CD2 3.4Å; F145-F524 VanDerWaalsContact CE1-CD2 3.4Å; F145-F524 AromaticContact CE1-CE2 3.55Å; F145-F524 HydrophobicContact CE1-CE2 3.55Å; F145-F524 HydrophobicContact CZ-CD2 4.25Å; E146-F524 HydrophobicContact CB-CE1 4.04Å; E146-F524 HydrophobicContact CB-CE2 4.45Å; E146-F524 HydrophobicContact CB-CZ 3.73Å; E146-F524 HydrophobicContact CG-CE1 3.57Å; E146-F524 HydrophobicContact CG-CZ 3.77Å; A149-F524 HydrophobicContact CB-CB 3.44Å; A149-F524 VanDerWaalsContact CB-CB 3.44Å; A149-F524 HydrophobicContact CB-CD1 3.81Å; A149-F524 HydrophobicContact CB-CD2 4.1Å; A149-F524 HydrophobicContact CB-CG 3.52Å; Q153-F524 PolarHBondContact NE2-O 2.91Å; Y502-F524 HydrophobicContact CD1-CE2 4.17Å; Y502-F524 HydrophobicContact CD1-CZ 4.24Å; Y502-F524 HydrophobicContact CE1-CE2 4.24Å; Y502-F524 HydrophobicContact CE1-CZ 4.45Å; F504-F524 AromaticContact CE1-CD1 3.87Å; F504-F524 HydrophobicContact CE1-CD1 3.87Å; F504-F524 HydrophobicContact CE1-CD2 4.17Å; F504-F524 AromaticContact CE1-CE1 3.75Å; F504-F524 HydrophobicContact CE1-CE1 3.75Å; F504-F524 HydrophobicContact CE1-CE2 4.06Å; F504-F524 HydrophobicContact CE1-CG 4.06Å; F504-F524 AromaticContact CE1-CZ 3.84Å; F504-F524 HydrophobicContact CE1-CZ 3.84Å; F504-F524 HydrophobicContact CZ-CD1 4.42Å; F504-F524 AromaticContact CZ-CD2 3.92Å; F504-F524 HydrophobicContact CZ-CD2 3.92Å; F504-F524 HydrophobicContact CZ-CE1 4.2Å; F504-F524 AromaticContact CZ-CE2 3.67Å; F504-F524 HydrophobicContact CZ-CE2 3.67Å; F504-F524 HydrophobicContact CZ-CG 4.27Å; F504-F524 AromaticContact CZ-CZ 3.81Å; F504-F524 HydrophobicContact CZ-CZ 3.81Å; V520-F524 HydrophobicContact CG1-CD2 3.7Å; V520-F524 HydrophobicContact CG1-CE2 3.48Å; V520-F524 VanDerWaalsContact CG1-CE2 3.48Å; V520-F524 WeakPolarHBondContact O-CB 3.15Å; V520-F524 WeakPolarHBondContact O-CD2 3.14Å; V520-F524 PolarHBondContact O-N 2.99Å; R521-F524 WeakPolarHBondContact O-CB 3.34Å; R521-F524 PolarHBondContact O-N 3.43Å; L522-F524 VanDerWaalsContact C-N 3.29Å; L522-F524 PolarHBondContact O-N 2.75Å; F524-G526 PolarHBondContact O-N 2.84Å; F524-G526 VanDerWaalsContact O-N 3.13Å
525	T	67.8	Low	68.8	Low	58 Å²	58	51.4 Å²	51.4	36%	0.356	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	4.5	174.1	58.9	0	0	0	0	113.5	R521 L522 V523	R521-T525 WeakPolarHBondContact O-CG2 3.45Å; R521-T525 PolarHBondContact O-N 2.89Å; R521-T525 PolarHBondContact O-OG1 3.14Å; L522-T525 WeakPolarHBondContact CA-OG1 3.17Å; L522-T525 CarbonylContact O-C 3.48Å; L522-T525 PolarHBondContact O-N 3.49Å; L522-T525 PolarHBondContact O-OG1 3.04Å; V523-T525 PolarHBondContact O-N 2.86Å
526	G	69.2	Low	68.7	Low	27 Å²	27	52.8 Å²	52.8	28%	0.278	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	23.9	178.1	0	0	0	0	0	113.9	L522 V523 F524 P528 P529	L522-G526 PolarHBondContact O-N 2.67Å; V523-G526 PolarHBondContact O-N 3.12Å; F524-G526 PolarHBondContact O-N 2.84Å; F524-G526 VanDerWaalsContact O-N 3.13Å; G526-P528 CarbonylContact C-O 3.59Å; G526-P528 CarbonylContact O-C 3.4Å; G526-P529 WeakPolarHBondContact O-CA 3.31Å
527	I	65.8	Low	69.5	Low	101 Å²	101	49.7 Å²	49.7	52%	0.518	28%	0.278	S	S	.	.	S	Bend	trans	-120.9	111.4	-179.4	-55.8	177.7	0	0	0	109.9	L522 V523	L522-I527 CarbonylContact C-O 3.57Å; L522-I527 HydrophobicContact CB-CB 4.46Å; L522-I527 HydrophobicContact CD2-CD1 4.5Å; L522-I527 WeakPolarHBondContact O-CA 3.47Å; L522-I527 PolarHBondContact O-N 3.16Å; L522-I527 VanDerWaalsContact O-O 3.13Å; V523-I527 VanDerWaalsContact CA-O 3.25Å; V523-I527 WeakPolarHBondContact CA-O 3.43Å; V523-I527 PolarHBondContact N-O 3.24Å; V523-I527 VanDerWaalsContact N-O 3.16Å
528	P	66.5	Low	70.6	Confident	60 Å²	60	43.6 Å²	43.6	39%	0.39	25%	0.254	S	S	.	.	S	Bend	cis	-71.9	157.6	-4.7	29.1	-32.1	0	0	0	112.3	G526 Y531	G526-P528 CarbonylContact C-O 3.59Å; G526-P528 CarbonylContact O-C 3.4Å; P528-Y531 HydrophobicContact CG-CD2 3.72Å; P528-Y531 HydrophobicContact CG-CE2 3.61Å
529	P	70.5	Confident	71.4	Confident	101 Å²	101	40.8 Å²	40.8	66%	0.656	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	150.2	-174.3	26.3	-35.1	0	0	0	112.6	N506 G526	N506-P529 PolarHBondContact ND2-O 3.11Å; G526-P529 WeakPolarHBondContact O-CA 3.31Å
530	G	72.8	Confident	72.2	Confident	42 Å²	42	38.5 Å²	38.5	43%	0.433	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	87	-0.9	172.4	0	0	0	0	0	115.5	N506	N506-G530 PolarHBondContact ND2-O 3.13Å
531	Y	72.4	Confident	73.1	Confident	18 Å²	18	38.5 Å²	38.5	7%	0.071	22%	0.223	C	C	.	.			trans	-76.8	138.9	165.8	-82.5	-82.7	0	0	0	111.1	F504 N506 I509 N510 V512 V523 P528	F504-Y531 HydrophobicContact CB-CD1 3.75Å; F504-Y531 HydrophobicContact CB-CG 4.42Å; N506-Y531 HydrophobicContact CB-CD1 3.57Å; N506-Y531 HydrophobicContact CB-CD2 3.94Å; N506-Y531 HydrophobicContact CB-CE1 3.55Å; N506-Y531 HydrophobicContact CB-CE2 3.92Å; N506-Y531 HydrophobicContact CB-CG 3.78Å; I509-Y531 HydrophobicContact CD1-CE2 3.88Å; I509-Y531 VanDerWaalsContact CG2-OH 3.3Å; I509-Y531 WeakPolarHBondContact CG2-OH 3.35Å; N510-Y531 WeakPolarHBondContact O-CE1 3.47Å; V512-Y531 HydrophobicContact CB-CE1 4.23Å; V512-Y531 HydrophobicContact CG1-CE1 3.9Å; V512-Y531 HydrophobicContact CG2-CD1 3.8Å; V512-Y531 HydrophobicContact CG2-CE1 3.45Å; V512-Y531 VanDerWaalsContact CG2-CE1 3.45Å; V523-Y531 VanDerWaalsContact CG1-CB 3.4Å; V523-Y531 HydrophobicContact CG1-CG 3.94Å; P528-Y531 HydrophobicContact CG-CD2 3.72Å; P528-Y531 HydrophobicContact CG-CE2 3.61Å
532	E	69.4	Low	73.5	Confident	65 Å²	65	39 Å²	39	30%	0.304	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.1	174.7	-72.4	178.1	-142	0	0	110.4	R181 F504 Y505 E534	R181-E532 WeakPolarHBondContact CD-OE2 3.39Å; R181-E532 IonicContact CZ-OE1 3.17Å; R181-E532 IonicContact CZ-OE2 3.61Å; R181-E532 IonicContact NE-OE1 2.63Å; R181-E532 IonicContact NE-OE2 3.63Å; R181-E532 PolarHBondContact NE-OE2 2.74Å; R181-E532 VanDerWaalsContact NE-OE2 3.11Å; R181-E532 IonicContact NH1-OE1 3.03Å; R181-E532 PolarHBondContact NH1-OE1 3.34Å; R181-E532 IonicContact NH1-OE2 3.4Å; R181-E532 PolarHBondContact NH1-OE2 3.39Å; R181-E532 IonicContact NH2-OE1 3.73Å; R181-E532 PolarHBondContact NH2-OE1 2.93Å; R181-E532 IonicContact NH2-OE2 3.7Å; R181-E532 PolarHBondContact NH2-OE2 3.41Å; F504-E532 CarbonylContact C-O 3.56Å; F504-E532 VanDerWaalsContact CA-O 3.24Å; F504-E532 WeakPolarHBondContact CA-O 3.25Å; Y505-E532 PolarHBondContact N-O 2.77Å; Y505-E532 PolarHBondContact O-N 2.99Å; E532-E534 PolarHBondContact O-N 3.23Å
533	S	71.3	Confident	74	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.063	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	128	177.2	175.4	0	0	0	0	111.8	E146 G535	E146-S533 WeakPolarHBondContact OE1-CB 3.39Å; E146-S533 PolarHBondContact OE1-OG 3.05Å; S533-G535 PolarHBondContact OG-N 2.75Å
534	E	70.1	Confident	74.3	Confident	47 Å²	47	40.1 Å²	40.1	22%	0.22	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	0.6	170.2	-60.9	-168.3	129.6	0	0	112	R503 E532	R503-E534 HydrophobicContact CB-CB 4.35Å; R503-E534 WeakPolarHBondContact CD-OE2 3.4Å; R503-E534 HydrophobicContact CG-CB 4.18Å; R503-E534 WeakPolarHBondContact CG-OE2 3.32Å; R503-E534 IonicContact CZ-OE2 3.82Å; R503-E534 IonicContact NE-OE2 2.85Å; R503-E534 PolarHBondContact NE-OE2 2.86Å; R503-E534 PolarHBondContact O-N 3.47Å; E532-E534 PolarHBondContact O-N 3.23Å
535	G	72	Confident	74	Confident	13 Å²	13	47.5 Å²	47.5	13%	0.134	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	101.9	-160.6	-179	0	0	0	0	0	113.7	R503 S533	R503-G535 PolarHBondContact N-O 2.02Å; S533-G535 PolarHBondContact OG-N 2.75Å
536	I	72.9	Confident	73.1	Confident	49 Å²	49	47.8 Å²	47.8	25%	0.251	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	129.3	-179.7	-61.6	168.8	0	0	0	108.5	A500 Y502 F538 Y539	A500-I536 HydrophobicContact CB-CD1 3.89Å; A500-I536 HydrophobicContact CB-CG1 4.15Å; A500-I536 HydrophobicContact CB-CG2 3.98Å; Y502-I536 HydrophobicContact CD1-CG1 3.79Å; Y502-I536 HydrophobicContact CE1-CD1 3.98Å; Y502-I536 HydrophobicContact CE1-CG1 3.72Å; Y502-I536 HydrophobicContact CG-CG1 4.46Å; I536-F538 WeakPolarHBondContact CG2-O 3.34Å; I536-Y539 HydrophobicContact CD1-CE1 4.39Å; I536-Y539 WeakPolarHBondContact CD1-OH 3.3Å; I536-Y539 HydrophobicContact CG2-CD2 4.31Å; I536-Y539 HydrophobicContact CG2-CE2 3.89Å
537	S	82	Confident	71.3	Confident	16 Å²	16	52.8 Å²	52.8	11%	0.112	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-42.7	177.1	-62.4	0	0	0	0	112.4	M501 Q513	M501-S537 PolarHBondContact O-N 3.42Å; Q513-S537 PolarHBondContact NE2-OG 2.98Å
538	F	85.4	Confident	69.7	Low	2 Å²	2	56 Å²	56	1%	0.009	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	171.7	-179.2	48.4	-100.5	0	0	0	110.7	I451 Y464 I466 A488 M501 I536 L540	I451-F538 HydrophobicContact CG2-CE1 4.12Å; I451-F538 HydrophobicContact CG2-CZ 4.27Å; Y464-F538 WeakPolarHBondContact O-CE1 3.27Å; I466-F538 HydrophobicContact CD1-CB 3.43Å; I466-F538 VanDerWaalsContact CD1-CB 3.43Å; I466-F538 HydrophobicContact CG1-CB 3.92Å; I466-F538 HydrophobicContact CG2-CB 4.1Å; I466-F538 HydrophobicContact CG2-CD1 4.01Å; I466-F538 HydrophobicContact CG2-CG 4.25Å; A488-F538 HydrophobicContact CB-CB 4.11Å; A488-F538 HydrophobicContact CB-CD2 3.92Å; A488-F538 HydrophobicContact CB-CG 4.15Å; M501-F538 HydrophobicContact CB-CD2 3.81Å; M501-F538 HydrophobicContact CB-CE2 3.61Å; M501-F538 HydrophobicContact CB-CG 4.38Å; M501-F538 HydrophobicContact CB-CZ 4.06Å; M501-F538 WeakPolarHBondContact CB-O 3.06Å; M501-F538 HydrophobicContact CE-CE2 4.26Å; M501-F538 HydrophobicContact CG-CD2 4.48Å; M501-F538 HydrophobicContact CG-CE1 4.41Å; M501-F538 HydrophobicContact CG-CE2 3.86Å; M501-F538 HydrophobicContact CG-CZ 3.83Å; M501-F538 PolarHBondContact N-O 3.16Å; I536-F538 WeakPolarHBondContact CG2-O 3.34Å; F538-L540 HydrophobicContact CD2-CD2 3.77Å; F538-L540 HydrophobicContact CD2-CG 3.96Å; F538-L540 HydrophobicContact CE2-CD1 4.11Å; F538-L540 HydrophobicContact CE2-CD2 3.63Å; F538-L540 HydrophobicContact CE2-CG 3.87Å
539	Y	79	Confident	68	Low	10 Å²	10	57.7 Å²	57.7	4%	0.039	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.7	175	-64.8	-98.8	0	0	0	111.5	A488 V489 S490 Y492 I499 A500 I536	A488-Y539 WeakPolarHBondContact CB-O 3.41Å; V489-Y539 PolarHBondContact N-O 3.36Å; V489-Y539 PolarHBondContact O-N 3.48Å; S490-Y539 WeakPolarHBondContact O-CD2 2.9Å; S490-Y539 VanDerWaalsContact O-CE2 3.31Å; S490-Y539 WeakPolarHBondContact O-CE2 3.26Å; Y492-Y539 HydrophobicContact CD2-CD1 4.15Å; Y492-Y539 AromaticContact CD2-CE1 3.86Å; Y492-Y539 HydrophobicContact CD2-CE1 3.86Å; Y492-Y539 HydrophobicContact CG-CE1 4.2Å; Y492-Y539 VanDerWaalsContact N-CE2 3.29Å; I499-Y539 CarbonylContact O-C 3.5Å; I499-Y539 VanDerWaalsContact O-CA 3.3Å; I499-Y539 WeakPolarHBondContact O-CA 3.31Å; A500-Y539 HydrophobicContact CB-CD1 4.03Å; A500-Y539 HydrophobicContact CB-CE1 3.8Å; I536-Y539 HydrophobicContact CD1-CE1 4.39Å; I536-Y539 WeakPolarHBondContact CD1-OH 3.3Å; I536-Y539 HydrophobicContact CG2-CD2 4.31Å; I536-Y539 HydrophobicContact CG2-CE2 3.89Å
540	L	85.6	Confident	66.4	Low	1 Å²	1	57.1 Å²	57.1	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	166.3	-176.8	-62.7	178.3	0	0	0	110.5	I434 A488 A497 T498 I499 M501 F538	I434-L540 HydrophobicContact CG2-CD2 3.42Å; I434-L540 VanDerWaalsContact CG2-CD2 3.42Å; A488-L540 HydrophobicContact CB-CD2 4.2Å; A497-L540 CarbonylContact C-O 3.53Å; A497-L540 WeakPolarHBondContact CA-O 2.98Å; T498-L540 PolarHBondContact N-O 2.8Å; I499-L540 HydrophobicContact CB-CB 4.02Å; I499-L540 WeakPolarHBondContact CB-O 3.19Å; I499-L540 HydrophobicContact CG2-CB 4.24Å; I499-L540 PolarHBondContact N-O 2.96Å; I499-L540 PolarHBondContact O-N 2.04Å; M501-L540 HydrophobicContact CE-CD1 3.57Å; F538-L540 HydrophobicContact CD2-CD2 3.77Å; F538-L540 HydrophobicContact CD2-CG 3.96Å; F538-L540 HydrophobicContact CE2-CD1 4.11Å; F538-L540 HydrophobicContact CE2-CD2 3.63Å; F538-L540 HydrophobicContact CE2-CG 3.87Å
541	W	84.7	Confident	64.4	Low	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-91.3	166.1	171.7	-64.7	-87.8	0	0	0	111.7	P386 L389 G432 S433 V435 L448 V489 C495 A497	P386-W541 HydrophobicContact CG-CH2 4.29Å; P386-W541 HydrophobicContact CG-CZ2 3.93Å; L389-W541 HydrophobicContact CD1-CB 3.5Å; L389-W541 HydrophobicContact CD1-CD2 4.14Å; L389-W541 HydrophobicContact CD1-CG 3.62Å; L389-W541 HydrophobicContact CD2-CD2 3.87Å; L389-W541 HydrophobicContact CD2-CE3 3.71Å; L389-W541 HydrophobicContact CD2-CG 4.26Å; L389-W541 HydrophobicContact CD2-CZ3 4.25Å; G432-W541 CarbonylContact C-O 3.54Å; G432-W541 WeakPolarHBondContact CA-O 3.05Å; S433-W541 PolarHBondContact N-O 3.05Å; S433-W541 PolarHBondContact O-N 3.29Å; S433-W541 VanDerWaalsContact O-N 3.13Å; V435-W541 HydrophobicContact CG2-CH2 3.95Å; V435-W541 HydrophobicContact CG2-CZ3 3.93Å; L448-W541 HydrophobicContact CD2-CH2 3.66Å; L448-W541 HydrophobicContact CD2-CZ2 4.41Å; V489-W541 HydrophobicContact CG1-CH2 4.05Å; V489-W541 HydrophobicContact CG1-CZ2 4.15Å; C495-W541 HydrophobicContact CB-CZ2 4.04Å; C495-W541 PolarHBondContact O-NE1 3.02Å; A497-W541 HydrophobicContact CB-CD2 4.28Å; A497-W541 HydrophobicContact CB-CZ2 4.19Å
542	Q	75.5	Confident	64	Low	116 Å²	116	68.9 Å²	68.9	54%	0.542	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-57.6	139.1	171.2	-68	-64.1	-24.6	0	0	110.1	S433 I499 V544	S433-Q542 PolarHBondContact OG-O 2.96Å; S433-Q542 VanDerWaalsContact OG-O 3.06Å; I499-Q542 VanDerWaalsContact CD1-NE2 3.35Å; Q542-V544 PolarHBondContact O-N 3.04Å
543	P	78.7	Confident	63.7	Low	46 Å²	46	69.1 Å²	69.1	30%	0.299	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-50.9	130.8	173.9	-26.7	34.6	0	0	0	112	N391 P430 S433	N391-P543 WeakPolarHBondContact OD1-CA 3.21Å; P430-P543 HydrophobicContact CB-CB 3.97Å; P430-P543 HydrophobicContact CB-CG 3.99Å; P430-P543 HydrophobicContact CG-CB 4.1Å; P430-P543 HydrophobicContact CG-CG 4.11Å; S433-P543 VanDerWaalsContact OG-CA 3.24Å; S433-P543 WeakPolarHBondContact OG-CA 2.97Å
544	V	81.1	Confident	63.3	Low	59 Å²	59	72.4 Å²	72.4	36%	0.358	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-72.9	137.9	167.8	-66.4	0	0	0	0	108.6	L389 N391 S433 Q542 S546	L389-V544 HydrophobicContact CB-CG1 3.93Å; N391-V544 PolarHBondContact ND2-O 2.67Å; N391-V544 WeakPolarHBondContact OD1-CG2 3.3Å; N391-V544 PolarHBondContact OD1-N 3.47Å; S433-V544 PolarHBondContact OG-N 2.96Å; Q542-V544 PolarHBondContact O-N 3.04Å; V544-S546 PolarHBondContact O-N 3.22Å
545	N	62.4	Low	62.9	Low	157 Å²	157	73.9 Å²	73.9	84%	0.84	40%	0.4	S	S	*	.			trans	-64.8	98.8	177.1	-74.8	-27.4	0	0	0	109.3	T547	N545-T547 PolarHBondContact O-N 3.26Å; N545-T547 VanDerWaalsContact O-N 3.12Å
546	S	46.9	Very low	62.3	Low	65 Å²	65	77.7 Å²	77.7	46%	0.455	42%	0.416	S	S	.	.			trans	-78.2	95.3	171.5	53.4	0	0	0	0	109	V544 E548	V544-S546 PolarHBondContact O-N 3.22Å; S546-E548 PolarHBondContact O-N 2.94Å
547	T	32.6	Very low	61.6	Low	131 Å²	131	79.6 Å²	79.6	80%	0.804	43%	0.427	S	S	*	.			trans	-73.8	60.2	164.2	47.9	0	0	0	0	109.9	N545	N545-T547 PolarHBondContact O-N 3.26Å; N545-T547 VanDerWaalsContact O-N 3.12Å
548	E	32.9	Very low	60.1	Low	169 Å²	169	84.1 Å²	84.1	79%	0.79	45%	0.45	S	S	*	.	S	Bend	trans	-174	102.7	164.7	-108.6	160	-164.3	0	0	112.8	S546	S546-E548 PolarHBondContact O-N 2.94Å
549	S	30.3	Very low	58.2	Low	95 Å²	95	90.5 Å²	90.5	66%	0.664	48%	0.484	S	S	*	.			trans	37.4	93.5	151.2	60.7	0	0	0	0	120.4	K551	S549-K551 VanDerWaalsContact C-N 3.34Å; S549-K551 PolarHBondContact O-N 2.76Å
550	I	36.5	Very low	56.4	Low	90 Å²	90	97.2 Å²	97.2	46%	0.462	52%	0.521	S	S	.	.				-80.6	94.9	128.6	-59	177.6	0	0	0	105.7	F393 I427	F393-I550 HydrophobicContact CD1-CD1 3.62Å; F393-I550 HydrophobicContact CE1-CD1 3.44Å; F393-I550 VanDerWaalsContact CE1-CD1 3.44Å; F393-I550 HydrophobicContact CG-CD1 4.27Å; F393-I550 HydrophobicContact CZ-CD1 3.93Å; I427-I550 HydrophobicContact CD1-CG2 3.87Å
551	K	30.2	Very low	53.8	Low	237 Å²	237	105.9 Å²	105.9	100%	1.03	57%	0.567	S	S	*	*			trans	-117.9	0	163.1	-89.8	-168.2	178.7	-179.5	0	109.1	S549	S549-K551 VanDerWaalsContact C-N 3.34Å; S549-K551 PolarHBondContact O-N 2.76Å

Retrieved 551 of 551 residues in 143.4 ms (Link to these results)

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