A0A087XQD4_POEFO Loading...

HORMA domain containing 1

AlphaFold DB , UniProt , Accession A0A087XQD4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 372 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	34.1	Very low	243 Å²	243	165.7 Å²	165.7	100%	1.197	87%	0.87	S	S	*	*				0	108.3	0	-69.5	-150.8	-112.8	0	0	107.8
2	A	34.5	Very low	34.3	Very low	105 Å²	105	159.1 Å²	159.1	87%	0.868	86%	0.857	S	S	*	*			trans	-103.2	120.7	178.7	0	0	0	0	0	108.2	A4	A2-A4 PolarHBondContact O-N 3.18Å
3	Y	35.7	Very low	35.1	Very low	229 Å²	229	153.7 Å²	153.7	90%	0.898	85%	0.848	S	S	*	*			trans	-76.3	116.4	173.4	-97.2	-96	0	0	0	108.7	Q5	Y3-Q5 PolarHBondContact O-N 2.95Å
4	A	36.5	Very low	36.6	Very low	94 Å²	94	150.6 Å²	150.6	78%	0.777	82%	0.824	S	S	*	*			trans	-73	112.3	170.2	0	0	0	0	0	109.2	A2 Q6	A2-A4 PolarHBondContact O-N 3.18Å; A4-Q6 PolarHBondContact O-N 2.78Å
5	Q	37.6	Very low	38.5	Very low	187 Å²	187	141.6 Å²	141.6	87%	0.874	78%	0.777	S	S	*	*			trans	-68.3	108.4	164.7	-91.9	174.3	-28.5	0	0	108.5	Y3 V7	Y3-Q5 PolarHBondContact O-N 2.95Å; Q5-V7 PolarHBondContact O-N 2.77Å
6	Q	35.3	Very low	40.1	Very low	188 Å²	188	133.2 Å²	133.2	88%	0.879	73%	0.731	S	S	*	*			trans	-70.2	107.5	162.9	-79.1	-177	-16.4	0	0	108.5	A4 R8	A4-Q6 PolarHBondContact O-N 2.78Å; Q6-R8 PolarHBondContact O-N 3.03Å
7	V	32.9	Very low	41.9	Very low	132 Å²	132	127.4 Å²	127.4	80%	0.8	70%	0.702	S	S	*	*			trans	-67.2	111.7	167.1	179.3	0	0	0	0	107.4	Q5	Q5-V7 PolarHBondContact O-N 2.77Å
8	R	29.1	Very low	43.2	Very low	228 Å²	228	125.1 Å²	125.1	86%	0.86	69%	0.688	S	S	*	*			trans	-65.8	127.8	165	-75.9	179.4	179.4	171.1	-0.4	107.7	Q6 S10	Q6-R8 PolarHBondContact O-N 3.03Å; R8-S10 PolarHBondContact O-N 3.33Å
9	P	29.5	Very low	44.7	Very low	118 Å²	118	126.8 Å²	126.8	77%	0.766	69%	0.691	S	S	*	*			trans	-70	107	168.1	27.6	-29.3	0	0	0	107.8	Q11	P9-Q11 VanDerWaalsContact C-N 3.34Å; P9-Q11 PolarHBondContact O-N 3.13Å
10	S	33.4	Very low	46.4	Very low	111 Å²	111	121.1 Å²	121.1	78%	0.776	66%	0.66	S	S	*	*			trans	-65.6	96.7	163.2	50.4	0	0	0	0	107.4	R8 A12	R8-S10 PolarHBondContact O-N 3.33Å; S10-A12 PolarHBondContact O-N 3.32Å
11	Q	34.9	Very low	47.9	Very low	188 Å²	188	118.7 Å²	118.7	88%	0.879	66%	0.656	S	S	*	*			trans	-66.7	88.3	163.2	-80.1	-178.7	-22.6	0	0	107.2	P9 A13	P9-Q11 VanDerWaalsContact C-N 3.34Å; P9-Q11 PolarHBondContact O-N 3.13Å; Q11-A13 PolarHBondContact O-N 2.98Å
12	A	36.5	Very low	50.4	Low	86 Å²	86	108.6 Å²	108.6	71%	0.711	61%	0.61	S	S	*	*			trans	-61.7	107.8	162.7	0	0	0	0	0	106.2	S10 Q14	S10-A12 PolarHBondContact O-N 3.32Å; A12-Q14 PolarHBondContact O-N 3.32Å
13	A	44.9	Very low	53	Low	89 Å²	89	107.1 Å²	107.1	74%	0.736	59%	0.585	S	S	*	*			trans	-59.2	103.2	176.6	0	0	0	0	0	108.2	Q11 A15	Q11-A13 PolarHBondContact O-N 2.98Å; A13-A15 PolarHBondContact O-N 2.8Å
14	Q	55.7	Low	55.6	Low	111 Å²	111	102.6 Å²	102.6	52%	0.519	57%	0.572	S	S	.	*			trans	-59.8	128.7	176.2	-75	178.8	-16.3	0	0	108.7	A12 L16 R32	A12-Q14 PolarHBondContact O-N 3.32Å; Q14-L16 PolarHBondContact O-N 2.94Å; Q14-R32 PolarHBondContact O-NH1 2.8Å
15	A	64.3	Low	58.2	Low	15 Å²	15	101.8 Å²	101.8	12%	0.124	55%	0.552	C	S	.	*	S	Bend	trans	-61.2	-33.2	-176.5	0	0	0	0	0	112	A13 R32 V58	A13-A15 PolarHBondContact O-N 2.8Å; A15-R32 WeakPolarHBondContact O-CD 3.46Å; A15-R32 PolarHBondContact O-NH1 3.23Å; A15-V58 HydrophobicContact CB-CG2 3.81Å
16	L	65.1	Low	60.7	Low	7 Å²	7	92.9 Å²	92.9	4%	0.037	51%	0.51	C	S	.	.	S	Bend	trans	-139.1	136.1	177.8	-62.9	171.3	0	0	0	110.2	Q14 R32 V58	Q14-L16 PolarHBondContact O-N 2.94Å; L16-R32 HydrophobicContact CD2-CB 4.16Å; L16-V58 HydrophobicContact CD1-CG1 4.03Å
17	P	70.9	Confident	63.4	Low	35 Å²	35	85.2 Å²	85.2	23%	0.227	48%	0.475	C	S	.	.			trans	-71.2	150.3	177.5	30	-35.6	0	0	0	112.7	V20 V29	P17-V20 HydrophobicContact CG-CG2 4.33Å; P17-V29 HydrophobicContact CG-CG2 3.39Å
18	D	64.1	Low	66.3	Low	86 Å²	86	81.3 Å²	81.3	46%	0.46	45%	0.45	S	S	.	.	S	Bend	trans	-71.9	-40.8	175.6	-84	-49.4	0	0	0	113.1	R148	D18-R148 VanDerWaalsContact CG-NH1 3.34Å; D18-R148 WeakPolarHBondContact OD1-CD 3.39Å; D18-R148 IonicContact OD1-CZ 3.34Å; D18-R148 IonicContact OD1-NE 3.88Å; D18-R148 PolarHBondContact OD1-NE 3.23Å; D18-R148 IonicContact OD1-NH1 3.27Å; D18-R148 PolarHBondContact OD1-NH1 2.72Å; D18-R148 IonicContact OD2-CZ 3.99Å; D18-R148 IonicContact OD2-NH1 2.9Å; D18-R148 PolarHBondContact OD2-NH1 2.89Å
19	E	72	Confident	69.2	Low	157 Å²	157	70.6 Å²	70.6	73%	0.734	41%	0.409	S	S	*	.			trans	-126	141.3	-177.7	-165	172.5	-167.1	0	0	110.2
20	V	79.3	Confident	72.3	Confident	13 Å²	13	65.2 Å²	65.2	8%	0.079	37%	0.374	C	S	.	.			trans	-122.2	100.2	-179.2	-178.1	0	0	0	0	107.7	P17 Q25 V29 T147 T218	P17-V20 HydrophobicContact CG-CG2 4.33Å; V20-Q25 HydrophobicContact CG1-CB 4.08Å; V20-V29 HydrophobicContact CG2-CG2 3.89Å; V20-T147 HydrophobicContact CG2-CG2 4.39Å; V20-T218 HydrophobicContact CG1-CG2 4.37Å; V20-T218 HydrophobicContact CG2-CG2 4.28Å
21	A	78.2	Confident	75.2	Confident	71 Å²	71	60.2 Å²	60.2	59%	0.587	34%	0.338	S	S	*	.			trans	-100	-33.3	-176.6	0	0	0	0	0	112.5	Y220	A21-Y220 PolarHBondContact O-OH 2.71Å; A21-Y220 VanDerWaalsContact O-OH 3.08Å
22	S	87.9	Confident	78	Confident	31 Å²	31	52.9 Å²	52.9	22%	0.217	30%	0.303	C	S	.	.	S	Bend	trans	-109.6	159.4	-179.1	88.2	0	0	0	0	113.5	E24 Q25 S26 Y220	S22-E24 VanDerWaalsContact C-N 3.26Å; S22-E24 VanDerWaalsContact CB-OE2 3.3Å; S22-E24 WeakPolarHBondContact CB-OE2 3.24Å; S22-E24 PolarHBondContact O-N 3.14Å; S22-E24 PolarHBondContact OG-N 3.17Å; S22-E24 PolarHBondContact OG-OE2 2.93Å; S22-Q25 PolarHBondContact O-N 3.3Å; S22-Q25 PolarHBondContact OG-N 3.11Å; S22-S26 PolarHBondContact O-N 2.89Å; S22-Y220 WeakPolarHBondContact O-CE2 3.25Å
23	E	89.4	Confident	80.7	Confident	73 Å²	73	49 Å²	49	34%	0.341	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-37.1	172.9	-173	177	169.1	0	0	111.4	S26 L27 K92 Y220	E23-S26 WeakPolarHBondContact O-CB 3.43Å; E23-S26 PolarHBondContact O-N 3.05Å; E23-L27 WeakPolarHBondContact O-CB 3.22Å; E23-L27 PolarHBondContact O-N 3.06Å; E23-K92 WeakPolarHBondContact OE1-CE 3.31Å; E23-K92 IonicContact OE1-NZ 2.65Å; E23-K92 PolarHBondContact OE1-NZ 3.37Å; E23-K92 IonicContact OE2-NZ 3.64Å; E23-Y220 HydrophobicContact CB-CD1 3.71Å; E23-Y220 HydrophobicContact CB-CD2 4.19Å; E23-Y220 HydrophobicContact CB-CE1 3.91Å; E23-Y220 HydrophobicContact CB-CE2 4.39Å; E23-Y220 HydrophobicContact CB-CG 3.85Å; E23-Y220 HydrophobicContact CG-CD1 3.95Å; E23-Y220 HydrophobicContact CG-CG 3.99Å; E23-Y220 VanDerWaalsContact N-CE2 3.28Å
24	E	90.4	Very high	83.2	Confident	134 Å²	134	45.1 Å²	45.1	63%	0.626	24%	0.237	S	C	*	.	H	α-helix	trans	-65.9	-41.3	177.7	-53.2	104.8	170.1	0	0	111.7	S22 S26 L27 I28	S22-E24 VanDerWaalsContact C-N 3.26Å; S22-E24 VanDerWaalsContact CB-OE2 3.3Å; S22-E24 WeakPolarHBondContact CB-OE2 3.24Å; S22-E24 PolarHBondContact O-N 3.14Å; S22-E24 PolarHBondContact OG-N 3.17Å; S22-E24 PolarHBondContact OG-OE2 2.93Å; E24-S26 VanDerWaalsContact C-N 3.3Å; E24-S26 PolarHBondContact O-N 3.39Å; E24-L27 WeakPolarHBondContact O-CB 3.1Å; E24-L27 PolarHBondContact O-N 2.81Å; E24-I28 VanDerWaalsContact O-CG1 3.31Å; E24-I28 WeakPolarHBondContact O-CG1 3.23Å; E24-I28 PolarHBondContact O-N 2.98Å
25	Q	89.9	Confident	85.1	Confident	78 Å²	78	39.9 Å²	39.9	36%	0.364	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-41.9	175.5	-71.2	177.2	-27.7	0	0	111.3	V20 S22 I28 V29	V20-Q25 HydrophobicContact CG1-CB 4.08Å; S22-Q25 PolarHBondContact O-N 3.3Å; S22-Q25 PolarHBondContact OG-N 3.11Å; Q25-I28 PolarHBondContact O-N 2.72Å; Q25-V29 WeakPolarHBondContact O-CG2 3.32Å; Q25-V29 PolarHBondContact O-N 3.23Å
26	S	91.4	Very high	86.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-44	176	172	0	0	0	0	111.7	S22 E23 E24 I28 V29 V30 T218 H221	S22-S26 PolarHBondContact O-N 2.89Å; E23-S26 WeakPolarHBondContact O-CB 3.43Å; E23-S26 PolarHBondContact O-N 3.05Å; E24-S26 VanDerWaalsContact C-N 3.3Å; E24-S26 PolarHBondContact O-N 3.39Å; S26-I28 PolarHBondContact O-N 2.79Å; S26-V29 WeakPolarHBondContact O-CB 3.49Å; S26-V29 PolarHBondContact O-N 3.19Å; S26-V30 WeakPolarHBondContact O-CG2 3.43Å; S26-V30 PolarHBondContact O-N 3.37Å; S26-T218 WeakPolarHBondContact OG-CB 3.13Å; S26-T218 PolarHBondContact OG-OG1 3.1Å; S26-H221 PolarHBondContact OG-ND1 2.52Å
27	L	92.6	Very high	88	Confident	26 Å²	26	38.9 Å²	38.9	14%	0.136	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-44.1	174.9	-179.7	62.3	0	0	0	111.9	E23 E24 V29 V30 K31 I89 Q90	E23-L27 WeakPolarHBondContact O-CB 3.22Å; E23-L27 PolarHBondContact O-N 3.06Å; E24-L27 WeakPolarHBondContact O-CB 3.1Å; E24-L27 PolarHBondContact O-N 2.81Å; L27-V29 VanDerWaalsContact C-N 3.35Å; L27-V29 PolarHBondContact O-N 2.92Å; L27-V30 PolarHBondContact O-N 2.75Å; L27-K31 HydrophobicContact CD1-CD 4.4Å; L27-K31 HydrophobicContact CD1-CG 4.31Å; L27-K31 HydrophobicContact CG-CD 4.25Å; L27-K31 WeakPolarHBondContact O-CG 3.3Å; L27-K31 PolarHBondContact O-N 2.95Å; L27-I89 HydrophobicContact CD1-CB 4.39Å; L27-I89 HydrophobicContact CD1-CG2 3.49Å; L27-I89 VanDerWaalsContact CD1-CG2 3.49Å; L27-Q90 HydrophobicContact CD2-CB 4.06Å; L27-Q90 HydrophobicContact CD2-CG 3.91Å
28	I	92.1	Very high	89.2	Confident	51 Å²	51	37.2 Å²	37.2	26%	0.262	19%	0.194	S	C	.	.	H	α-helix	trans	-61.3	-43.8	177.1	-68.4	164.2	0	0	0	110.6	E24 Q25 S26 V30 K31 R32	E24-I28 VanDerWaalsContact O-CG1 3.31Å; E24-I28 WeakPolarHBondContact O-CG1 3.23Å; E24-I28 PolarHBondContact O-N 2.98Å; Q25-I28 PolarHBondContact O-N 2.72Å; S26-I28 PolarHBondContact O-N 2.79Å; I28-V30 PolarHBondContact O-N 3.24Å; I28-K31 PolarHBondContact O-N 2.93Å; I28-R32 HydrophobicContact CG2-CG 4.23Å; I28-R32 WeakPolarHBondContact O-CB 3.42Å; I28-R32 VanDerWaalsContact O-CG 3.26Å; I28-R32 WeakPolarHBondContact O-CG 3.21Å; I28-R32 PolarHBondContact O-N 2.74Å
29	V	91.6	Very high	90.7	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-49.3	176.5	170.9	0	0	0	0	110.9	P17 V20 Q25 S26 L27 R32 L33 T147 T218	P17-V29 HydrophobicContact CG-CG2 3.39Å; V20-V29 HydrophobicContact CG2-CG2 3.89Å; Q25-V29 WeakPolarHBondContact O-CG2 3.32Å; Q25-V29 PolarHBondContact O-N 3.23Å; S26-V29 WeakPolarHBondContact O-CB 3.49Å; S26-V29 PolarHBondContact O-N 3.19Å; L27-V29 VanDerWaalsContact C-N 3.35Å; L27-V29 PolarHBondContact O-N 2.92Å; V29-R32 PolarHBondContact O-N 2.82Å; V29-L33 VanDerWaalsContact O-CB 3.31Å; V29-L33 WeakPolarHBondContact O-CB 3.31Å; V29-L33 PolarHBondContact O-N 3.32Å; V29-T147 HydrophobicContact CG1-CG2 4.08Å; V29-T218 HydrophobicContact CB-CG2 4.44Å; V29-T218 HydrophobicContact CG1-CG2 4.12Å
30	V	93.9	Very high	91.8	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-46.8	-179.4	171	0	0	0	0	111.7	S26 L27 I28 R32 L33 L34 I89 I119 H221 V223	S26-V30 WeakPolarHBondContact O-CG2 3.43Å; S26-V30 PolarHBondContact O-N 3.37Å; L27-V30 PolarHBondContact O-N 2.75Å; I28-V30 PolarHBondContact O-N 3.24Å; V30-R32 PolarHBondContact O-N 3.13Å; V30-L33 PolarHBondContact O-N 2.96Å; V30-L34 WeakPolarHBondContact O-CB 3.46Å; V30-L34 PolarHBondContact O-N 2.88Å; V30-I89 HydrophobicContact CG1-CD1 4.31Å; V30-I89 HydrophobicContact CG1-CG2 4.11Å; V30-I119 HydrophobicContact CG1-CD1 4.46Å; V30-H221 HydrophobicContact CG2-CB 3.53Å; V30-V223 HydrophobicContact CB-CG2 4.21Å; V30-V223 HydrophobicContact CG1-CG2 3.67Å; V30-V223 HydrophobicContact CG2-CG2 3.74Å
31	K	94.9	Very high	92.6	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-45.3	178.2	-71.4	-177.7	177.9	178.9	0	111.3	L27 I28 L34 A35 F86 A303	L27-K31 HydrophobicContact CD1-CD 4.4Å; L27-K31 HydrophobicContact CD1-CG 4.31Å; L27-K31 HydrophobicContact CG-CD 4.25Å; L27-K31 WeakPolarHBondContact O-CG 3.3Å; L27-K31 PolarHBondContact O-N 2.95Å; I28-K31 PolarHBondContact O-N 2.93Å; K31-L34 PolarHBondContact O-N 3.33Å; K31-A35 WeakPolarHBondContact O-CB 3.16Å; K31-A35 PolarHBondContact O-N 3.37Å; K31-F86 HydrophobicContact CB-CD1 3.84Å; K31-F86 HydrophobicContact CB-CE1 3.7Å; K31-F86 HydrophobicContact CB-CG 4.45Å; K31-F86 HydrophobicContact CB-CZ 4.22Å; K31-F86 HydrophobicContact CD-CB 4.08Å; K31-F86 HydrophobicContact CD-CD1 4.1Å; K31-F86 HydrophobicContact CD-CG 4.01Å; K31-F86 HydrophobicContact CG-CB 4.4Å; K31-F86 HydrophobicContact CG-CD1 3.58Å; K31-F86 HydrophobicContact CG-CE1 4Å; K31-F86 HydrophobicContact CG-CG 4.03Å; K31-F86 WeakPolarHBondContact O-CE1 3.48Å; K31-A303 HydrophobicContact CB-CB 4.2Å
32	R	93.1	Very high	93.4	Very high	35 Å²	35	21.8 Å²	21.8	13%	0.132	11%	0.106	C	C	.	.	H	α-helix	trans	-65.8	-42.8	178.2	-72.3	-175.6	-180	-178.4	-0.1	112.3	Q14 A15 L16 I28 V29 V30 L34 A35 I36 I300 A303	Q14-R32 PolarHBondContact O-NH1 2.8Å; A15-R32 WeakPolarHBondContact O-CD 3.46Å; A15-R32 PolarHBondContact O-NH1 3.23Å; L16-R32 HydrophobicContact CD2-CB 4.16Å; I28-R32 HydrophobicContact CG2-CG 4.23Å; I28-R32 WeakPolarHBondContact O-CB 3.42Å; I28-R32 VanDerWaalsContact O-CG 3.26Å; I28-R32 WeakPolarHBondContact O-CG 3.21Å; I28-R32 PolarHBondContact O-N 2.74Å; V29-R32 PolarHBondContact O-N 2.82Å; V30-R32 PolarHBondContact O-N 3.13Å; R32-L34 VanDerWaalsContact C-N 3.34Å; R32-L34 PolarHBondContact O-N 2.98Å; R32-A35 PolarHBondContact O-N 3.29Å; R32-I36 WeakPolarHBondContact O-CB 3.46Å; R32-I36 VanDerWaalsContact O-CG1 3.25Å; R32-I36 WeakPolarHBondContact O-CG1 3.35Å; R32-I36 PolarHBondContact O-N 3.13Å; R32-I300 HydrophobicContact CG-CG2 4.46Å; R32-A303 HydrophobicContact CG-CB 4.33Å
33	L	94.2	Very high	93.8	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-44	178.4	-173.4	64.5	0	0	0	111.2	V29 V30 I36 A37 L154 V155 V216	V29-L33 VanDerWaalsContact O-CB 3.31Å; V29-L33 WeakPolarHBondContact O-CB 3.31Å; V29-L33 PolarHBondContact O-N 3.32Å; V30-L33 PolarHBondContact O-N 2.96Å; L33-I36 PolarHBondContact O-N 3.46Å; L33-A37 VanDerWaalsContact O-CB 3.3Å; L33-A37 WeakPolarHBondContact O-CB 3.39Å; L33-A37 PolarHBondContact O-N 2.85Å; L33-L154 HydrophobicContact CD1-CD2 4.32Å; L33-V155 HydrophobicContact CD1-CG2 4.31Å; L33-V216 HydrophobicContact CD2-CB 3.85Å; L33-V216 HydrophobicContact CD2-CG1 4.18Å; L33-V216 HydrophobicContact CD2-CG2 3.75Å
34	L	96.5	Very high	94	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-44.5	175.2	-173.2	65	0	0	0	111.5	V30 K31 R32 A37 V38 M82 C85 F86 I89 F117	V30-L34 WeakPolarHBondContact O-CB 3.46Å; V30-L34 PolarHBondContact O-N 2.88Å; K31-L34 PolarHBondContact O-N 3.33Å; R32-L34 VanDerWaalsContact C-N 3.34Å; R32-L34 PolarHBondContact O-N 2.98Å; L34-A37 PolarHBondContact O-N 3.42Å; L34-V38 HydrophobicContact CD1-CG2 4.28Å; L34-V38 HydrophobicContact CG-CG2 4.48Å; L34-V38 WeakPolarHBondContact O-CB 3.26Å; L34-V38 WeakPolarHBondContact O-CG2 3.1Å; L34-V38 PolarHBondContact O-N 3.08Å; L34-M82 HydrophobicContact CB-CE 4.24Å; L34-M82 HydrophobicContact CD2-CE 3.96Å; L34-M82 HydrophobicContact CG-CE 3.78Å; L34-M82 HydrophobicContact CG-SD 4.4Å; L34-C85 HydrophobicContact CD2-CB 3.88Å; L34-F86 HydrophobicContact CD2-CE1 4.39Å; L34-I89 HydrophobicContact CD2-CD1 3.96Å; L34-F117 HydrophobicContact CD1-CB 3.84Å; L34-F117 HydrophobicContact CD1-CD1 3.75Å; L34-F117 HydrophobicContact CD1-CD2 3.4Å; L34-F117 VanDerWaalsContact CD1-CD2 3.4Å; L34-F117 HydrophobicContact CD1-CE1 4.14Å; L34-F117 HydrophobicContact CD1-CE2 3.83Å; L34-F117 HydrophobicContact CD1-CG 3.36Å; L34-F117 HydrophobicContact CD1-CZ 4.18Å
35	A	95.4	Very high	94.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.1	-45.4	177.9	0	0	0	0	0	112.7	K31 R32 S39 M82 F86 M299	K31-A35 WeakPolarHBondContact O-CB 3.16Å; K31-A35 PolarHBondContact O-N 3.37Å; R32-A35 PolarHBondContact O-N 3.29Å; A35-S39 VanDerWaalsContact O-CB 3.26Å; A35-S39 WeakPolarHBondContact O-CB 3.17Å; A35-S39 PolarHBondContact O-N 3.24Å; A35-S39 PolarHBondContact O-OG 2.65Å; A35-M82 HydrophobicContact CB-CE 4.1Å; A35-F86 HydrophobicContact CB-CZ 4.21Å; A35-M299 HydrophobicContact CB-CG 4.27Å; A35-M299 HydrophobicContact CB-SD 3.88Å
36	I	94.5	Very high	94.3	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-63.9	-44.5	177.6	-68.6	164.2	0	0	0	110.1	R32 L33 G40 V58 V63 I65 V155 I300	R32-I36 WeakPolarHBondContact O-CB 3.46Å; R32-I36 VanDerWaalsContact O-CG1 3.25Å; R32-I36 WeakPolarHBondContact O-CG1 3.35Å; R32-I36 PolarHBondContact O-N 3.13Å; L33-I36 PolarHBondContact O-N 3.46Å; I36-G40 PolarHBondContact O-N 3.13Å; I36-V58 HydrophobicContact CD1-CG2 4.23Å; I36-V63 HydrophobicContact CG2-CB 4.49Å; I36-V63 HydrophobicContact CG2-CG1 4.37Å; I36-I65 HydrophobicContact CG1-CD1 3.99Å; I36-V155 HydrophobicContact CG2-CG1 4.43Å; I36-V155 HydrophobicContact CG2-CG2 3.9Å; I36-I300 HydrophobicContact CG1-CD1 4.12Å
37	A	95.7	Very high	94.4	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	10%	0.101	C	C	.	.	H	α-helix	trans	-66.1	-47.7	-179.1	0	0	0	0	0	111.8	L33 L34 S39 G40 I41 F117 L158	L33-A37 VanDerWaalsContact O-CB 3.3Å; L33-A37 WeakPolarHBondContact O-CB 3.39Å; L33-A37 PolarHBondContact O-N 2.85Å; L34-A37 PolarHBondContact O-N 3.42Å; A37-S39 PolarHBondContact O-N 2.94Å; A37-G40 PolarHBondContact O-N 3.41Å; A37-I41 WeakPolarHBondContact O-CD1 2.94Å; A37-I41 WeakPolarHBondContact O-CG1 2.86Å; A37-I41 PolarHBondContact O-N 3.45Å; A37-F117 HydrophobicContact CB-CE1 3.49Å; A37-F117 VanDerWaalsContact CB-CE1 3.49Å; A37-F117 HydrophobicContact CB-CZ 3.53Å; A37-L158 HydrophobicContact CB-CD2 4.24Å
38	V	96.7	Very high	94.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.3	-45.5	177	170.6	0	0	0	0	110.9	L34 G40 I41 T42 I78 M82 M99 F117 M176	L34-V38 HydrophobicContact CD1-CG2 4.28Å; L34-V38 HydrophobicContact CG-CG2 4.48Å; L34-V38 WeakPolarHBondContact O-CB 3.26Å; L34-V38 WeakPolarHBondContact O-CG2 3.1Å; L34-V38 PolarHBondContact O-N 3.08Å; V38-G40 VanDerWaalsContact C-N 3.35Å; V38-G40 PolarHBondContact O-N 3.17Å; V38-I41 PolarHBondContact O-N 3.37Å; V38-T42 WeakPolarHBondContact O-CG2 3.33Å; V38-T42 PolarHBondContact O-N 3.27Å; V38-T42 PolarHBondContact O-OG1 2.99Å; V38-I78 HydrophobicContact CG1-CG2 3.89Å; V38-M82 HydrophobicContact CB-SD 4.02Å; V38-M82 HydrophobicContact CG1-SD 4.07Å; V38-M82 HydrophobicContact CG2-SD 3.84Å; V38-M99 HydrophobicContact CG1-SD 4.1Å; V38-F117 HydrophobicContact CG2-CE2 4.23Å; V38-M176 HydrophobicContact CG2-CE 4.43Å
39	S	96.1	Very high	94.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.6	-42.7	176.2	-60.1	0	0	0	0	112.3	A35 A37 T42 Y43 M64 L66	A35-S39 VanDerWaalsContact O-CB 3.26Å; A35-S39 WeakPolarHBondContact O-CB 3.17Å; A35-S39 PolarHBondContact O-N 3.24Å; A35-S39 PolarHBondContact O-OG 2.65Å; A37-S39 PolarHBondContact O-N 2.94Å; S39-T42 PolarHBondContact O-N 2.88Å; S39-T42 PolarHBondContact O-OG1 3.08Å; S39-Y43 VanDerWaalsContact O-CB 3.26Å; S39-Y43 WeakPolarHBondContact O-CB 3.43Å; S39-Y43 PolarHBondContact O-N 3.36Å; S39-M64 WeakPolarHBondContact CB-O 3.39Å; S39-L66 PolarHBondContact OG-N 3.13Å; S39-L66 VanDerWaalsContact OG-N 3.08Å
40	G	95	Very high	94.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-45.4	177.3	0	0	0	0	0	111.8	I36 A37 V38 Y43 L44	I36-G40 PolarHBondContact O-N 3.13Å; A37-G40 PolarHBondContact O-N 3.41Å; V38-G40 VanDerWaalsContact C-N 3.35Å; V38-G40 PolarHBondContact O-N 3.17Å; G40-Y43 PolarHBondContact O-N 3.17Å; G40-L44 VanDerWaalsContact O-CB 3.26Å; G40-L44 WeakPolarHBondContact O-CB 3.47Å; G40-L44 WeakPolarHBondContact O-CD1 3.21Å; G40-L44 WeakPolarHBondContact O-CG 3.19Å; G40-L44 PolarHBondContact O-N 2.97Å
41	I	95.7	Very high	94.4	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-51.9	176.7	-68	158.5	0	0	0	110.6	A37 V38 Y43 L44 R45 M99 Y115 F117 L158 F225	A37-I41 WeakPolarHBondContact O-CD1 2.94Å; A37-I41 WeakPolarHBondContact O-CG1 2.86Å; A37-I41 PolarHBondContact O-N 3.45Å; V38-I41 PolarHBondContact O-N 3.37Å; I41-Y43 PolarHBondContact O-N 3.46Å; I41-L44 PolarHBondContact O-N 3.42Å; I41-R45 HydrophobicContact CG2-CG 4.17Å; I41-R45 VanDerWaalsContact O-CB 3.28Å; I41-R45 WeakPolarHBondContact O-CB 3.35Å; I41-R45 VanDerWaalsContact O-CG 3.3Å; I41-R45 WeakPolarHBondContact O-CG 3.23Å; I41-R45 PolarHBondContact O-N 2.97Å; I41-M99 HydrophobicContact CB-CE 3.71Å; I41-M99 HydrophobicContact CD1-CE 3.83Å; I41-M99 HydrophobicContact CG1-CE 4.37Å; I41-M99 HydrophobicContact CG2-CE 3.27Å; I41-Y115 HydrophobicContact CD1-CD1 3.76Å; I41-Y115 HydrophobicContact CD1-CD2 4.14Å; I41-Y115 HydrophobicContact CD1-CE1 4.28Å; I41-Y115 HydrophobicContact CD1-CG 3.65Å; I41-Y115 HydrophobicContact CG1-CD1 4.16Å; I41-Y115 HydrophobicContact CG1-CE1 4.18Å; I41-Y115 HydrophobicContact CG1-CG 4.36Å; I41-Y115 HydrophobicContact CG2-CD1 4.48Å; I41-Y115 HydrophobicContact CG2-CD2 3.75Å; I41-Y115 HydrophobicContact CG2-CE1 4.1Å; I41-Y115 HydrophobicContact CG2-CE2 3.27Å; I41-Y115 HydrophobicContact CG2-CG 4.29Å; I41-Y115 VanDerWaalsContact CG2-CZ 3.44Å; I41-F117 HydrophobicContact CD1-CE2 4.42Å; I41-F117 HydrophobicContact CD1-CZ 4.02Å; I41-L158 HydrophobicContact CD1-CD1 4.49Å; I41-L158 HydrophobicContact CG1-CD1 3.74Å; I41-L158 HydrophobicContact CG1-CD2 4.26Å; I41-F225 HydrophobicContact CD1-CZ 4.14Å
42	T	95.7	Very high	94.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-31	-177.5	59	0	0	0	0	112	V38 S39 G46 I47 F48 Y53 M99 L174	V38-T42 WeakPolarHBondContact O-CG2 3.33Å; V38-T42 PolarHBondContact O-N 3.27Å; V38-T42 PolarHBondContact O-OG1 2.99Å; S39-T42 PolarHBondContact O-N 2.88Å; S39-T42 PolarHBondContact O-OG1 3.08Å; T42-G46 PolarHBondContact O-N 3.43Å; T42-I47 WeakPolarHBondContact O-CB 3.44Å; T42-I47 PolarHBondContact O-N 2.87Å; T42-F48 HydrophobicContact CG2-CE2 4.17Å; T42-Y53 VanDerWaalsContact CB-OH 3.23Å; T42-Y53 WeakPolarHBondContact CB-OH 2.77Å; T42-Y53 PolarHBondContact O-OH 2.97Å; T42-Y53 VanDerWaalsContact O-OH 3.06Å; T42-Y53 PolarHBondContact OG1-OH 3.07Å; T42-M99 HydrophobicContact CG2-SD 4.43Å; T42-L174 HydrophobicContact CG2-CD2 4.41Å
43	Y	94.9	Very high	94.3	Very high	89 Å²	89	26.9 Å²	26.9	35%	0.349	15%	0.149	S	C	.	.	H	α-helix	trans	-71.8	-54.2	175.1	177.3	-101.3	0	0	0	111.7	S39 G40 I41 R45 G46 Y53 M64	S39-Y43 VanDerWaalsContact O-CB 3.26Å; S39-Y43 WeakPolarHBondContact O-CB 3.43Å; S39-Y43 PolarHBondContact O-N 3.36Å; G40-Y43 PolarHBondContact O-N 3.17Å; I41-Y43 PolarHBondContact O-N 3.46Å; Y43-R45 VanDerWaalsContact C-N 3.29Å; Y43-R45 PolarHBondContact O-N 3.29Å; Y43-G46 PolarHBondContact O-N 3.29Å; Y43-Y53 WeakPolarHBondContact CA-OH 3.5Å; Y43-Y53 HydrophobicContact CD2-CD1 4.25Å; Y43-Y53 AromaticContact CD2-CD2 3.67Å; Y43-Y53 HydrophobicContact CD2-CD2 3.67Å; Y43-Y53 HydrophobicContact CD2-CE1 4.46Å; Y43-Y53 AromaticContact CD2-CE2 3.87Å; Y43-Y53 HydrophobicContact CD2-CE2 3.87Å; Y43-Y53 AromaticContact CD2-CG 3.86Å; Y43-Y53 HydrophobicContact CD2-CG 3.86Å; Y43-Y53 HydrophobicContact CE2-CD2 4.43Å; Y43-Y53 PolarHBondContact N-OH 3.05Å; Y43-Y53 VanDerWaalsContact N-OH 3.08Å; Y43-M64 HydrophobicContact CD1-CB 3.77Å; Y43-M64 HydrophobicContact CD1-CG 3.43Å; Y43-M64 VanDerWaalsContact CD1-CG 3.43Å; Y43-M64 HydrophobicContact CD2-CB 3.8Å; Y43-M64 HydrophobicContact CD2-CE 4.38Å; Y43-M64 HydrophobicContact CD2-CG 3.78Å; Y43-M64 HydrophobicContact CE1-CB 4.26Å; Y43-M64 HydrophobicContact CE1-CG 3.42Å; Y43-M64 VanDerWaalsContact CE1-CG 3.42Å; Y43-M64 HydrophobicContact CE2-CB 4.27Å; Y43-M64 HydrophobicContact CE2-CE 3.9Å; Y43-M64 HydrophobicContact CE2-CG 3.75Å; Y43-M64 HydrophobicContact CG-CB 3.52Å; Y43-M64 HydrophobicContact CG-CG 3.62Å
44	L	93.6	Very high	94.2	Very high	44 Å²	44	26.9 Å²	26.9	23%	0.23	15%	0.15	C	C	.	.	H	α-helix	trans	-69.8	-28.3	-173.3	-66.7	164	0	0	0	112.5	G40 I41 G46 Y159 M162	G40-L44 VanDerWaalsContact O-CB 3.26Å; G40-L44 WeakPolarHBondContact O-CB 3.47Å; G40-L44 WeakPolarHBondContact O-CD1 3.21Å; G40-L44 WeakPolarHBondContact O-CG 3.19Å; G40-L44 PolarHBondContact O-N 2.97Å; I41-L44 PolarHBondContact O-N 3.42Å; L44-G46 VanDerWaalsContact C-N 3.26Å; L44-Y159 HydrophobicContact CD1-CD1 3.78Å; L44-Y159 HydrophobicContact CD1-CD2 3.79Å; L44-Y159 HydrophobicContact CD1-CE1 3.94Å; L44-Y159 HydrophobicContact CD1-CE2 3.95Å; L44-Y159 HydrophobicContact CD1-CG 3.71Å; L44-Y159 HydrophobicContact CD2-CD1 3.99Å; L44-Y159 HydrophobicContact CD2-CE1 4.09Å; L44-Y159 HydrophobicContact CG-CD1 4.38Å; L44-Y159 HydrophobicContact CG-CE1 4.29Å; L44-M162 HydrophobicContact CB-CB 3.7Å; L44-M162 HydrophobicContact CB-CG 3.86Å; L44-M162 HydrophobicContact CD1-CB 3.73Å; L44-M162 HydrophobicContact CD1-CG 3.63Å; L44-M162 HydrophobicContact CG-CB 4.21Å; L44-M162 HydrophobicContact CG-CG 4.37Å
45	R	94	Very high	94	Very high	18 Å²	18	28.4 Å²	28.4	7%	0.068	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	1.3	171.6	-59.7	-55.7	-75.4	149.3	-13	113.5	I41 Y43 I47 I101 E113 Y115 M162 G166 L168	I41-R45 HydrophobicContact CG2-CG 4.17Å; I41-R45 VanDerWaalsContact O-CB 3.28Å; I41-R45 WeakPolarHBondContact O-CB 3.35Å; I41-R45 VanDerWaalsContact O-CG 3.3Å; I41-R45 WeakPolarHBondContact O-CG 3.23Å; I41-R45 PolarHBondContact O-N 2.97Å; Y43-R45 VanDerWaalsContact C-N 3.29Å; Y43-R45 PolarHBondContact O-N 3.29Å; R45-I47 VanDerWaalsContact C-N 3.29Å; R45-I47 HydrophobicContact CB-CD1 4.18Å; R45-I47 HydrophobicContact CB-CG1 4.08Å; R45-I47 PolarHBondContact O-N 3.46Å; R45-I101 HydrophobicContact CG-CD1 4.5Å; R45-E113 IonicContact CZ-OE2 2.63Å; R45-E113 VanDerWaalsContact CZ-OE2 3.31Å; R45-E113 IonicContact NE-OE1 3.95Å; R45-E113 IonicContact NE-OE2 3.9Å; R45-E113 PolarHBondContact NE-OE2 2.85Å; R45-E113 IonicContact NH2-OE2 3.37Å; R45-E113 PolarHBondContact NH2-OE2 3.31Å; R45-Y115 WeakPolarHBondContact CD-OH 3.18Å; R45-Y115 VanDerWaalsContact CG-OH 3.31Å; R45-Y115 WeakPolarHBondContact CG-OH 3.35Å; R45-M162 HydrophobicContact CG-SD 4.09Å; R45-G166 PolarHBondContact NH1-O 3.17Å; R45-G166 PolarHBondContact NH2-O 3.32Å; R45-L168 HydrophobicContact CB-CD1 3.76Å; R45-L168 HydrophobicContact CB-CG 4.5Å
46	G	92.8	Very high	93.7	Very high	57 Å²	57	30.3 Å²	30.3	59%	0.588	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	67	26.1	176	0	0	0	0	0	114.4	T42 Y43 L44 F48	T42-G46 PolarHBondContact O-N 3.43Å; Y43-G46 PolarHBondContact O-N 3.29Å; L44-G46 VanDerWaalsContact C-N 3.26Å; G46-F48 VanDerWaalsContact C-N 3.32Å; G46-F48 PolarHBondContact O-N 3.05Å
47	I	93.9	Very high	93.2	Very high	40 Å²	40	37 Å²	37	21%	0.205	20%	0.195	C	C	.	.			trans	-66.5	-36.3	-176.7	-55.9	-59.5	0	0	0	111.5	T42 R45 I101 L168 V172	T42-I47 WeakPolarHBondContact O-CB 3.44Å; T42-I47 PolarHBondContact O-N 2.87Å; R45-I47 VanDerWaalsContact C-N 3.29Å; R45-I47 HydrophobicContact CB-CD1 4.18Å; R45-I47 HydrophobicContact CB-CG1 4.08Å; R45-I47 PolarHBondContact O-N 3.46Å; I47-I101 HydrophobicContact CD1-CD1 4.43Å; I47-L168 HydrophobicContact CD1-CD1 3.58Å; I47-V172 HydrophobicContact CD1-CG2 4.02Å
48	F	93.4	Very high	92.5	Very high	29 Å²	29	37.2 Å²	37.2	13%	0.127	20%	0.197	C	C	.	.	S	Bend	trans	-127.1	153	178.6	-56.4	-60.3	0	0	0	110.5	T42 G46 A52 Y53 L66 T75 I78	T42-F48 HydrophobicContact CG2-CE2 4.17Å; G46-F48 VanDerWaalsContact C-N 3.32Å; G46-F48 PolarHBondContact O-N 3.05Å; F48-A52 HydrophobicContact CB-CB 4.03Å; F48-Y53 HydrophobicContact CB-CE2 3.76Å; F48-Y53 WeakPolarHBondContact CD2-OH 3.29Å; F48-L66 HydrophobicContact CD2-CD1 3.81Å; F48-L66 HydrophobicContact CE2-CD1 4.42Å; F48-L66 HydrophobicContact CE2-CD2 4.43Å; F48-T75 HydrophobicContact CD1-CG2 4.18Å; F48-T75 HydrophobicContact CD2-CG2 4.28Å; F48-T75 HydrophobicContact CE1-CG2 4.49Å; F48-T75 HydrophobicContact CG-CG2 4.08Å; F48-I78 HydrophobicContact CE2-CG1 3.78Å; F48-I78 HydrophobicContact CZ-CG1 3.91Å
49	P	92.4	Very high	91.7	Very high	47 Å²	47	41.9 Å²	41.9	31%	0.305	22%	0.218	S	C	.	.			trans	-66	152.9	178.6	28.5	-36.4	0	0	0	111.6	R51 A52 Y53	P49-R51 HydrophobicContact CB-CG 4.22Å; P49-R51 HydrophobicContact CG-CG 4.04Å; P49-R51 PolarHBondContact O-N 3.35Å; P49-A52 VanDerWaalsContact O-CB 3.24Å; P49-A52 WeakPolarHBondContact O-CB 3.48Å; P49-A52 PolarHBondContact O-N 2.71Å; P49-Y53 WeakPolarHBondContact O-CD2 3.18Å
50	G	91.4	Very high	91	Very high	48 Å²	48	47 Å²	47	50%	0.495	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-54.7	-29	-177.2	0	0	0	0	0	115.3	A52 Y53	G50-A52 PolarHBondContact O-N 3.37Å; G50-Y53 PolarHBondContact O-N 2.94Å; G50-Y53 VanDerWaalsContact O-N 3.08Å
51	R	91.7	Very high	90.3	Very high	169 Å²	169	49.5 Å²	49.5	64%	0.638	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-61.3	-26.7	175.3	67.7	178.6	177.1	-87.8	0.1	113.7	P49 Y53	P49-R51 HydrophobicContact CB-CG 4.22Å; P49-R51 HydrophobicContact CG-CG 4.04Å; P49-R51 PolarHBondContact O-N 3.35Å; R51-Y53 PolarHBondContact O-N 2.71Å; R51-Y53 VanDerWaalsContact O-N 3.16Å
52	A	93.1	Very high	90.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-72.1	-0	176.8	0	0	0	0	0	112.8	F48 P49 G50 L66 K67 T75	F48-A52 HydrophobicContact CB-CB 4.03Å; P49-A52 VanDerWaalsContact O-CB 3.24Å; P49-A52 WeakPolarHBondContact O-CB 3.48Å; P49-A52 PolarHBondContact O-N 2.71Å; G50-A52 PolarHBondContact O-N 3.37Å; A52-L66 HydrophobicContact CB-CD1 4.33Å; A52-K67 WeakPolarHBondContact O-CB 3.5Å; A52-K67 PolarHBondContact O-N 2.78Å; A52-T75 HydrophobicContact CB-CG2 3.89Å
53	Y	93.9	Very high	89.9	Confident	8 Å²	8	54.3 Å²	54.3	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.5	-175.8	-59.3	-92.3	0	0	0	112.8	T42 Y43 F48 P49 G50 R51 M64 I65 L66 K67	T42-Y53 VanDerWaalsContact CB-OH 3.23Å; T42-Y53 WeakPolarHBondContact CB-OH 2.77Å; T42-Y53 PolarHBondContact O-OH 2.97Å; T42-Y53 VanDerWaalsContact O-OH 3.06Å; T42-Y53 PolarHBondContact OG1-OH 3.07Å; Y43-Y53 WeakPolarHBondContact CA-OH 3.5Å; Y43-Y53 HydrophobicContact CD2-CD1 4.25Å; Y43-Y53 AromaticContact CD2-CD2 3.67Å; Y43-Y53 HydrophobicContact CD2-CD2 3.67Å; Y43-Y53 HydrophobicContact CD2-CE1 4.46Å; Y43-Y53 AromaticContact CD2-CE2 3.87Å; Y43-Y53 HydrophobicContact CD2-CE2 3.87Å; Y43-Y53 AromaticContact CD2-CG 3.86Å; Y43-Y53 HydrophobicContact CD2-CG 3.86Å; Y43-Y53 HydrophobicContact CE2-CD2 4.43Å; Y43-Y53 PolarHBondContact N-OH 3.05Å; Y43-Y53 VanDerWaalsContact N-OH 3.08Å; F48-Y53 HydrophobicContact CB-CE2 3.76Å; F48-Y53 WeakPolarHBondContact CD2-OH 3.29Å; P49-Y53 WeakPolarHBondContact O-CD2 3.18Å; G50-Y53 PolarHBondContact O-N 2.94Å; G50-Y53 VanDerWaalsContact O-N 3.08Å; R51-Y53 PolarHBondContact O-N 2.71Å; R51-Y53 VanDerWaalsContact O-N 3.16Å; Y53-M64 HydrophobicContact CD1-CB 4.17Å; Y53-M64 HydrophobicContact CG-CB 4.39Å; Y53-I65 CarbonylContact C-O 3.1Å; Y53-I65 VanDerWaalsContact CA-O 3.27Å; Y53-I65 WeakPolarHBondContact CA-O 3.33Å; Y53-L66 HydrophobicContact CD1-CB 4.18Å; Y53-L66 HydrophobicContact CD1-CD1 3.92Å; Y53-L66 HydrophobicContact CE1-CB 4.01Å; Y53-L66 HydrophobicContact CE1-CD1 3.39Å; Y53-L66 HydrophobicContact CE1-CG 4.32Å; Y53-L66 HydrophobicContact CE2-CD1 4.24Å; Y53-K67 WeakPolarHBondContact O-CE 3.31Å; Y53-K67 PolarHBondContact O-NZ 3Å
54	G	92.6	Very high	89.8	Confident	4 Å²	4	51.2 Å²	51.2	4%	0.041	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	150.6	162.2	0	0	0	0	0	110.1	M64 I65 K67	G54-M64 CarbonylContact O-C 3.49Å; G54-M64 WeakPolarHBondContact O-CA 3.39Å; G54-I65 PolarHBondContact N-O 3.09Å; G54-I65 PolarHBondContact O-N 2.93Å; G54-K67 VanDerWaalsContact N-CE 3.33Å
55	S	90.9	Very high	89.9	Confident	40 Å²	40	49.2 Å²	49.2	28%	0.28	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	131	172.2	59.9	0	0	0	0	110.9	V63	S55-V63 CarbonylContact C-O 3.49Å; S55-V63 WeakPolarHBondContact CA-O 3.48Å
56	K	89.8	Confident	89.9	Confident	40 Å²	40	48.4 Å²	48.4	17%	0.174	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	166	165.6	-68	-163.8	-168.3	-127.2	0	110.4	K62 V63 I65 E297 I300	K56-K62 CarbonylContact O-C 3.53Å; K56-K62 WeakPolarHBondContact O-CA 3.44Å; K56-V63 HydrophobicContact CB-CG2 4.02Å; K56-V63 PolarHBondContact N-O 3.48Å; K56-V63 WeakPolarHBondContact O-CG2 3.5Å; K56-V63 PolarHBondContact O-N 3.3Å; K56-I65 HydrophobicContact CB-CG1 4.14Å; K56-I65 HydrophobicContact CD-CG1 4.1Å; K56-I65 HydrophobicContact CG-CG1 3.89Å; K56-E297 VanDerWaalsContact CE-OE1 3.31Å; K56-E297 WeakPolarHBondContact CE-OE1 3.28Å; K56-E297 WeakPolarHBondContact CE-OE2 3.44Å; K56-E297 WeakPolarHBondContact CG-OE1 3.2Å; K56-E297 IonicContact NZ-OE2 2.81Å; K56-E297 PolarHBondContact NZ-OE2 3.09Å; K56-I300 HydrophobicContact CD-CD1 3.85Å
57	Y	85	Confident	89.7	Confident	141 Å²	141	48.2 Å²	48.2	55%	0.553	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.4	168.1	-76	-94.7	0	0	0	109.7	K62	Y57-K62 HydrophobicContact CD1-CB 4.4Å; Y57-K62 HydrophobicContact CE1-CB 3.95Å
58	V	80.2	Confident	88.6	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	95.2	164.6	-176.8	0	0	0	0	105	A15 L16 I36 D60 Q61 V63 I152	A15-V58 HydrophobicContact CB-CG2 3.81Å; L16-V58 HydrophobicContact CD1-CG1 4.03Å; I36-V58 HydrophobicContact CD1-CG2 4.23Å; V58-D60 PolarHBondContact O-N 2.93Å; V58-Q61 PolarHBondContact N-O 2.83Å; V58-Q61 PolarHBondContact O-N 2.91Å; V58-V63 HydrophobicContact CB-CG1 4.48Å; V58-V63 HydrophobicContact CG2-CG1 4.04Å; V58-V63 HydrophobicContact CG2-CG2 3.73Å; V58-I152 HydrophobicContact CG1-CG1 4.09Å
59	E	79.4	Confident	87.6	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.453	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-116	-162.5	-57.5	-78.9	-150.2	0	0	112.1	R148 I152	E59-R148 VanDerWaalsContact CD-CZ 3.4Å; E59-R148 IonicContact OE1-CZ 2.93Å; E59-R148 IonicContact OE1-NE 2.63Å; E59-R148 PolarHBondContact OE1-NE 2.87Å; E59-R148 IonicContact OE1-NH1 2.81Å; E59-R148 PolarHBondContact OE1-NH1 3.42Å; E59-R148 IonicContact OE1-NH2 2.61Å; E59-R148 PolarHBondContact OE1-NH2 3.43Å; E59-R148 IonicContact OE2-CZ 2.8Å; E59-R148 IonicContact OE2-NH2 3.98Å; E59-R148 PolarHBondContact OE2-NH2 3.08Å; E59-I152 HydrophobicContact CB-CD1 4.49Å; E59-I152 HydrophobicContact CG-CD1 3.41Å; E59-I152 VanDerWaalsContact CG-CD1 3.41Å; E59-I152 HydrophobicContact CG-CG1 4.06Å
60	D	80.6	Confident	86.4	Confident	107 Å²	107	53.4 Å²	53.4	57%	0.572	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-12.1	179.1	60.5	-18.6	0	0	0	112.4	V58 K62 R156	V58-D60 PolarHBondContact O-N 2.93Å; D60-K62 PolarHBondContact O-N 3.35Å; D60-R156 IonicContact OD1-CZ 3.67Å; D60-R156 IonicContact OD1-NE 2.68Å; D60-R156 IonicContact OD1-NH2 2.8Å; D60-R156 PolarHBondContact OD1-NH2 2.94Å; D60-R156 IonicContact OD2-CZ 2.76Å; D60-R156 IonicContact OD2-NH2 2.75Å; D60-R156 PolarHBondContact OD2-NH2 2.84Å
61	Q	82.1	Confident	85.8	Confident	54 Å²	54	57.4 Å²	57.4	25%	0.252	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.6	179.3	-174.3	63.1	53.7	0	0	110.4	V58 V63 V155 R156	V58-Q61 PolarHBondContact N-O 2.83Å; V58-Q61 PolarHBondContact O-N 2.91Å; Q61-V63 HydrophobicContact CG-CG1 4.14Å; Q61-V63 PolarHBondContact O-N 3.1Å; Q61-V155 HydrophobicContact CG-CG1 4.33Å; Q61-R156 HydrophobicContact CG-CG 4.46Å
62	K	90	Very high	85.5	Confident	101 Å²	101	50.2 Å²	50.2	44%	0.439	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	123.7	166.2	-171.9	178.9	-177.8	178	0	109	K56 Y57 D60	K56-K62 CarbonylContact O-C 3.53Å; K56-K62 WeakPolarHBondContact O-CA 3.44Å; Y57-K62 HydrophobicContact CD1-CB 4.4Å; Y57-K62 HydrophobicContact CE1-CB 3.95Å; D60-K62 PolarHBondContact O-N 3.35Å
63	V	92.1	Very high	85.1	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146	176.2	-60.4	0	0	0	0	110.5	I36 S55 K56 V58 Q61 I65 V155 Y159	I36-V63 HydrophobicContact CG2-CB 4.49Å; I36-V63 HydrophobicContact CG2-CG1 4.37Å; S55-V63 CarbonylContact C-O 3.49Å; S55-V63 WeakPolarHBondContact CA-O 3.48Å; K56-V63 HydrophobicContact CB-CG2 4.02Å; K56-V63 PolarHBondContact N-O 3.48Å; K56-V63 WeakPolarHBondContact O-CG2 3.5Å; K56-V63 PolarHBondContact O-N 3.3Å; V58-V63 HydrophobicContact CB-CG1 4.48Å; V58-V63 HydrophobicContact CG2-CG1 4.04Å; V58-V63 HydrophobicContact CG2-CG2 3.73Å; Q61-V63 HydrophobicContact CG-CG1 4.14Å; Q61-V63 PolarHBondContact O-N 3.1Å; V63-I65 HydrophobicContact CB-CD1 4.43Å; V63-I65 HydrophobicContact CG2-CD1 3.72Å; V63-I65 HydrophobicContact CG2-CG1 4.27Å; V63-V155 HydrophobicContact CG1-CG1 3.64Å; V63-Y159 WeakPolarHBondContact CA-OH 3.46Å; V63-Y159 HydrophobicContact CG1-CE2 4.35Å
64	M	93.5	Very high	84.9	Confident	24 Å²	24	55.1 Å²	55.1	12%	0.118	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.1	175.8	-57.3	-55	-67	0	0	110	S39 Y43 Y53 G54 Y159	S39-M64 WeakPolarHBondContact CB-O 3.39Å; Y43-M64 HydrophobicContact CD1-CB 3.77Å; Y43-M64 HydrophobicContact CD1-CG 3.43Å; Y43-M64 VanDerWaalsContact CD1-CG 3.43Å; Y43-M64 HydrophobicContact CD2-CB 3.8Å; Y43-M64 HydrophobicContact CD2-CE 4.38Å; Y43-M64 HydrophobicContact CD2-CG 3.78Å; Y43-M64 HydrophobicContact CE1-CB 4.26Å; Y43-M64 HydrophobicContact CE1-CG 3.42Å; Y43-M64 VanDerWaalsContact CE1-CG 3.42Å; Y43-M64 HydrophobicContact CE2-CB 4.27Å; Y43-M64 HydrophobicContact CE2-CE 3.9Å; Y43-M64 HydrophobicContact CE2-CG 3.75Å; Y43-M64 HydrophobicContact CG-CB 3.52Å; Y43-M64 HydrophobicContact CG-CG 3.62Å; Y53-M64 HydrophobicContact CD1-CB 4.17Å; Y53-M64 HydrophobicContact CG-CB 4.39Å; G54-M64 CarbonylContact O-C 3.49Å; G54-M64 WeakPolarHBondContact O-CA 3.39Å; M64-Y159 PolarHBondContact N-OH 3.49Å
65	I	94.4	Very high	84.8	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.015	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.8	-176.4	-54.1	-51	0	0	0	108	I36 Y53 G54 K56 V63 K67 I300	I36-I65 HydrophobicContact CG1-CD1 3.99Å; Y53-I65 CarbonylContact C-O 3.1Å; Y53-I65 VanDerWaalsContact CA-O 3.27Å; Y53-I65 WeakPolarHBondContact CA-O 3.33Å; G54-I65 PolarHBondContact N-O 3.09Å; G54-I65 PolarHBondContact O-N 2.93Å; K56-I65 HydrophobicContact CB-CG1 4.14Å; K56-I65 HydrophobicContact CD-CG1 4.1Å; K56-I65 HydrophobicContact CG-CG1 3.89Å; V63-I65 HydrophobicContact CB-CD1 4.43Å; V63-I65 HydrophobicContact CG2-CD1 3.72Å; V63-I65 HydrophobicContact CG2-CG1 4.27Å; I65-K67 PolarHBondContact O-N 2.83Å; I65-I300 HydrophobicContact CB-CD1 4.36Å; I65-I300 HydrophobicContact CD1-CD1 3.56Å; I65-I300 HydrophobicContact CG1-CD1 3.68Å; I65-I300 HydrophobicContact CG2-CD1 3.76Å; I65-I300 HydrophobicContact CG2-CG1 3.9Å
66	L	94.1	Very high	84.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	126.7	179.9	-169.4	70.6	0	0	0	109.4	S39 F48 A52 Y53 T75 I78 M299	S39-L66 PolarHBondContact OG-N 3.13Å; S39-L66 VanDerWaalsContact OG-N 3.08Å; F48-L66 HydrophobicContact CD2-CD1 3.81Å; F48-L66 HydrophobicContact CE2-CD1 4.42Å; F48-L66 HydrophobicContact CE2-CD2 4.43Å; A52-L66 HydrophobicContact CB-CD1 4.33Å; Y53-L66 HydrophobicContact CD1-CB 4.18Å; Y53-L66 HydrophobicContact CD1-CD1 3.92Å; Y53-L66 HydrophobicContact CE1-CB 4.01Å; Y53-L66 HydrophobicContact CE1-CD1 3.39Å; Y53-L66 HydrophobicContact CE1-CG 4.32Å; Y53-L66 HydrophobicContact CE2-CD1 4.24Å; L66-T75 HydrophobicContact CD1-CG2 3.93Å; L66-I78 HydrophobicContact CD2-CB 3.72Å; L66-I78 HydrophobicContact CD2-CG1 4.23Å; L66-I78 HydrophobicContact CD2-CG2 3.56Å; L66-M299 HydrophobicContact CB-CE 3.78Å; L66-M299 HydrophobicContact CD2-CE 3.79Å; L66-M299 HydrophobicContact CG-CE 4.26Å
67	K	88.6	Confident	84.8	Confident	52 Å²	52	54.7 Å²	54.7	23%	0.226	29%	0.293	C	S	.	.			trans	-91.9	142.8	170.6	-67.1	170.3	173.1	154	0	107.5	A52 Y53 G54 I65 D69	A52-K67 WeakPolarHBondContact O-CB 3.5Å; A52-K67 PolarHBondContact O-N 2.78Å; Y53-K67 WeakPolarHBondContact O-CE 3.31Å; Y53-K67 PolarHBondContact O-NZ 3Å; G54-K67 VanDerWaalsContact N-CE 3.33Å; I65-K67 PolarHBondContact O-N 2.83Å; K67-D69 PolarHBondContact O-N 2.88Å
68	G	72	Confident	85.3	Confident	32 Å²	32	48.1 Å²	48.1	33%	0.33	27%	0.267	S	S	.	.			trans	-69.9	115.7	167.4	0	0	0	0	0	106.6	H79	G68-H79 WeakPolarHBondContact CA-CE1 3.2Å; G68-H79 PolarHBondContact N-CE1 2.86Å
69	D	71.4	Confident	85.9	Confident	29 Å²	29	48.8 Å²	48.8	16%	0.155	27%	0.269	C	S	.	.			trans	-119.5	126.5	-179.6	-168.5	-5.2	0	0	0	109.4	K67 D71 C72 T75	K67-D69 PolarHBondContact O-N 2.88Å; D69-D71 PolarHBondContact O-N 2.92Å; D69-D71 PolarHBondContact OD1-N 2.96Å; D69-C72 HydrophobicContact CB-CB 4.24Å; D69-C72 CarbonylContact O-C 3.45Å; D69-C72 PolarHBondContact O-N 3.37Å; D69-T75 PolarHBondContact N-OG1 3.3Å; D69-T75 VanDerWaalsContact N-OG1 3.12Å; D69-T75 PolarHBondContact O-OG1 2.91Å
70	L	68.1	Low	86.5	Confident	165 Å²	165	47.2 Å²	47.2	86%	0.864	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-29.7	175.6	-66	173.6	0	0	0	110.9	C72	L70-C72 PolarHBondContact O-N 3.26Å
71	D	79.3	Confident	87.3	Confident	131 Å²	131	42.6 Å²	42.6	70%	0.701	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-3	-179.4	-64	-27.8	0	0	0	112.6	D69	D69-D71 PolarHBondContact O-N 2.92Å; D69-D71 PolarHBondContact OD1-N 2.96Å
72	C	83.8	Confident	87.9	Confident	18 Å²	18	40.1 Å²	40.1	12%	0.122	23%	0.225	C	C	.	.			trans	-134.5	85.1	175.8	-164.1	0	0	0	0	110.4	D69 L70 G74 T75	D69-C72 HydrophobicContact CB-CB 4.24Å; D69-C72 CarbonylContact O-C 3.45Å; D69-C72 PolarHBondContact O-N 3.37Å; L70-C72 PolarHBondContact O-N 3.26Å; C72-G74 PolarHBondContact O-N 3.4Å; C72-T75 HydrophobicContact CB-CG2 3.68Å; C72-T75 WeakPolarHBondContact O-CB 3.19Å; C72-T75 WeakPolarHBondContact O-CG2 3.29Å; C72-T75 PolarHBondContact O-N 3.1Å; C72-T75 PolarHBondContact O-OG1 3.29Å
73	P	85.3	Confident	88.2	Confident	88 Å²	88	38.8 Å²	38.8	57%	0.571	22%	0.22	S	C	*	.	H	α-helix	trans	-54.4	-32.1	-175.3	-28.2	34.8	0	0	0	114.4	T75 S76 Q77	P73-T75 PolarHBondContact O-N 3.02Å; P73-S76 WeakPolarHBondContact O-CB 3.21Å; P73-S76 PolarHBondContact O-N 3Å; P73-S76 VanDerWaalsContact O-N 3.12Å; P73-Q77 PolarHBondContact O-N 3.4Å
74	G	89.3	Confident	88.4	Confident	23 Å²	23	38.7 Å²	38.7	24%	0.237	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-30.4	175.8	0	0	0	0	0	113.7	C72 Q77 I78	C72-G74 PolarHBondContact O-N 3.4Å; G74-Q77 WeakPolarHBondContact O-CB 3.22Å; G74-Q77 PolarHBondContact O-N 3.25Å; G74-I78 PolarHBondContact O-N 3.42Å; G74-I78 VanDerWaalsContact O-N 3.14Å
75	T	91.8	Very high	88.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-38.4	176.1	69.3	0	0	0	0	111.7	F48 A52 L66 D69 C72 P73 Q77 I78 H79	F48-T75 HydrophobicContact CD1-CG2 4.18Å; F48-T75 HydrophobicContact CD2-CG2 4.28Å; F48-T75 HydrophobicContact CE1-CG2 4.49Å; F48-T75 HydrophobicContact CG-CG2 4.08Å; A52-T75 HydrophobicContact CB-CG2 3.89Å; L66-T75 HydrophobicContact CD1-CG2 3.93Å; D69-T75 PolarHBondContact N-OG1 3.3Å; D69-T75 VanDerWaalsContact N-OG1 3.12Å; D69-T75 PolarHBondContact O-OG1 2.91Å; C72-T75 HydrophobicContact CB-CG2 3.68Å; C72-T75 WeakPolarHBondContact O-CB 3.19Å; C72-T75 WeakPolarHBondContact O-CG2 3.29Å; C72-T75 PolarHBondContact O-N 3.1Å; C72-T75 PolarHBondContact O-OG1 3.29Å; P73-T75 PolarHBondContact O-N 3.02Å; T75-Q77 VanDerWaalsContact C-N 3.27Å; T75-Q77 PolarHBondContact O-N 3.14Å; T75-I78 PolarHBondContact O-N 3.24Å; T75-H79 PolarHBondContact O-CD2 2.92Å; T75-H79 PolarHBondContact O-N 3.22Å
76	S	89.9	Confident	88.7	Confident	57 Å²	57	37.7 Å²	37.7	40%	0.399	22%	0.215	S	C	.	.	H	α-helix	trans	-64.9	-34.7	175.2	-65.5	0	0	0	0	111.2	P73 H79 Q80	P73-S76 WeakPolarHBondContact O-CB 3.21Å; P73-S76 PolarHBondContact O-N 3Å; P73-S76 VanDerWaalsContact O-N 3.12Å; S76-H79 WeakPolarHBondContact O-CB 3.49Å; S76-H79 PolarHBondContact O-N 3.44Å; S76-Q80 PolarHBondContact O-N 3.21Å
77	Q	91	Very high	88.9	Confident	19 Å²	19	39.3 Å²	39.3	9%	0.089	22%	0.224	C	C	.	.	H	α-helix	trans	-65.8	-42.7	175	-169.9	60	74	0	0	111.9	P73 G74 T75 H79 Q80 W81	P73-Q77 PolarHBondContact O-N 3.4Å; G74-Q77 WeakPolarHBondContact O-CB 3.22Å; G74-Q77 PolarHBondContact O-N 3.25Å; T75-Q77 VanDerWaalsContact C-N 3.27Å; T75-Q77 PolarHBondContact O-N 3.14Å; Q77-H79 VanDerWaalsContact C-N 3.34Å; Q77-Q80 PolarHBondContact O-N 3.17Å; Q77-W81 HydrophobicContact CG-CD2 4.4Å; Q77-W81 HydrophobicContact CG-CH2 4.36Å; Q77-W81 HydrophobicContact CG-CZ2 3.57Å; Q77-W81 VanDerWaalsContact O-CG 3.29Å; Q77-W81 PolarHBondContact O-N 3Å
78	I	94.8	Very high	89.3	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-43.1	173.7	-63.8	-60.5	0	0	0	111.3	V38 F48 L66 G74 T75 Q80 W81 M82 L174 M299	V38-I78 HydrophobicContact CG1-CG2 3.89Å; F48-I78 HydrophobicContact CE2-CG1 3.78Å; F48-I78 HydrophobicContact CZ-CG1 3.91Å; L66-I78 HydrophobicContact CD2-CB 3.72Å; L66-I78 HydrophobicContact CD2-CG1 4.23Å; L66-I78 HydrophobicContact CD2-CG2 3.56Å; G74-I78 PolarHBondContact O-N 3.42Å; G74-I78 VanDerWaalsContact O-N 3.14Å; T75-I78 PolarHBondContact O-N 3.24Å; I78-Q80 VanDerWaalsContact C-N 3.31Å; I78-Q80 PolarHBondContact O-N 3.41Å; I78-W81 HydrophobicContact CD1-CD2 4.48Å; I78-W81 HydrophobicContact CD1-CE3 3.5Å; I78-W81 HydrophobicContact CD1-CZ3 3.55Å; I78-W81 WeakPolarHBondContact O-CB 3Å; I78-W81 PolarHBondContact O-N 3.11Å; I78-M82 HydrophobicContact CG2-CG 4.19Å; I78-M82 VanDerWaalsContact O-CG 3.28Å; I78-M82 WeakPolarHBondContact O-CG 3.17Å; I78-M82 PolarHBondContact O-N 3.05Å; I78-L174 HydrophobicContact CD1-CD2 3.36Å; I78-L174 HydrophobicContact CG1-CD2 4.48Å; I78-M299 HydrophobicContact CG2-CE 4.01Å
79	H	92.1	Very high	90.4	Very high	19 Å²	19	35.3 Å²	35.3	9%	0.088	20%	0.197	C	C	.	.	H	α-helix	trans	-57.2	-46.1	175.6	-78.5	-158.7	0	0	0	111.8	G68 T75 S76 Q77 W81 M82 Q83 M299	G68-H79 WeakPolarHBondContact CA-CE1 3.2Å; G68-H79 PolarHBondContact N-CE1 2.86Å; T75-H79 PolarHBondContact O-CD2 2.92Å; T75-H79 PolarHBondContact O-N 3.22Å; S76-H79 WeakPolarHBondContact O-CB 3.49Å; S76-H79 PolarHBondContact O-N 3.44Å; Q77-H79 VanDerWaalsContact C-N 3.34Å; H79-W81 VanDerWaalsContact C-N 3.31Å; H79-W81 PolarHBondContact O-N 3.49Å; H79-M82 PolarHBondContact O-N 2.58Å; H79-Q83 WeakPolarHBondContact O-CG 3.49Å; H79-Q83 PolarHBondContact O-N 2.79Å; H79-M299 WeakPolarHBondContact CD2-CE 3.15Å; H79-M299 WeakPolarHBondContact NE2-CE 3.43Å
80	Q	93.1	Very high	91.6	Very high	64 Å²	64	36.8 Å²	36.8	30%	0.299	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-39.6	177.7	-159.7	-173.8	21.2	0	0	112	S76 Q77 I78 Q83 G84	S76-Q80 PolarHBondContact O-N 3.21Å; Q77-Q80 PolarHBondContact O-N 3.17Å; I78-Q80 VanDerWaalsContact C-N 3.31Å; I78-Q80 PolarHBondContact O-N 3.41Å; Q80-Q83 PolarHBondContact O-N 2.71Å; Q80-G84 PolarHBondContact O-N 3.26Å; Q80-G84 VanDerWaalsContact O-N 3.13Å
81	W	95.9	Very high	92.8	Very high	11 Å²	11	33.3 Å²	33.3	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-43.2	174.7	-65.1	-10	0	0	0	112	Q77 I78 H79 Q83 G84 C85 L174 M176 F194 P368	Q77-W81 HydrophobicContact CG-CD2 4.4Å; Q77-W81 HydrophobicContact CG-CH2 4.36Å; Q77-W81 HydrophobicContact CG-CZ2 3.57Å; Q77-W81 VanDerWaalsContact O-CG 3.29Å; Q77-W81 PolarHBondContact O-N 3Å; I78-W81 HydrophobicContact CD1-CD2 4.48Å; I78-W81 HydrophobicContact CD1-CE3 3.5Å; I78-W81 HydrophobicContact CD1-CZ3 3.55Å; I78-W81 WeakPolarHBondContact O-CB 3Å; I78-W81 PolarHBondContact O-N 3.11Å; H79-W81 VanDerWaalsContact C-N 3.31Å; H79-W81 PolarHBondContact O-N 3.49Å; W81-Q83 VanDerWaalsContact C-N 3.33Å; W81-Q83 PolarHBondContact O-N 3.12Å; W81-G84 PolarHBondContact O-N 3.42Å; W81-C85 PolarHBondContact O-N 2.98Å; W81-C85 PolarHBondContact O-SG 2.96Å; W81-C85 VanDerWaalsContact O-SG 3.37Å; W81-L174 HydrophobicContact CH2-CB 4.48Å; W81-L174 HydrophobicContact CZ3-CB 4.44Å; W81-L174 HydrophobicContact CZ3-CD2 3.86Å; W81-L174 HydrophobicContact CZ3-CG 4.02Å; W81-M176 HydrophobicContact CB-SD 3.78Å; W81-M176 HydrophobicContact CD2-CB 3.9Å; W81-M176 HydrophobicContact CE3-CB 3.54Å; W81-M176 HydrophobicContact CE3-CE 4.35Å; W81-M176 HydrophobicContact CE3-SD 4.44Å; W81-M176 HydrophobicContact CG-CB 4.39Å; W81-M176 HydrophobicContact CG-SD 4.47Å; W81-M176 HydrophobicContact CZ3-CB 3.99Å; W81-F194 HydrophobicContact CB-CE2 4.23Å; W81-F194 HydrophobicContact CB-CZ 3.75Å; W81-F194 AromaticContact CD1-CZ 3.95Å; W81-F194 HydrophobicContact CG-CE1 4.48Å; W81-F194 AromaticContact CG-CZ 3.94Å; W81-F194 HydrophobicContact CG-CZ 3.94Å; W81-F194 WeakPolarHBondContact O-CE2 3.49Å; W81-P368 HydrophobicContact CD2-CG 4.27Å; W81-P368 HydrophobicContact CH2-CG 4.18Å; W81-P368 HydrophobicContact CZ2-CB 3.67Å; W81-P368 HydrophobicContact CZ2-CG 3.34Å; W81-P368 VanDerWaalsContact NE1-CB 3.29Å
82	M	96.4	Very high	93.6	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-40.5	176.8	-70.7	-57.7	-55.6	0	0	111.8	L34 A35 V38 I78 H79 G84 C85 F86 M299	L34-M82 HydrophobicContact CB-CE 4.24Å; L34-M82 HydrophobicContact CD2-CE 3.96Å; L34-M82 HydrophobicContact CG-CE 3.78Å; L34-M82 HydrophobicContact CG-SD 4.4Å; A35-M82 HydrophobicContact CB-CE 4.1Å; V38-M82 HydrophobicContact CB-SD 4.02Å; V38-M82 HydrophobicContact CG1-SD 4.07Å; V38-M82 HydrophobicContact CG2-SD 3.84Å; I78-M82 HydrophobicContact CG2-CG 4.19Å; I78-M82 VanDerWaalsContact O-CG 3.28Å; I78-M82 WeakPolarHBondContact O-CG 3.17Å; I78-M82 PolarHBondContact O-N 3.05Å; H79-M82 PolarHBondContact O-N 2.58Å; M82-G84 VanDerWaalsContact C-N 3.34Å; M82-G84 PolarHBondContact O-N 3.37Å; M82-C85 WeakPolarHBondContact O-CB 3.28Å; M82-C85 PolarHBondContact O-N 2.93Å; M82-F86 HydrophobicContact CB-CE2 4.28Å; M82-F86 HydrophobicContact CB-CZ 4.3Å; M82-F86 HydrophobicContact CE-CD1 4.39Å; M82-F86 HydrophobicContact CE-CE1 3.38Å; M82-F86 HydrophobicContact CE-CE2 4.32Å; M82-F86 HydrophobicContact CE-CZ 3.33Å; M82-F86 WeakPolarHBondContact O-CD1 3.45Å; M82-F86 WeakPolarHBondContact O-CD2 3.24Å; M82-F86 WeakPolarHBondContact O-CG 3.49Å; M82-F86 PolarHBondContact O-N 3.46Å; M82-M299 HydrophobicContact CG-CE 4.08Å; M82-M299 HydrophobicContact CG-SD 4.44Å
83	Q	95	Very high	94.2	Very high	72 Å²	72	31.1 Å²	31.1	34%	0.336	16%	0.162	S	C	.	.	H	α-helix	trans	-60.7	-42.6	173.8	-72.1	175.7	-8.5	0	0	111.9	H79 Q80 W81 F86 D87 E302	H79-Q83 WeakPolarHBondContact O-CG 3.49Å; H79-Q83 PolarHBondContact O-N 2.79Å; Q80-Q83 PolarHBondContact O-N 2.71Å; W81-Q83 VanDerWaalsContact C-N 3.33Å; W81-Q83 PolarHBondContact O-N 3.12Å; Q83-F86 PolarHBondContact O-N 3.33Å; Q83-D87 PolarHBondContact O-N 3.06Å; Q83-E302 PolarHBondContact NE2-OE2 3.36Å; Q83-E302 VanDerWaalsContact NE2-OE2 3.17Å
84	G	96.6	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-39.1	174.8	0	0	0	0	0	113.7	Q80 W81 M82 A88 P192	Q80-G84 PolarHBondContact O-N 3.26Å; Q80-G84 VanDerWaalsContact O-N 3.13Å; W81-G84 PolarHBondContact O-N 3.42Å; M82-G84 VanDerWaalsContact C-N 3.34Å; M82-G84 PolarHBondContact O-N 3.37Å; G84-A88 WeakPolarHBondContact O-CB 3.21Å; G84-A88 PolarHBondContact O-N 3.01Å; G84-A88 VanDerWaalsContact O-N 3.13Å; G84-P192 WeakPolarHBondContact CA-O 3.39Å
85	C	97.7	Very high	95	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.007	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-48.3	170.5	-68.9	0	0	0	0	110.9	L34 W81 M82 D87 A88 I89 L94 M176 L178	L34-C85 HydrophobicContact CD2-CB 3.88Å; W81-C85 PolarHBondContact O-N 2.98Å; W81-C85 PolarHBondContact O-SG 2.96Å; W81-C85 VanDerWaalsContact O-SG 3.37Å; M82-C85 WeakPolarHBondContact O-CB 3.28Å; M82-C85 PolarHBondContact O-N 2.93Å; C85-D87 PolarHBondContact O-N 3.4Å; C85-A88 PolarHBondContact O-N 3.45Å; C85-I89 WeakPolarHBondContact O-CG1 3.43Å; C85-I89 PolarHBondContact O-N 3.42Å; C85-L94 HydrophobicContact CB-CD2 4.35Å; C85-M176 VanDerWaalsContact SG-SD 3.64Å; C85-L178 WeakPolarHBondContact SG-CD2 3.5Å
86	F	97.3	Very high	95.3	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-39.1	-177.2	-63.2	-19.7	0	0	0	113.2	K31 L34 A35 M82 Q83 I89 Q90 A303 M306	K31-F86 HydrophobicContact CB-CD1 3.84Å; K31-F86 HydrophobicContact CB-CE1 3.7Å; K31-F86 HydrophobicContact CB-CG 4.45Å; K31-F86 HydrophobicContact CB-CZ 4.22Å; K31-F86 HydrophobicContact CD-CB 4.08Å; K31-F86 HydrophobicContact CD-CD1 4.1Å; K31-F86 HydrophobicContact CD-CG 4.01Å; K31-F86 HydrophobicContact CG-CB 4.4Å; K31-F86 HydrophobicContact CG-CD1 3.58Å; K31-F86 HydrophobicContact CG-CE1 4Å; K31-F86 HydrophobicContact CG-CG 4.03Å; K31-F86 WeakPolarHBondContact O-CE1 3.48Å; L34-F86 HydrophobicContact CD2-CE1 4.39Å; A35-F86 HydrophobicContact CB-CZ 4.21Å; M82-F86 HydrophobicContact CB-CE2 4.28Å; M82-F86 HydrophobicContact CB-CZ 4.3Å; M82-F86 HydrophobicContact CE-CD1 4.39Å; M82-F86 HydrophobicContact CE-CE1 3.38Å; M82-F86 HydrophobicContact CE-CE2 4.32Å; M82-F86 HydrophobicContact CE-CZ 3.33Å; M82-F86 WeakPolarHBondContact O-CD1 3.45Å; M82-F86 WeakPolarHBondContact O-CD2 3.24Å; M82-F86 WeakPolarHBondContact O-CG 3.49Å; M82-F86 PolarHBondContact O-N 3.46Å; Q83-F86 PolarHBondContact O-N 3.33Å; F86-I89 PolarHBondContact O-N 2.95Å; F86-Q90 VanDerWaalsContact O-CB 3.29Å; F86-Q90 WeakPolarHBondContact O-CB 3.3Å; F86-Q90 PolarHBondContact O-N 3.29Å; F86-A303 HydrophobicContact CE2-CB 3.87Å; F86-A303 HydrophobicContact CZ-CB 3.94Å; F86-M306 HydrophobicContact CB-CE 3.72Å
87	D	97.1	Very high	95.6	Very high	36 Å²	36	26.8 Å²	26.8	19%	0.193	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-47.9	172.8	-175.3	65.8	0	0	0	110.8	Q83 C85 I89 Q90 K91 Y189 P192	Q83-D87 PolarHBondContact O-N 3.06Å; C85-D87 PolarHBondContact O-N 3.4Å; D87-I89 VanDerWaalsContact C-N 3.33Å; D87-I89 PolarHBondContact O-N 3.44Å; D87-Q90 PolarHBondContact O-N 3.48Å; D87-K91 VanDerWaalsContact CG-NZ 3.3Å; D87-K91 WeakPolarHBondContact O-CG 3.35Å; D87-K91 PolarHBondContact O-N 3.2Å; D87-K91 VanDerWaalsContact O-N 3.11Å; D87-K91 WeakPolarHBondContact OD1-CE 3.15Å; D87-K91 IonicContact OD1-NZ 2.98Å; D87-K91 PolarHBondContact OD1-NZ 3.38Å; D87-K91 IonicContact OD2-NZ 2.81Å; D87-K91 PolarHBondContact OD2-NZ 3.48Å; D87-Y189 WeakPolarHBondContact OD2-CE2 3.45Å; D87-Y189 PolarHBondContact OD2-OH 3.24Å; D87-P192 HydrophobicContact CB-CG 4.36Å
88	A	97.1	Very high	95.9	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-35	179.8	0	0	0	0	0	112.7	G84 C85 K92 Y93 L94 Y180 Y189	G84-A88 WeakPolarHBondContact O-CB 3.21Å; G84-A88 PolarHBondContact O-N 3.01Å; G84-A88 VanDerWaalsContact O-N 3.13Å; C85-A88 PolarHBondContact O-N 3.45Å; A88-K92 PolarHBondContact O-N 3.3Å; A88-Y93 PolarHBondContact O-N 3.01Å; A88-L94 HydrophobicContact CB-CB 3.78Å; A88-L94 HydrophobicContact CB-CD1 4.17Å; A88-L94 HydrophobicContact CB-CG 4.38Å; A88-L94 PolarHBondContact O-N 2.97Å; A88-Y180 HydrophobicContact CB-CE1 4.19Å; A88-Y189 VanDerWaalsContact CA-OH 3.23Å; A88-Y189 WeakPolarHBondContact CA-OH 3.26Å; A88-Y189 HydrophobicContact CB-CE1 4.31Å; A88-Y189 WeakPolarHBondContact CB-OH 3.14Å; A88-Y189 PolarHBondContact N-OH 3.16Å
89	I	96.6	Very high	96	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.5	-45.9	176.9	-65.2	163.6	0	0	0	110.7	L27 V30 L34 C85 F86 D87 K91 K92 L94 I119 Y121	L27-I89 HydrophobicContact CD1-CB 4.39Å; L27-I89 HydrophobicContact CD1-CG2 3.49Å; L27-I89 VanDerWaalsContact CD1-CG2 3.49Å; V30-I89 HydrophobicContact CG1-CD1 4.31Å; V30-I89 HydrophobicContact CG1-CG2 4.11Å; L34-I89 HydrophobicContact CD2-CD1 3.96Å; C85-I89 WeakPolarHBondContact O-CG1 3.43Å; C85-I89 PolarHBondContact O-N 3.42Å; F86-I89 PolarHBondContact O-N 2.95Å; D87-I89 VanDerWaalsContact C-N 3.33Å; D87-I89 PolarHBondContact O-N 3.44Å; I89-K91 PolarHBondContact O-N 3.03Å; I89-K92 WeakPolarHBondContact O-CA 3.46Å; I89-K92 PolarHBondContact O-N 3.38Å; I89-L94 HydrophobicContact CD1-CD2 3.99Å; I89-L94 HydrophobicContact CG1-CB 4.03Å; I89-L94 HydrophobicContact CG1-CD2 3.56Å; I89-L94 HydrophobicContact CG1-CG 4.42Å; I89-I119 HydrophobicContact CD1-CD1 3.6Å; I89-I119 HydrophobicContact CG1-CD1 3.61Å; I89-Y121 WeakPolarHBondContact CA-OH 3.39Å; I89-Y121 HydrophobicContact CG2-CE1 4.15Å; I89-Y121 WeakPolarHBondContact O-CE1 3.41Å
90	Q	94.9	Very high	96.2	Very high	60 Å²	60	25.1 Å²	25.1	28%	0.28	11%	0.111	S	C	.	.	H	α-helix	trans	-62.5	-32	-179.4	-179.1	166	-14.6	0	0	112.7	L27 F86 D87 K92	L27-Q90 HydrophobicContact CD2-CB 4.06Å; L27-Q90 HydrophobicContact CD2-CG 3.91Å; F86-Q90 VanDerWaalsContact O-CB 3.29Å; F86-Q90 WeakPolarHBondContact O-CB 3.3Å; F86-Q90 PolarHBondContact O-N 3.29Å; D87-Q90 PolarHBondContact O-N 3.48Å; Q90-K92 VanDerWaalsContact C-N 3.28Å
91	K	94.8	Very high	96.3	Very high	91 Å²	91	22.1 Å²	22.1	40%	0.396	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0	174.6	-66.9	173.3	-178.5	165.7	0	113.8	D87 I89 Y93 Y189	D87-K91 VanDerWaalsContact CG-NZ 3.3Å; D87-K91 WeakPolarHBondContact O-CG 3.35Å; D87-K91 PolarHBondContact O-N 3.2Å; D87-K91 VanDerWaalsContact O-N 3.11Å; D87-K91 WeakPolarHBondContact OD1-CE 3.15Å; D87-K91 IonicContact OD1-NZ 2.98Å; D87-K91 PolarHBondContact OD1-NZ 3.38Å; D87-K91 IonicContact OD2-NZ 2.81Å; D87-K91 PolarHBondContact OD2-NZ 3.48Å; I89-K91 PolarHBondContact O-N 3.03Å; K91-Y93 HydrophobicContact CB-CD1 4.08Å; K91-Y93 HydrophobicContact CB-CD2 3.58Å; K91-Y93 HydrophobicContact CB-CE1 4.08Å; K91-Y93 HydrophobicContact CB-CE2 3.6Å; K91-Y93 HydrophobicContact CB-CG 3.83Å; K91-Y93 HydrophobicContact CD-CD2 4.04Å; K91-Y93 HydrophobicContact CD-CE2 3.67Å; K91-Y93 HydrophobicContact CG-CD2 4.45Å; K91-Y93 HydrophobicContact CG-CE2 4.18Å; K91-Y93 WeakPolarHBondContact O-CD1 3.37Å; K91-Y93 WeakPolarHBondContact O-CE1 3.42Å; K91-Y93 PolarHBondContact O-N 3.47Å; K91-Y189 HydrophobicContact CD-CE2 4.02Å
92	K	94.9	Very high	96.2	Very high	57 Å²	57	22.1 Å²	22.1	25%	0.248	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	28.5	-174.5	-52.7	-175.7	-179	-175.9	0	114	E23 A88 I89 Q90 Y121	E23-K92 WeakPolarHBondContact OE1-CE 3.31Å; E23-K92 IonicContact OE1-NZ 2.65Å; E23-K92 PolarHBondContact OE1-NZ 3.37Å; E23-K92 IonicContact OE2-NZ 3.64Å; A88-K92 PolarHBondContact O-N 3.3Å; I89-K92 WeakPolarHBondContact O-CA 3.46Å; I89-K92 PolarHBondContact O-N 3.38Å; Q90-K92 VanDerWaalsContact C-N 3.28Å; K92-Y121 HydrophobicContact CB-CD1 4.01Å; K92-Y121 HydrophobicContact CB-CD2 4.08Å; K92-Y121 HydrophobicContact CB-CE1 4.22Å; K92-Y121 HydrophobicContact CB-CE2 4.27Å; K92-Y121 HydrophobicContact CB-CG 3.96Å; K92-Y121 HydrophobicContact CD-CD1 4.41Å; K92-Y121 HydrophobicContact CD-CG 4.48Å; K92-Y121 HydrophobicContact CG-CD1 3.82Å; K92-Y121 HydrophobicContact CG-CE1 4.19Å; K92-Y121 HydrophobicContact CG-CG 4.14Å
93	Y	96	Very high	96.1	Very high	47 Å²	47	24.9 Å²	24.9	18%	0.184	12%	0.115	C	C	.	.			trans	-91.5	-31.1	-179.3	-63.6	-16.2	0	0	0	112.3	A88 K91 R95 Y180 Y181 V184 T185 P186 Y189	A88-Y93 PolarHBondContact O-N 3.01Å; K91-Y93 HydrophobicContact CB-CD1 4.08Å; K91-Y93 HydrophobicContact CB-CD2 3.58Å; K91-Y93 HydrophobicContact CB-CE1 4.08Å; K91-Y93 HydrophobicContact CB-CE2 3.6Å; K91-Y93 HydrophobicContact CB-CG 3.83Å; K91-Y93 HydrophobicContact CD-CD2 4.04Å; K91-Y93 HydrophobicContact CD-CE2 3.67Å; K91-Y93 HydrophobicContact CG-CD2 4.45Å; K91-Y93 HydrophobicContact CG-CE2 4.18Å; K91-Y93 WeakPolarHBondContact O-CD1 3.37Å; K91-Y93 WeakPolarHBondContact O-CE1 3.42Å; K91-Y93 PolarHBondContact O-N 3.47Å; Y93-R95 PolarHBondContact O-N 3.31Å; Y93-Y180 CarbonylContact O-C 3.59Å; Y93-Y180 WeakPolarHBondContact O-CA 3.48Å; Y93-Y180 WeakPolarHBondContact O-CB 3.43Å; Y93-Y181 PolarHBondContact O-N 3.27Å; Y93-V184 HydrophobicContact CD1-CB 4.48Å; Y93-V184 HydrophobicContact CD1-CG2 4.05Å; Y93-V184 WeakPolarHBondContact CE1-O 3.45Å; Y93-T185 WeakPolarHBondContact CB-OG1 3.21Å; Y93-T185 HydrophobicContact CD2-CG2 4.07Å; Y93-T185 HydrophobicContact CG-CG2 4.04Å; Y93-P186 HydrophobicContact CE2-CG 4.44Å; Y93-P186 VanDerWaalsContact CZ-CD 3.45Å; Y93-P186 WeakPolarHBondContact OH-CD 3.41Å; Y93-Y189 AromaticContact CD2-CD1 3.82Å; Y93-Y189 HydrophobicContact CD2-CD1 3.82Å; Y93-Y189 HydrophobicContact CD2-CD2 4.03Å; Y93-Y189 AromaticContact CD2-CE1 3.76Å; Y93-Y189 HydrophobicContact CD2-CE1 3.76Å; Y93-Y189 AromaticContact CD2-CE2 3.99Å; Y93-Y189 HydrophobicContact CD2-CE2 3.99Å; Y93-Y189 AromaticContact CD2-CG 3.95Å; Y93-Y189 HydrophobicContact CD2-CG 3.95Å; Y93-Y189 AromaticContact CD2-CZ 3.84Å; Y93-Y189 HydrophobicContact CE2-CD1 4.43Å; Y93-Y189 AromaticContact CE2-CD2 3.94Å; Y93-Y189 HydrophobicContact CE2-CD2 3.94Å; Y93-Y189 HydrophobicContact CE2-CE2 4.16Å; Y93-Y189 HydrophobicContact CE2-CG 4.09Å
94	L	97	Very high	95.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	114.5	-169.6	-165.9	66.3	0	0	0	112.2	C85 A88 I89 A96 A97 I119 Y121 L178 Y180	C85-L94 HydrophobicContact CB-CD2 4.35Å; A88-L94 HydrophobicContact CB-CB 3.78Å; A88-L94 HydrophobicContact CB-CD1 4.17Å; A88-L94 HydrophobicContact CB-CG 4.38Å; A88-L94 PolarHBondContact O-N 2.97Å; I89-L94 HydrophobicContact CD1-CD2 3.99Å; I89-L94 HydrophobicContact CG1-CB 4.03Å; I89-L94 HydrophobicContact CG1-CD2 3.56Å; I89-L94 HydrophobicContact CG1-CG 4.42Å; L94-A96 WeakPolarHBondContact CD1-O 3.5Å; L94-A97 HydrophobicContact CD2-CB 4.27Å; L94-I119 HydrophobicContact CD2-CD1 3.92Å; L94-I119 HydrophobicContact CG-CD1 4.42Å; L94-Y121 WeakPolarHBondContact O-CE2 3.28Å; L94-Y121 PolarHBondContact O-OH 2.9Å; L94-L178 HydrophobicContact CD1-CB 3.73Å; L94-L178 HydrophobicContact CD1-CD1 4.28Å; L94-L178 HydrophobicContact CD1-CD2 3.99Å; L94-L178 HydrophobicContact CD1-CG 4.19Å; L94-Y180 HydrophobicContact CD1-CD1 4.3Å; L94-Y180 HydrophobicContact CD1-CE1 4.04Å
95	R	95.9	Very high	95.6	Very high	76 Å²	76	28.7 Å²	28.7	29%	0.287	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-40.3	171.4	175.5	179.6	149.4	-110.4	0.9	111.9	Y93 K118 I119 A179 Y181 E252	Y93-R95 PolarHBondContact O-N 3.31Å; R95-K118 WeakPolarHBondContact O-CA 3.11Å; R95-I119 PolarHBondContact O-N 3.37Å; R95-A179 WeakPolarHBondContact CA-O 3.45Å; R95-A179 PolarHBondContact N-O 3.49Å; R95-Y181 HydrophobicContact CB-CD1 4.37Å; R95-Y181 HydrophobicContact CB-CD2 3.85Å; R95-Y181 HydrophobicContact CB-CE1 4.3Å; R95-Y181 HydrophobicContact CB-CE2 3.75Å; R95-Y181 HydrophobicContact CB-CG 4.17Å; R95-Y181 HydrophobicContact CG-CE1 4.15Å; R95-Y181 HydrophobicContact CG-CE2 4.27Å; R95-E252 PolarHBondContact NH2-O 3.46Å
96	A	96.8	Very high	95.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	141.9	176.3	0	0	0	0	0	113.2	L94 I98 Q116 F117 K118 L178 A179	L94-A96 WeakPolarHBondContact CD1-O 3.5Å; A96-I98 HydrophobicContact CB-CG1 4.4Å; A96-Q116 HydrophobicContact CB-CG 4.4Å; A96-F117 CarbonylContact C-O 3.59Å; A96-F117 WeakPolarHBondContact CA-O 3.36Å; A96-K118 HydrophobicContact CB-CG 4.44Å; A96-L178 CarbonylContact O-C 3.29Å; A96-L178 WeakPolarHBondContact O-CA 3.44Å; A96-A179 HydrophobicContact CB-CB 4.11Å; A96-A179 PolarHBondContact N-O 2.89Å; A96-A179 VanDerWaalsContact N-O 3.09Å; A96-A179 PolarHBondContact O-N 3.2Å
97	A	97.7	Very high	94.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.5	161.9	0	0	0	0	0	109.2	L94 Q116 F117 L178	L94-A97 HydrophobicContact CD2-CB 4.27Å; A97-Q116 WeakPolarHBondContact O-CA 3.44Å; A97-F117 PolarHBondContact N-O 3.03Å; A97-F117 PolarHBondContact O-N 3.01Å; A97-L178 HydrophobicContact CB-CD2 3.97Å
98	I	96.9	Very high	94.4	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	106.7	-175.5	-55	164.9	0	0	0	108.3	A96 Y114 Y115 Q116 M176 K177 I202 I251	A96-I98 HydrophobicContact CB-CG1 4.4Å; I98-Y114 HydrophobicContact CG2-CD2 4.37Å; I98-Y115 CarbonylContact C-O 3.56Å; I98-Y115 WeakPolarHBondContact CA-O 3.43Å; I98-Q116 HydrophobicContact CG1-CB 4.36Å; I98-Q116 HydrophobicContact CG1-CG 3.95Å; I98-M176 CarbonylContact O-C 3.53Å; I98-M176 VanDerWaalsContact O-CA 3.27Å; I98-M176 WeakPolarHBondContact O-CA 3.1Å; I98-K177 HydrophobicContact CB-CB 4.46Å; I98-K177 PolarHBondContact N-O 2.92Å; I98-K177 PolarHBondContact O-N 3.34Å; I98-I202 HydrophobicContact CG2-CD1 3.79Å; I98-I251 HydrophobicContact CD1-CD1 3.89Å; I98-I251 HydrophobicContact CD1-CG2 4.23Å
99	M	97.1	Very high	94.1	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.5	171.8	-171.9	170	70.4	0	0	109.1	V38 I41 T42 Y114 Y115 L174 N175 M176	V38-M99 HydrophobicContact CG1-SD 4.1Å; I41-M99 HydrophobicContact CB-CE 3.71Å; I41-M99 HydrophobicContact CD1-CE 3.83Å; I41-M99 HydrophobicContact CG1-CE 4.37Å; I41-M99 HydrophobicContact CG2-CE 3.27Å; T42-M99 HydrophobicContact CG2-SD 4.43Å; M99-Y114 CarbonylContact O-C 3.58Å; M99-Y114 VanDerWaalsContact O-CA 3.27Å; M99-Y114 WeakPolarHBondContact O-CA 3.26Å; M99-Y115 HydrophobicContact CE-CD2 3.8Å; M99-Y115 HydrophobicContact CE-CE2 4.29Å; M99-Y115 HydrophobicContact CE-CG 4.47Å; M99-Y115 PolarHBondContact N-O 3.06Å; M99-Y115 PolarHBondContact O-N 2.84Å; M99-L174 HydrophobicContact CG-CD1 3.68Å; M99-L174 HydrophobicContact CG-CD2 4.31Å; M99-L174 HydrophobicContact CG-CG 4.07Å; M99-L174 HydrophobicContact SD-CD1 4.04Å; M99-L174 HydrophobicContact SD-CD2 3.94Å; M99-L174 HydrophobicContact SD-CG 4.33Å; M99-N175 CarbonylContact C-O 3.5Å; M99-N175 WeakPolarHBondContact CA-O 3.31Å; M99-M176 HydrophobicContact CB-CE 4.06Å; M99-M176 HydrophobicContact CG-CE 4.3Å; M99-M176 HydrophobicContact SD-CE 4.22Å
100	S	95.7	Very high	93.9	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.014	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	143.9	-172.6	52.8	0	0	0	0	111.4	E113 L174 N175	S100-E113 WeakPolarHBondContact CA-O 3.41Å; S100-L174 WeakPolarHBondContact O-CA 3.38Å; S100-L174 WeakPolarHBondContact O-CD1 3.48Å; S100-N175 PolarHBondContact N-O 2.96Å; S100-N175 PolarHBondContact O-N 2.84Å; S100-N175 PolarHBondContact OG-O 3.24Å
101	I	95.4	Very high	93.8	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131	178.8	-54.9	179.9	0	0	0	108	R45 I47 V111 T112 E113 Y115 L168 V172 C173 L174	R45-I101 HydrophobicContact CG-CD1 4.5Å; I47-I101 HydrophobicContact CD1-CD1 4.43Å; I101-V111 WeakPolarHBondContact O-CA 3.48Å; I101-V111 WeakPolarHBondContact O-CB 3.35Å; I101-T112 PolarHBondContact O-N 2.88Å; I101-T112 PolarHBondContact O-OG1 2.72Å; I101-E113 HydrophobicContact CB-CB 4.25Å; I101-E113 HydrophobicContact CD1-CB 4.49Å; I101-E113 PolarHBondContact N-O 2.92Å; I101-E113 PolarHBondContact O-N 2.78Å; I101-Y115 HydrophobicContact CD1-CE2 3.92Å; I101-Y115 HydrophobicContact CG1-CE2 4.41Å; I101-L168 HydrophobicContact CD1-CD1 3.87Å; I101-L168 HydrophobicContact CD1-CD2 4.26Å; I101-L168 HydrophobicContact CG2-CD1 4.24Å; I101-L168 HydrophobicContact CG2-CD2 4.01Å; I101-V172 HydrophobicContact CG2-CB 3.85Å; I101-V172 HydrophobicContact CG2-CG1 3.85Å; I101-C173 WeakPolarHBondContact CA-O 3.4Å; I101-L174 HydrophobicContact CG1-CD1 3.8Å
102	Y	94.4	Very high	93.8	Very high	10 Å²	10	35.9 Å²	35.9	4%	0.039	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	163	-179	61.3	-75.9	0	0	0	109.7	D104 P108 K110 V172 C173 N175	Y102-D104 WeakPolarHBondContact CD2-O 3.21Å; Y102-P108 HydrophobicContact CD2-CB 4.11Å; Y102-P108 HydrophobicContact CE1-CB 4.42Å; Y102-P108 HydrophobicContact CE2-CB 3.62Å; Y102-K110 VanDerWaalsContact CB-O 3.29Å; Y102-K110 WeakPolarHBondContact CB-O 3.48Å; Y102-V172 WeakPolarHBondContact O-CA 3.35Å; Y102-C173 HydrophobicContact CD1-CB 4.07Å; Y102-C173 VanDerWaalsContact CD1-O 3.31Å; Y102-C173 WeakPolarHBondContact CD1-O 3.45Å; Y102-C173 HydrophobicContact CD2-CB 3.89Å; Y102-C173 HydrophobicContact CE1-CB 3.53Å; Y102-C173 WeakPolarHBondContact CE1-O 3.43Å; Y102-C173 HydrophobicContact CE2-CB 3.4Å; Y102-C173 HydrophobicContact CG-CB 4.22Å; Y102-C173 PolarHBondContact N-O 3.2Å; Y102-C173 VanDerWaalsContact N-O 3.1Å; Y102-C173 PolarHBondContact O-N 3.22Å; Y102-C173 WeakPolarHBondContact OH-CB 3.42Å; Y102-N175 HydrophobicContact CD1-CB 4.37Å; Y102-N175 HydrophobicContact CE1-CB 3.65Å
103	T	92.9	Very high	93.8	Very high	61 Å²	61	33.2 Å²	33.2	37%	0.374	18%	0.18	S	C	.	.	S	Bend	trans	-112.8	-20.3	-174.4	52.6	0	0	0	0	113.9	P105 T112 P169 V172	T103-P105 WeakPolarHBondContact O-CD 3.38Å; T103-T112 HydrophobicContact CG2-CG2 4.36Å; T103-P169 HydrophobicContact CG2-CB 4.29Å; T103-P169 HydrophobicContact CG2-CG 3.84Å; T103-V172 HydrophobicContact CG2-CG1 4.39Å
104	D	91.3	Very high	93.8	Very high	57 Å²	57	31.8 Å²	31.8	31%	0.305	17%	0.174	S	C	.	.			trans	-106.9	105.2	-178.9	-179.3	2.1	0	0	0	110.6	Y102 S106 N107	Y102-D104 WeakPolarHBondContact CD2-O 3.21Å; D104-S106 PolarHBondContact O-N 3.33Å; D104-S106 VanDerWaalsContact O-N 3.1Å; D104-S106 VanDerWaalsContact OD1-CB 3.24Å; D104-S106 WeakPolarHBondContact OD1-CB 3.21Å; D104-S106 PolarHBondContact OD1-N 3.44Å; D104-S106 PolarHBondContact OD1-OG 2.8Å; D104-N107 HydrophobicContact CB-CB 4.33Å; D104-N107 CarbonylContact O-C 3.54Å; D104-N107 VanDerWaalsContact O-C 3.29Å; D104-N107 PolarHBondContact O-N 3.28Å; D104-N107 PolarHBondContact OD2-ND2 2.81Å
105	P	90.1	Very high	93.8	Very high	94 Å²	94	31.8 Å²	31.8	61%	0.61	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.2	176.3	-25.6	34.4	0	0	0	114.1	T103 N107	T103-P105 WeakPolarHBondContact O-CD 3.38Å; P105-N107 VanDerWaalsContact C-N 3.34Å
106	S	89.9	Confident	93.9	Very high	102 Å²	102	28.9 Å²	28.9	71%	0.713	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-21	179.5	-45.2	0	0	0	0	112.3	D104 P108	D104-S106 PolarHBondContact O-N 3.33Å; D104-S106 VanDerWaalsContact O-N 3.1Å; D104-S106 VanDerWaalsContact OD1-CB 3.24Å; D104-S106 WeakPolarHBondContact OD1-CB 3.21Å; D104-S106 PolarHBondContact OD1-N 3.44Å; D104-S106 PolarHBondContact OD1-OG 2.8Å; S106-P108 VanDerWaalsContact C-CD 3.49Å
107	N	89.1	Confident	93.9	Very high	65 Å²	65	29.2 Å²	29.2	35%	0.348	17%	0.165	S	C	.	.			trans	-130.4	64.4	-177.4	-68.8	-73.8	0	0	0	111.3	D104 P105 Q109 K110	D104-N107 HydrophobicContact CB-CB 4.33Å; D104-N107 CarbonylContact O-C 3.54Å; D104-N107 VanDerWaalsContact O-C 3.29Å; D104-N107 PolarHBondContact O-N 3.28Å; D104-N107 PolarHBondContact OD2-ND2 2.81Å; P105-N107 VanDerWaalsContact C-N 3.34Å; N107-Q109 PolarHBondContact O-N 2.92Å; N107-K110 HydrophobicContact CB-CB 4.41Å; N107-K110 HydrophobicContact CB-CD 4Å; N107-K110 HydrophobicContact CB-CG 4.23Å; N107-K110 PolarHBondContact O-N 3.06Å
108	P	88.7	Confident	93.9	Very high	35 Å²	35	30.7 Å²	30.7	23%	0.227	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-9.8	-175.9	28	-36.7	0	0	0	114.6	Y102 S106	Y102-P108 HydrophobicContact CD2-CB 4.11Å; Y102-P108 HydrophobicContact CE1-CB 4.42Å; Y102-P108 HydrophobicContact CE2-CB 3.62Å; S106-P108 VanDerWaalsContact C-CD 3.49Å
109	Q	89.5	Confident	93.9	Very high	50 Å²	50	30.7 Å²	30.7	23%	0.234	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.8	173.3	-49.1	-59.6	-2.3	0	0	112.6	N107 V111 T201 E203	N107-Q109 PolarHBondContact O-N 2.92Å; Q109-V111 PolarHBondContact O-N 2.8Å; Q109-T201 PolarHBondContact OE1-O 2.8Å; Q109-E203 PolarHBondContact O-N 3.19Å
110	K	92.2	Very high	93.8	Very high	87 Å²	87	32.8 Å²	32.8	38%	0.378	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	91.1	179.5	-69.6	-176.6	-175.6	170	0	109.8	Y102 N107 E203 V205	Y102-K110 VanDerWaalsContact CB-O 3.29Å; Y102-K110 WeakPolarHBondContact CB-O 3.48Å; N107-K110 HydrophobicContact CB-CB 4.41Å; N107-K110 HydrophobicContact CB-CD 4Å; N107-K110 HydrophobicContact CB-CG 4.23Å; N107-K110 PolarHBondContact O-N 3.06Å; K110-E203 CarbonylContact C-O 3.54Å; K110-E203 VanDerWaalsContact CA-O 3.28Å; K110-E203 WeakPolarHBondContact CA-O 3.29Å; K110-V205 HydrophobicContact CB-CG2 3.93Å
111	V	94.2	Very high	93.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	155.5	-175	-52.6	0	0	0	0	111.2	I101 Q109 I202 E203 F204 V205	I101-V111 WeakPolarHBondContact O-CA 3.48Å; I101-V111 WeakPolarHBondContact O-CB 3.35Å; Q109-V111 PolarHBondContact O-N 2.8Å; V111-I202 HydrophobicContact CB-CG2 4.13Å; V111-I202 HydrophobicContact CG1-CG2 3.76Å; V111-I202 HydrophobicContact CG2-CG2 3.23Å; V111-E203 PolarHBondContact N-O 3.43Å; V111-F204 HydrophobicContact CG2-CD1 4.37Å; V111-F204 HydrophobicContact CG2-CD2 4.02Å; V111-F204 HydrophobicContact CG2-CE1 4.18Å; V111-F204 HydrophobicContact CG2-CE2 3.77Å; V111-F204 HydrophobicContact CG2-CG 4.3Å; V111-F204 HydrophobicContact CG2-CZ 3.86Å; V111-F204 WeakPolarHBondContact O-CA 3.5Å; V111-V205 PolarHBondContact O-N 2.94Å
112	T	94.2	Very high	93	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.025	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-21.7	168.9	58.7	0	0	0	0	111.8	I101 T103 F204 E230	I101-T112 PolarHBondContact O-N 2.88Å; I101-T112 PolarHBondContact O-OG1 2.72Å; T103-T112 HydrophobicContact CG2-CG2 4.36Å; T112-F204 WeakPolarHBondContact O-CE1 3.35Å; T112-E230 PolarHBondContact O-N 3.11Å
113	E	95.1	Very high	91.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	141.1	-178.4	-171.9	165.7	-174.6	0	0	109.9	R45 S100 I101 Y115 L165 M227 A228	R45-E113 IonicContact CZ-OE2 2.63Å; R45-E113 VanDerWaalsContact CZ-OE2 3.31Å; R45-E113 IonicContact NE-OE1 3.95Å; R45-E113 IonicContact NE-OE2 3.9Å; R45-E113 PolarHBondContact NE-OE2 2.85Å; R45-E113 IonicContact NH2-OE2 3.37Å; R45-E113 PolarHBondContact NH2-OE2 3.31Å; S100-E113 WeakPolarHBondContact CA-O 3.41Å; I101-E113 HydrophobicContact CB-CB 4.25Å; I101-E113 HydrophobicContact CD1-CB 4.49Å; I101-E113 PolarHBondContact N-O 2.92Å; I101-E113 PolarHBondContact O-N 2.78Å; E113-Y115 HydrophobicContact CG-CE1 4.4Å; E113-Y115 HydrophobicContact CG-CE2 4.05Å; E113-Y115 PolarHBondContact OE1-OH 2.88Å; E113-L165 WeakPolarHBondContact OE1-CD1 3.24Å; E113-M227 HydrophobicContact CG-CE 4.26Å; E113-M227 VanDerWaalsContact OE1-CE 3.31Å; E113-M227 WeakPolarHBondContact OE1-CE 3.35Å; E113-A228 CarbonylContact C-O 3.53Å; E113-A228 VanDerWaalsContact CA-O 3.29Å; E113-A228 WeakPolarHBondContact CA-O 3.27Å
114	Y	95.9	Very high	90.2	Very high	17 Å²	17	46.5 Å²	46.5	7%	0.067	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.2	169.5	79.5	-105.6	0	0	0	112.1	I98 M99 Q116 I202 F204 M227 A228	I98-Y114 HydrophobicContact CG2-CD2 4.37Å; M99-Y114 CarbonylContact O-C 3.58Å; M99-Y114 VanDerWaalsContact O-CA 3.27Å; M99-Y114 WeakPolarHBondContact O-CA 3.26Å; Y114-Q116 HydrophobicContact CD2-CB 4.07Å; Y114-Q116 HydrophobicContact CE2-CB 3.9Å; Y114-I202 HydrophobicContact CD1-CG2 4.42Å; Y114-F204 AromaticContact CD1-CE2 3.51Å; Y114-F204 HydrophobicContact CD1-CE2 3.51Å; Y114-F204 AromaticContact CD1-CZ 3.52Å; Y114-F204 HydrophobicContact CD1-CZ 3.52Å; Y114-F204 AromaticContact CE1-CE2 3.56Å; Y114-F204 HydrophobicContact CE1-CE2 3.56Å; Y114-F204 AromaticContact CE1-CZ 3.83Å; Y114-F204 HydrophobicContact CE1-CZ 3.83Å; Y114-M227 CarbonylContact O-C 3.54Å; Y114-M227 WeakPolarHBondContact O-CA 3.12Å; Y114-M227 VanDerWaalsContact O-CB 3.25Å; Y114-M227 WeakPolarHBondContact O-CB 3.46Å; Y114-A228 HydrophobicContact CD1-CB 3.94Å; Y114-A228 HydrophobicContact CE1-CB 3.36Å; Y114-A228 HydrophobicContact CE2-CB 4.39Å; Y114-A228 PolarHBondContact N-O 3.5Å; Y114-A228 PolarHBondContact O-N 2.96Å
115	Y	97.1	Very high	88.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.7	177.5	-53.7	-78.9	0	0	0	108.5	I41 R45 I98 M99 I101 E113 M162 F225 M227	I41-Y115 HydrophobicContact CD1-CD1 3.76Å; I41-Y115 HydrophobicContact CD1-CD2 4.14Å; I41-Y115 HydrophobicContact CD1-CE1 4.28Å; I41-Y115 HydrophobicContact CD1-CG 3.65Å; I41-Y115 HydrophobicContact CG1-CD1 4.16Å; I41-Y115 HydrophobicContact CG1-CE1 4.18Å; I41-Y115 HydrophobicContact CG1-CG 4.36Å; I41-Y115 HydrophobicContact CG2-CD1 4.48Å; I41-Y115 HydrophobicContact CG2-CD2 3.75Å; I41-Y115 HydrophobicContact CG2-CE1 4.1Å; I41-Y115 HydrophobicContact CG2-CE2 3.27Å; I41-Y115 HydrophobicContact CG2-CG 4.29Å; I41-Y115 VanDerWaalsContact CG2-CZ 3.44Å; R45-Y115 WeakPolarHBondContact CD-OH 3.18Å; R45-Y115 VanDerWaalsContact CG-OH 3.31Å; R45-Y115 WeakPolarHBondContact CG-OH 3.35Å; I98-Y115 CarbonylContact C-O 3.56Å; I98-Y115 WeakPolarHBondContact CA-O 3.43Å; M99-Y115 HydrophobicContact CE-CD2 3.8Å; M99-Y115 HydrophobicContact CE-CE2 4.29Å; M99-Y115 HydrophobicContact CE-CG 4.47Å; M99-Y115 PolarHBondContact N-O 3.06Å; M99-Y115 PolarHBondContact O-N 2.84Å; I101-Y115 HydrophobicContact CD1-CE2 3.92Å; I101-Y115 HydrophobicContact CG1-CE2 4.41Å; E113-Y115 HydrophobicContact CG-CE1 4.4Å; E113-Y115 HydrophobicContact CG-CE2 4.05Å; E113-Y115 PolarHBondContact OE1-OH 2.88Å; Y115-M162 HydrophobicContact CE1-CE 3.6Å; Y115-M162 HydrophobicContact CE1-SD 4.25Å; Y115-F225 HydrophobicContact CD1-CE2 4.13Å; Y115-F225 HydrophobicContact CD1-CZ 4.02Å; Y115-M227 HydrophobicContact CD1-CB 3.8Å; Y115-M227 HydrophobicContact CD1-CE 4.43Å; Y115-M227 HydrophobicContact CD1-SD 4.14Å; Y115-M227 HydrophobicContact CE1-CB 4.31Å; Y115-M227 HydrophobicContact CE1-CE 3.78Å; Y115-M227 HydrophobicContact CE1-SD 3.82Å
116	Q	97.4	Very high	86.7	Confident	16 Å²	16	44.5 Å²	44.5	8%	0.075	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.8	-174.2	179.7	174.9	34.3	0	0	110.7	A96 A97 I98 Y114 K118 F225 D226	A96-Q116 HydrophobicContact CB-CG 4.4Å; A97-Q116 WeakPolarHBondContact O-CA 3.44Å; I98-Q116 HydrophobicContact CG1-CB 4.36Å; I98-Q116 HydrophobicContact CG1-CG 3.95Å; Y114-Q116 HydrophobicContact CD2-CB 4.07Å; Y114-Q116 HydrophobicContact CE2-CB 3.9Å; Q116-K118 VanDerWaalsContact CD-CE 3.44Å; Q116-K118 HydrophobicContact CG-CG 3.93Å; Q116-K118 VanDerWaalsContact OE1-CE 3.28Å; Q116-F225 WeakPolarHBondContact O-CA 3.45Å; Q116-D226 PolarHBondContact N-O 2.89Å; Q116-D226 PolarHBondContact O-N 2.86Å
117	F	98	Very high	85	Confident	6 Å²	6	43 Å²	43	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	102.6	171.9	-57.1	-88	0	0	0	108.1	L34 A37 V38 I41 A96 A97 V223 K224 F225	L34-F117 HydrophobicContact CD1-CB 3.84Å; L34-F117 HydrophobicContact CD1-CD1 3.75Å; L34-F117 HydrophobicContact CD1-CD2 3.4Å; L34-F117 VanDerWaalsContact CD1-CD2 3.4Å; L34-F117 HydrophobicContact CD1-CE1 4.14Å; L34-F117 HydrophobicContact CD1-CE2 3.83Å; L34-F117 HydrophobicContact CD1-CG 3.36Å; L34-F117 HydrophobicContact CD1-CZ 4.18Å; A37-F117 HydrophobicContact CB-CE1 3.49Å; A37-F117 VanDerWaalsContact CB-CE1 3.49Å; A37-F117 HydrophobicContact CB-CZ 3.53Å; V38-F117 HydrophobicContact CG2-CE2 4.23Å; I41-F117 HydrophobicContact CD1-CE2 4.42Å; I41-F117 HydrophobicContact CD1-CZ 4.02Å; A96-F117 CarbonylContact C-O 3.59Å; A96-F117 WeakPolarHBondContact CA-O 3.36Å; A97-F117 PolarHBondContact N-O 3.03Å; A97-F117 PolarHBondContact O-N 3.01Å; F117-V223 HydrophobicContact CD1-CG1 4.45Å; F117-K224 CarbonylContact C-O 3.58Å; F117-K224 WeakPolarHBondContact CA-O 3.32Å; F117-F225 HydrophobicContact CD1-CB 4.26Å; F117-F225 AromaticContact CD1-CD2 3.92Å; F117-F225 HydrophobicContact CD1-CD2 3.92Å; F117-F225 HydrophobicContact CD1-CG 4.18Å; F117-F225 HydrophobicContact CE1-CB 4.33Å; F117-F225 HydrophobicContact CE1-CD1 4.32Å; F117-F225 AromaticContact CE1-CD2 3.59Å; F117-F225 HydrophobicContact CE1-CD2 3.59Å; F117-F225 AromaticContact CE1-CE2 3.97Å; F117-F225 HydrophobicContact CE1-CE2 3.97Å; F117-F225 AromaticContact CE1-CG 3.82Å; F117-F225 HydrophobicContact CE1-CG 3.82Å; F117-F225 HydrophobicContact CE1-CZ 4.47Å; F117-F225 HydrophobicContact CE2-CE2 4.38Å; F117-F225 AromaticContact CZ-CD2 3.91Å; F117-F225 HydrophobicContact CZ-CD2 3.91Å; F117-F225 AromaticContact CZ-CE2 3.82Å; F117-F225 HydrophobicContact CZ-CE2 3.82Å; F117-F225 HydrophobicContact CZ-CG 4.5Å; F117-F225 HydrophobicContact CZ-CZ 4.29Å
118	K	97.4	Very high	83.2	Confident	32 Å²	32	40.5 Å²	40.5	14%	0.139	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.2	173.8	-61.7	178.7	177.6	175.4	0	108.4	R95 A96 Q116 F130 V223 K224 D226 E252	R95-K118 WeakPolarHBondContact O-CA 3.11Å; A96-K118 HydrophobicContact CB-CG 4.44Å; Q116-K118 VanDerWaalsContact CD-CE 3.44Å; Q116-K118 HydrophobicContact CG-CG 3.93Å; Q116-K118 VanDerWaalsContact OE1-CE 3.28Å; K118-F130 HydrophobicContact CB-CE1 3.85Å; K118-F130 HydrophobicContact CB-CZ 3.78Å; K118-F130 HydrophobicContact CD-CE1 4.41Å; K118-V223 CarbonylContact O-C 3.54Å; K118-V223 WeakPolarHBondContact O-CA 3.35Å; K118-K224 HydrophobicContact CB-CB 4.36Å; K118-K224 PolarHBondContact N-O 3.04Å; K118-K224 PolarHBondContact O-N 2.9Å; K118-D226 IonicContact NZ-OD2 2.83Å; K118-E252 IonicContact NZ-OE2 3.94Å; K118-E252 PolarHBondContact NZ-OE2 3.2Å
119	I	96.5	Very high	81.5	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.2	-175.6	-54.1	175.3	0	0	0	108.3	V30 I89 L94 R95 Y121 Y181 C222 V223	V30-I119 HydrophobicContact CG1-CD1 4.46Å; I89-I119 HydrophobicContact CD1-CD1 3.6Å; I89-I119 HydrophobicContact CG1-CD1 3.61Å; L94-I119 HydrophobicContact CD2-CD1 3.92Å; L94-I119 HydrophobicContact CG-CD1 4.42Å; R95-I119 PolarHBondContact O-N 3.37Å; I119-Y121 HydrophobicContact CG2-CE1 3.89Å; I119-Y121 HydrophobicContact CG2-CE2 4.15Å; I119-Y181 PolarHBondContact O-OH 3.11Å; I119-C222 WeakPolarHBondContact CA-O 3.42Å; I119-V223 HydrophobicContact CG1-CG2 4.47Å
120	Q	94.1	Very high	79.9	Confident	47 Å²	47	41.1 Å²	41.1	22%	0.22	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144	171.6	-70.1	-179.8	-23.9	0	0	109.6	V128 F130 H221 C222	Q120-V128 HydrophobicContact CB-CG1 4.11Å; Q120-F130 HydrophobicContact CB-CZ 4.5Å; Q120-F130 HydrophobicContact CG-CD1 4.33Å; Q120-F130 HydrophobicContact CG-CE1 3.79Å; Q120-F130 HydrophobicContact CG-CE2 4.15Å; Q120-F130 HydrophobicContact CG-CZ 3.68Å; Q120-F130 VanDerWaalsContact NE2-CD1 3.26Å; Q120-H221 WeakPolarHBondContact O-CA 3.22Å; Q120-C222 HydrophobicContact CB-CB 4.45Å; Q120-C222 PolarHBondContact N-O 2.93Å; Q120-C222 PolarHBondContact O-N 3.35Å
121	Y	91.7	Very high	77.9	Confident	40 Å²	40	43.9 Å²	43.9	16%	0.157	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	145.4	-179.7	-54	-82.7	0	0	0	110.2	I89 K92 L94 I119 Y181 H221	I89-Y121 WeakPolarHBondContact CA-OH 3.39Å; I89-Y121 HydrophobicContact CG2-CE1 4.15Å; I89-Y121 WeakPolarHBondContact O-CE1 3.41Å; K92-Y121 HydrophobicContact CB-CD1 4.01Å; K92-Y121 HydrophobicContact CB-CD2 4.08Å; K92-Y121 HydrophobicContact CB-CE1 4.22Å; K92-Y121 HydrophobicContact CB-CE2 4.27Å; K92-Y121 HydrophobicContact CB-CG 3.96Å; K92-Y121 HydrophobicContact CD-CD1 4.41Å; K92-Y121 HydrophobicContact CD-CG 4.48Å; K92-Y121 HydrophobicContact CG-CD1 3.82Å; K92-Y121 HydrophobicContact CG-CE1 4.19Å; K92-Y121 HydrophobicContact CG-CG 4.14Å; L94-Y121 WeakPolarHBondContact O-CE2 3.28Å; L94-Y121 PolarHBondContact O-OH 2.9Å; I119-Y121 HydrophobicContact CG2-CE1 3.89Å; I119-Y121 HydrophobicContact CG2-CE2 4.15Å; Y121-Y181 HydrophobicContact CD2-CD2 4.2Å; Y121-Y181 AromaticContact CD2-CE2 3.73Å; Y121-Y181 HydrophobicContact CD2-CE2 3.73Å; Y121-Y181 HydrophobicContact CE2-CD2 4.05Å; Y121-Y181 AromaticContact CE2-CE2 3.68Å; Y121-Y181 HydrophobicContact CE2-CE2 3.68Å; Y121-H221 AromaticContact CD1-CD2 3.3Å; Y121-H221 WeakPolarHBondContact CD1-CD2 3.32Å; Y121-H221 AromaticContact CD1-NE2 3.52Å; Y121-H221 AromaticContact CE1-CD2 3.41Å; Y121-H221 VanDerWaalsContact CE1-CD2 3.41Å; Y121-H221 WeakPolarHBondContact CE1-CD2 3.19Å; Y121-H221 AromaticContact CE1-NE2 3.61Å
122	T	82.9	Confident	75.6	Confident	26 Å²	26	47.9 Å²	47.9	16%	0.16	26%	0.255	C	S	.	.			trans	-119.1	145	168.3	38.9	0	0	0	0	111.7	T126 V128 P219 Y220	T122-T126 VanDerWaalsContact CB-O 3.31Å; T122-T126 WeakPolarHBondContact CB-O 3.27Å; T122-T126 WeakPolarHBondContact CG2-O 3.34Å; T122-T126 PolarHBondContact OG1-O 3.47Å; T122-T126 VanDerWaalsContact OG1-O 3.1Å; T122-V128 HydrophobicContact CG2-CB 4.22Å; T122-V128 HydrophobicContact CG2-CG1 3.2Å; T122-P219 PolarHBondContact OG1-O 3.01Å; T122-Y220 PolarHBondContact N-O 2.97Å; T122-Y220 WeakPolarHBondContact OG1-CA 3.46Å; T122-Y220 PolarHBondContact OG1-O 2.81Å
123	T	67.3	Low	73.1	Confident	131 Å²	131	52.7 Å²	52.7	80%	0.804	28%	0.284	S	S	*	.	S	Bend	trans	-87.5	-20.9	-175.5	39.2	0	0	0	0	113.8
124	E	60.7	Low	70.5	Confident	165 Å²	165	59.1 Å²	59.1	77%	0.771	32%	0.319	S	S	*	.	S	Bend	trans	-124.2	18.1	-173.4	-61.5	-157.5	175.8	0	0	114.4	T126	E124-T126 WeakPolarHBondContact CB-OG1 3.37Å; E124-T126 PolarHBondContact O-N 3.47Å; E124-T126 VanDerWaalsContact O-N 3.13Å
125	G	53.3	Low	67.8	Low	21 Å²	21	65.3 Å²	65.3	22%	0.216	35%	0.353	C	S	.	.	S	Bend	trans	65.6	14	-175.4	0	0	0	0	0	113.4	P219	G125-P219 CarbonylContact C-O 3.49Å; G125-P219 WeakPolarHBondContact CA-O 3.22Å
126	T	54.6	Low	65.2	Low	87 Å²	87	73.9 Å²	73.9	53%	0.534	40%	0.399	S	S	.	.			trans	-86.3	150.6	176.6	-8.9	0	0	0	0	110.4	T122 E124 V128	T122-T126 VanDerWaalsContact CB-O 3.31Å; T122-T126 WeakPolarHBondContact CB-O 3.27Å; T122-T126 WeakPolarHBondContact CG2-O 3.34Å; T122-T126 PolarHBondContact OG1-O 3.47Å; T122-T126 VanDerWaalsContact OG1-O 3.1Å; E124-T126 WeakPolarHBondContact CB-OG1 3.37Å; E124-T126 PolarHBondContact O-N 3.47Å; E124-T126 VanDerWaalsContact O-N 3.13Å; T126-V128 PolarHBondContact O-N 3.37Å
127	Q	54.5	Low	62.3	Low	72 Å²	72	81.6 Å²	81.6	34%	0.336	44%	0.435	S	S	.	.			trans	-53.5	118.5	-168.5	-170.8	175.1	-1.6	0	0	113.7	S140 T142	Q127-S140 PolarHBondContact NE2-O 2.96Å; Q127-S140 PolarHBondContact OE1-O 2.79Å; Q127-S140 VanDerWaalsContact OE1-O 3.04Å; Q127-T142 PolarHBondContact NE2-OG1 3.47Å
128	V	52.8	Low	59.3	Low	12 Å²	12	90.5 Å²	90.5	7%	0.073	47%	0.474	C	S	.	.			trans	-85.9	108.9	169.3	-94.7	0	0	0	0	109.1	Q120 T122 T126 T218 C222	Q120-V128 HydrophobicContact CB-CG1 4.11Å; T122-V128 HydrophobicContact CG2-CB 4.22Å; T122-V128 HydrophobicContact CG2-CG1 3.2Å; T126-V128 PolarHBondContact O-N 3.37Å; V128-T218 WeakPolarHBondContact CG2-O 3.43Å; V128-C222 HydrophobicContact CB-CB 3.55Å; V128-C222 HydrophobicContact CG1-CB 4.32Å; V128-C222 HydrophobicContact CG2-CB 3.43Å; V128-C222 VanDerWaalsContact CG2-CB 3.43Å
129	D	52.6	Low	56.8	Low	44 Å²	44	96.4 Å²	96.4	24%	0.235	51%	0.506	C	S	.	.			trans	-118.6	133.1	161.3	-158.6	-18.8	0	0	0	110.3	E131 S132 K215	D129-E131 PolarHBondContact O-N 3.13Å; D129-E131 VanDerWaalsContact O-N 3.11Å; D129-E131 PolarHBondContact OD1-N 2.9Å; D129-S132 WeakPolarHBondContact O-CB 3.18Å; D129-S132 PolarHBondContact O-N 3.08Å; D129-S132 PolarHBondContact O-OG 2.71Å; D129-K215 IonicContact OD1-NZ 3.25Å; D129-K215 PolarHBondContact OD1-NZ 3.22Å; D129-K215 IonicContact OD2-NZ 2.77Å; D129-K215 PolarHBondContact OD2-NZ 3.12Å
130	F	55.2	Low	53.8	Low	54 Å²	54	99.8 Å²	99.8	24%	0.237	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-18.4	170.8	-83.2	-90.8	0	0	0	112.7	K118 Q120 C222 K224	K118-F130 HydrophobicContact CB-CE1 3.85Å; K118-F130 HydrophobicContact CB-CZ 3.78Å; K118-F130 HydrophobicContact CD-CE1 4.41Å; Q120-F130 HydrophobicContact CB-CZ 4.5Å; Q120-F130 HydrophobicContact CG-CD1 4.33Å; Q120-F130 HydrophobicContact CG-CE1 3.79Å; Q120-F130 HydrophobicContact CG-CE2 4.15Å; Q120-F130 HydrophobicContact CG-CZ 3.68Å; Q120-F130 VanDerWaalsContact NE2-CD1 3.26Å; F130-C222 HydrophobicContact CE2-CB 4.2Å; F130-C222 VanDerWaalsContact CE2-SG 3.57Å; F130-K224 HydrophobicContact CD1-CD 4.27Å; F130-K224 HydrophobicContact CD2-CB 3.92Å; F130-K224 HydrophobicContact CD2-CD 4.42Å; F130-K224 HydrophobicContact CE1-CB 4.13Å; F130-K224 HydrophobicContact CE1-CD 4.42Å; F130-K224 HydrophobicContact CE2-CB 3.38Å; F130-K224 HydrophobicContact CG-CD 4.27Å; F130-K224 HydrophobicContact CZ-CB 3.5Å
131	E	50.7	Low	51.1	Low	144 Å²	144	103.8 Å²	103.8	67%	0.673	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	3.7	-177.8	-67.5	163.1	-141.1	0	0	113.8	D129 T133 K215	D129-E131 PolarHBondContact O-N 3.13Å; D129-E131 VanDerWaalsContact O-N 3.11Å; D129-E131 PolarHBondContact OD1-N 2.9Å; E131-T133 VanDerWaalsContact C-N 3.26Å; E131-T133 PolarHBondContact O-N 2.79Å; E131-K215 IonicContact OE1-NZ 3.31Å; E131-K215 PolarHBondContact OE1-NZ 3.07Å
132	S	45.5	Very low	48.6	Very low	86 Å²	86	105.9 Å²	105.9	60%	0.601	58%	0.575	S	S	*	*			trans	-84.4	48.4	-170.6	-40.5	0	0	0	0	114.2	D129	D129-S132 WeakPolarHBondContact O-CB 3.18Å; D129-S132 PolarHBondContact O-N 3.08Å; D129-S132 PolarHBondContact O-OG 2.71Å
133	T	42.8	Very low	46.6	Very low	104 Å²	104	108.9 Å²	108.9	64%	0.638	60%	0.596	S	S	*	*	S	Bend	trans	-139.1	56	167.7	-47.8	0	0	0	0	109.6	E131	E131-T133 VanDerWaalsContact C-N 3.26Å; E131-T133 PolarHBondContact O-N 2.79Å
134	N	40.5	Very low	45.8	Very low	136 Å²	136	106.7 Å²	106.7	73%	0.727	58%	0.576	S	S	*	*	S	Bend	trans	179.8	137.3	137.8	-100.4	-46.3	0	0	0	110
135	N	37.6	Very low	45.4	Very low	146 Å²	146	101.4 Å²	101.4	78%	0.781	57%	0.565	S	S	*	*			trans	93.4	111.8	171.4	-54.8	-27	0	0	0	117.1	Q137	N135-Q137 PolarHBondContact O-N 3.45Å
136	N	43.3	Very low	46.2	Very low	180 Å²	180	104 Å²	104	96%	0.963	57%	0.574	S	S	*	*			trans	-58.9	74.9	161.8	-76.9	-38	0	0	0	111.7
137	Q	36.7	Very low	47.6	Very low	179 Å²	179	100.2 Å²	100.2	84%	0.836	55%	0.551	S	S	*	*			trans	-140	97.9	169.6	-136.6	173.6	56.4	0	0	111.7	N135	N135-Q137 PolarHBondContact O-N 3.45Å
138	K	35.5	Very low	49	Very low	192 Å²	192	99 Å²	99	84%	0.835	54%	0.544	S	S	*	.			trans	52.1	113.8	138.7	-145	175.6	-172.3	-178.3	0	116.7	S140	K138-S140 PolarHBondContact O-N 2.89Å
139	L	43.5	Very low	50.6	Low	157 Å²	157	105.1 Å²	105.1	82%	0.822	57%	0.569	S	S	*	*			trans	-30.4	100.8	165.3	-79.8	91.6	0	0	0	112.1	T141	L139-T141 PolarHBondContact O-N 3Å
140	S	33.8	Very low	52.4	Low	72 Å²	72	104.6 Å²	104.6	50%	0.503	57%	0.571	S	S	.	*			trans	-85.3	98.1	154.7	58.5	0	0	0	0	106.5	Q127 K138 T142	Q127-S140 PolarHBondContact NE2-O 2.96Å; Q127-S140 PolarHBondContact OE1-O 2.79Å; Q127-S140 VanDerWaalsContact OE1-O 3.04Å; K138-S140 PolarHBondContact O-N 2.89Å; S140-T142 PolarHBondContact O-N 3.25Å
141	T	36.8	Very low	54	Low	131 Å²	131	102 Å²	102	80%	0.804	56%	0.56	S	S	*	*			trans	-55.9	75	157.7	37.8	0	0	0	0	109.3	L139 S143	L139-T141 PolarHBondContact O-N 3Å; T141-S143 PolarHBondContact O-N 3.06Å
142	T	40.3	Very low	55.8	Low	85 Å²	85	95.7 Å²	95.7	52%	0.521	53%	0.53	S	S	.	.			trans	-78.6	106	166.2	49.5	0	0	0	0	106.4	Q127 S140 F144	Q127-T142 PolarHBondContact NE2-OG1 3.47Å; S140-T142 PolarHBondContact O-N 3.25Å; T142-F144 PolarHBondContact O-N 2.86Å
143	S	41.1	Very low	58	Low	88 Å²	88	96 Å²	96	62%	0.615	52%	0.524	S	S	*	.			trans	-25.7	111.6	177	176	0	0	0	0	114.4	T141 G145	T141-S143 PolarHBondContact O-N 3.06Å; S143-G145 PolarHBondContact O-N 3.3Å; S143-G145 VanDerWaalsContact O-N 3.09Å; S143-G145 PolarHBondContact OG-N 3.28Å
144	F	49.8	Very low	60.3	Low	86 Å²	86	91.3 Å²	91.3	38%	0.377	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-62.5	-5.2	168.4	-90.9	-76.7	0	0	0	113.6	T142 N146 P219	T142-F144 PolarHBondContact O-N 2.86Å; F144-N146 PolarHBondContact O-N 2.78Å; F144-P219 HydrophobicContact CD1-CG 3.67Å; F144-P219 VanDerWaalsContact CE1-CA 3.45Å; F144-P219 HydrophobicContact CE1-CB 4.05Å; F144-P219 HydrophobicContact CE1-CG 3.62Å; F144-P219 HydrophobicContact CG-CG 4.27Å; F144-P219 HydrophobicContact CZ-CB 4.16Å; F144-P219 HydrophobicContact CZ-CG 4.11Å
145	G	51.8	Low	62.7	Low	53 Å²	53	84.9 Å²	84.9	55%	0.546	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-73.1	10.8	-177.6	0	0	0	0	0	116	S143	S143-G145 PolarHBondContact O-N 3.3Å; S143-G145 VanDerWaalsContact O-N 3.09Å; S143-G145 PolarHBondContact OG-N 3.28Å
146	N	70.9	Confident	65.3	Low	75 Å²	75	82.1 Å²	82.1	40%	0.401	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-125.6	11.8	-177.1	-71.1	-28.1	0	0	0	114.4	F144 R148 K149 A150	F144-N146 PolarHBondContact O-N 2.78Å; N146-R148 VanDerWaalsContact C-N 3.27Å; N146-R148 PolarHBondContact O-N 3.27Å; N146-K149 HydrophobicContact CB-CB 4.38Å; N146-K149 PolarHBondContact O-N 2.91Å; N146-K149 VanDerWaalsContact O-N 3.11Å; N146-K149 WeakPolarHBondContact OD1-CD 3.47Å; N146-K149 PolarHBondContact OD1-NZ 3.29Å; N146-A150 WeakPolarHBondContact O-CB 3.41Å; N146-A150 PolarHBondContact O-N 2.61Å
147	T	83.8	Confident	67.6	Low	8 Å²	8	78 Å²	78	5%	0.049	41%	0.414	C	S	.	.	H	α-helix	trans	-51.2	-47.5	176.6	-58.2	0	0	0	0	111.6	V20 V29 A150 S151 V216 A217 T218	V20-T147 HydrophobicContact CG2-CG2 4.39Å; V29-T147 HydrophobicContact CG1-CG2 4.08Å; T147-A150 PolarHBondContact O-N 2.87Å; T147-S151 WeakPolarHBondContact O-CB 3.47Å; T147-S151 PolarHBondContact O-N 3.3Å; T147-S151 PolarHBondContact O-OG 2.94Å; T147-V216 HydrophobicContact CG2-CG1 3.98Å; T147-A217 PolarHBondContact OG1-O 2.88Å; T147-A217 VanDerWaalsContact OG1-O 3.13Å; T147-T218 HydrophobicContact CG2-CG2 3.62Å
148	R	84.2	Confident	70.2	Confident	48 Å²	48	69.5 Å²	69.5	18%	0.181	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-50.4	177.6	-171.8	179.1	-177.8	-152.7	-0.5	111.4	D18 E59 N146 A150 S151 I152	D18-R148 VanDerWaalsContact CG-NH1 3.34Å; D18-R148 WeakPolarHBondContact OD1-CD 3.39Å; D18-R148 IonicContact OD1-CZ 3.34Å; D18-R148 IonicContact OD1-NE 3.88Å; D18-R148 PolarHBondContact OD1-NE 3.23Å; D18-R148 IonicContact OD1-NH1 3.27Å; D18-R148 PolarHBondContact OD1-NH1 2.72Å; D18-R148 IonicContact OD2-CZ 3.99Å; D18-R148 IonicContact OD2-NH1 2.9Å; D18-R148 PolarHBondContact OD2-NH1 2.89Å; E59-R148 VanDerWaalsContact CD-CZ 3.4Å; E59-R148 IonicContact OE1-CZ 2.93Å; E59-R148 IonicContact OE1-NE 2.63Å; E59-R148 PolarHBondContact OE1-NE 2.87Å; E59-R148 IonicContact OE1-NH1 2.81Å; E59-R148 PolarHBondContact OE1-NH1 3.42Å; E59-R148 IonicContact OE1-NH2 2.61Å; E59-R148 PolarHBondContact OE1-NH2 3.43Å; E59-R148 IonicContact OE2-CZ 2.8Å; E59-R148 IonicContact OE2-NH2 3.98Å; E59-R148 PolarHBondContact OE2-NH2 3.08Å; N146-R148 VanDerWaalsContact C-N 3.27Å; N146-R148 PolarHBondContact O-N 3.27Å; R148-A150 PolarHBondContact O-N 2.96Å; R148-S151 WeakPolarHBondContact O-CB 3.45Å; R148-S151 PolarHBondContact O-N 2.89Å; R148-I152 HydrophobicContact CG-CD1 3.86Å; R148-I152 VanDerWaalsContact O-CD1 3.32Å; R148-I152 WeakPolarHBondContact O-CD1 3.35Å; R148-I152 VanDerWaalsContact O-CG1 3.25Å; R148-I152 WeakPolarHBondContact O-CG1 3.4Å; R148-I152 PolarHBondContact O-N 2.99Å
149	K	86.9	Confident	72.8	Confident	140 Å²	140	61.1 Å²	61.1	61%	0.609	34%	0.337	S	S	*	.	H	α-helix	trans	-60.7	-43.6	177.8	-66.6	-175.2	-170.8	161.1	0	112.7	N146 S151 I152 L153	N146-K149 HydrophobicContact CB-CB 4.38Å; N146-K149 PolarHBondContact O-N 2.91Å; N146-K149 VanDerWaalsContact O-N 3.11Å; N146-K149 WeakPolarHBondContact OD1-CD 3.47Å; N146-K149 PolarHBondContact OD1-NZ 3.29Å; K149-S151 VanDerWaalsContact C-N 3.31Å; K149-S151 PolarHBondContact O-N 3.1Å; K149-I152 PolarHBondContact O-N 2.82Å; K149-L153 VanDerWaalsContact O-CB 3.3Å; K149-L153 WeakPolarHBondContact O-CB 3.5Å; K149-L153 PolarHBondContact O-N 3.31Å
150	A	88.9	Confident	75	Confident	32 Å²	32	58 Å²	58	26%	0.264	32%	0.324	S	S	.	.	H	α-helix	trans	-63.1	-40.1	176.6	0	0	0	0	0	111.3	N146 T147 R148 L153 L154 V216	N146-A150 WeakPolarHBondContact O-CB 3.41Å; N146-A150 PolarHBondContact O-N 2.61Å; T147-A150 PolarHBondContact O-N 2.87Å; R148-A150 PolarHBondContact O-N 2.96Å; A150-L153 PolarHBondContact O-N 2.81Å; A150-L154 WeakPolarHBondContact O-CB 3.46Å; A150-L154 PolarHBondContact O-N 2.82Å; A150-V216 HydrophobicContact CB-CG2 4.17Å
151	S	89.1	Confident	77.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-46.8	175.4	-56.1	0	0	0	0	111.8	T147 R148 K149 L153 L154 V155 V216	T147-S151 WeakPolarHBondContact O-CB 3.47Å; T147-S151 PolarHBondContact O-N 3.3Å; T147-S151 PolarHBondContact O-OG 2.94Å; R148-S151 WeakPolarHBondContact O-CB 3.45Å; R148-S151 PolarHBondContact O-N 2.89Å; K149-S151 VanDerWaalsContact C-N 3.31Å; K149-S151 PolarHBondContact O-N 3.1Å; S151-L153 VanDerWaalsContact C-N 3.34Å; S151-L153 PolarHBondContact O-N 2.96Å; S151-L154 PolarHBondContact O-N 3.22Å; S151-V155 WeakPolarHBondContact O-CG2 3.39Å; S151-V155 PolarHBondContact O-N 3Å; S151-V216 WeakPolarHBondContact OG-CG1 3.47Å
152	I	88.9	Confident	80.1	Confident	11 Å²	11	50 Å²	50	6%	0.056	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-45	176.1	-64.5	152.7	0	0	0	110.3	V58 E59 R148 K149 L154 V155 R156	V58-I152 HydrophobicContact CG1-CG1 4.09Å; E59-I152 HydrophobicContact CB-CD1 4.49Å; E59-I152 HydrophobicContact CG-CD1 3.41Å; E59-I152 VanDerWaalsContact CG-CD1 3.41Å; E59-I152 HydrophobicContact CG-CG1 4.06Å; R148-I152 HydrophobicContact CG-CD1 3.86Å; R148-I152 VanDerWaalsContact O-CD1 3.32Å; R148-I152 WeakPolarHBondContact O-CD1 3.35Å; R148-I152 VanDerWaalsContact O-CG1 3.25Å; R148-I152 WeakPolarHBondContact O-CG1 3.4Å; R148-I152 PolarHBondContact O-N 2.99Å; K149-I152 PolarHBondContact O-N 2.82Å; I152-L154 VanDerWaalsContact C-N 3.32Å; I152-L154 PolarHBondContact O-N 3.2Å; I152-V155 PolarHBondContact O-N 2.89Å; I152-R156 HydrophobicContact CG2-CG 4.37Å; I152-R156 VanDerWaalsContact CG2-CZ 3.48Å; I152-R156 WeakPolarHBondContact O-CG 3.35Å; I152-R156 PolarHBondContact O-N 2.84Å
153	L	91.1	Very high	82.1	Confident	91 Å²	91	53.2 Å²	53.2	48%	0.476	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-41.6	178.5	-177.2	63.6	0	0	0	111.5	K149 A150 S151 R156 K157	K149-L153 VanDerWaalsContact O-CB 3.3Å; K149-L153 WeakPolarHBondContact O-CB 3.5Å; K149-L153 PolarHBondContact O-N 3.31Å; A150-L153 PolarHBondContact O-N 2.81Å; S151-L153 VanDerWaalsContact C-N 3.34Å; S151-L153 PolarHBondContact O-N 2.96Å; L153-R156 PolarHBondContact O-N 2.79Å; L153-K157 HydrophobicContact CG-CD 4.43Å; L153-K157 WeakPolarHBondContact O-CB 3.42Å; L153-K157 WeakPolarHBondContact O-CG 3.26Å; L153-K157 PolarHBondContact O-N 3.25Å
154	L	92.1	Very high	84.2	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-44.7	175.8	-173.5	154.4	0	0	0	111.2	L33 A150 S151 I152 K157 L158 V216 F225	L33-L154 HydrophobicContact CD1-CD2 4.32Å; A150-L154 WeakPolarHBondContact O-CB 3.46Å; A150-L154 PolarHBondContact O-N 2.82Å; S151-L154 PolarHBondContact O-N 3.22Å; I152-L154 VanDerWaalsContact C-N 3.32Å; I152-L154 PolarHBondContact O-N 3.2Å; L154-K157 PolarHBondContact O-N 2.63Å; L154-L158 WeakPolarHBondContact O-CB 3.46Å; L154-L158 PolarHBondContact O-N 3.44Å; L154-V216 HydrophobicContact CB-CG2 4.3Å; L154-V216 HydrophobicContact CD1-CG2 3.82Å; L154-F225 HydrophobicContact CD1-CB 3.99Å; L154-F225 HydrophobicContact CD2-CD1 3.86Å; L154-F225 HydrophobicContact CG-CD1 4.25Å
155	V	91.5	Very high	86	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-62.9	-45.1	176.2	172.8	0	0	0	0	111.2	L33 I36 Q61 V63 S151 I152 L158 Y159	L33-V155 HydrophobicContact CD1-CG2 4.31Å; I36-V155 HydrophobicContact CG2-CG1 4.43Å; I36-V155 HydrophobicContact CG2-CG2 3.9Å; Q61-V155 HydrophobicContact CG-CG1 4.33Å; V63-V155 HydrophobicContact CG1-CG1 3.64Å; S151-V155 WeakPolarHBondContact O-CG2 3.39Å; S151-V155 PolarHBondContact O-N 3Å; I152-V155 PolarHBondContact O-N 2.89Å; V155-L158 WeakPolarHBondContact O-CB 3.31Å; V155-L158 PolarHBondContact O-N 2.72Å; V155-Y159 HydrophobicContact CG1-CD2 4.11Å; V155-Y159 HydrophobicContact CG1-CE2 4.11Å; V155-Y159 VanDerWaalsContact O-CD2 3.27Å; V155-Y159 WeakPolarHBondContact O-CD2 3.47Å; V155-Y159 PolarHBondContact O-N 2.76Å
156	R	91.6	Very high	87.8	Confident	88 Å²	88	46.1 Å²	46.1	33%	0.332	23%	0.233	S	C	.	.	H	α-helix	trans	-61.5	-47.6	176.5	-73.7	-173.7	-175.5	135.1	-9.4	111.7	D60 Q61 I152 L153 L158 Y159 T160	D60-R156 IonicContact OD1-CZ 3.67Å; D60-R156 IonicContact OD1-NE 2.68Å; D60-R156 IonicContact OD1-NH2 2.8Å; D60-R156 PolarHBondContact OD1-NH2 2.94Å; D60-R156 IonicContact OD2-CZ 2.76Å; D60-R156 IonicContact OD2-NH2 2.75Å; D60-R156 PolarHBondContact OD2-NH2 2.84Å; Q61-R156 HydrophobicContact CG-CG 4.46Å; I152-R156 HydrophobicContact CG2-CG 4.37Å; I152-R156 VanDerWaalsContact CG2-CZ 3.48Å; I152-R156 WeakPolarHBondContact O-CG 3.35Å; I152-R156 PolarHBondContact O-N 2.84Å; L153-R156 PolarHBondContact O-N 2.79Å; R156-L158 VanDerWaalsContact C-N 3.3Å; R156-L158 PolarHBondContact O-N 2.84Å; R156-Y159 PolarHBondContact O-N 2.87Å; R156-Y159 VanDerWaalsContact O-N 3.11Å; R156-T160 PolarHBondContact O-N 3.27Å; R156-T160 PolarHBondContact O-OG1 2.91Å; R156-T160 VanDerWaalsContact O-OG1 3.09Å
157	K	92.1	Very high	88.7	Confident	93 Å²	93	47.3 Å²	47.3	40%	0.404	25%	0.245	S	C	.	.	H	α-helix	trans	-57	-42.9	175.7	-79.6	-178.3	172.7	-172.6	0	112.3	L153 L154 L161 M213	L153-K157 HydrophobicContact CG-CD 4.43Å; L153-K157 WeakPolarHBondContact O-CB 3.42Å; L153-K157 WeakPolarHBondContact O-CG 3.26Å; L153-K157 PolarHBondContact O-N 3.25Å; L154-K157 PolarHBondContact O-N 2.63Å; K157-L161 WeakPolarHBondContact O-CB 3.46Å; K157-L161 PolarHBondContact O-N 3.2Å; K157-M213 WeakPolarHBondContact CD-O 3.27Å; K157-M213 PolarHBondContact NZ-O 3.33Å
158	L	91.4	Very high	89	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-53.4	173.7	169.7	63	0	0	0	110.4	A37 I41 L154 V155 R156 T160 L161 M162 M213 F225	A37-L158 HydrophobicContact CB-CD2 4.24Å; I41-L158 HydrophobicContact CD1-CD1 4.49Å; I41-L158 HydrophobicContact CG1-CD1 3.74Å; I41-L158 HydrophobicContact CG1-CD2 4.26Å; L154-L158 WeakPolarHBondContact O-CB 3.46Å; L154-L158 PolarHBondContact O-N 3.44Å; V155-L158 WeakPolarHBondContact O-CB 3.31Å; V155-L158 PolarHBondContact O-N 2.72Å; R156-L158 VanDerWaalsContact C-N 3.3Å; R156-L158 PolarHBondContact O-N 2.84Å; L158-T160 PolarHBondContact O-N 3.41Å; L158-L161 PolarHBondContact O-N 3.46Å; L158-M162 HydrophobicContact CD1-CE 3.68Å; L158-M162 HydrophobicContact CD1-CG 3.84Å; L158-M162 HydrophobicContact CD1-SD 4.27Å; L158-M162 HydrophobicContact CG-CG 4.48Å; L158-M162 VanDerWaalsContact O-CG 3.22Å; L158-M162 WeakPolarHBondContact O-CG 3.37Å; L158-M162 PolarHBondContact O-N 3.08Å; L158-M213 HydrophobicContact CD1-CE 4.46Å; L158-F225 HydrophobicContact CB-CE1 4.28Å; L158-F225 HydrophobicContact CD1-CE1 3.89Å; L158-F225 HydrophobicContact CD1-CZ 4.06Å; L158-F225 HydrophobicContact CG-CE1 4.46Å
159	Y	89.4	Confident	89.2	Confident	15 Å²	15	48.2 Å²	48.2	6%	0.059	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-42.1	-177.4	-85.3	-115.5	0	0	0	112.5	L44 V63 M64 V155 R156 Q163	L44-Y159 HydrophobicContact CD1-CD1 3.78Å; L44-Y159 HydrophobicContact CD1-CD2 3.79Å; L44-Y159 HydrophobicContact CD1-CE1 3.94Å; L44-Y159 HydrophobicContact CD1-CE2 3.95Å; L44-Y159 HydrophobicContact CD1-CG 3.71Å; L44-Y159 HydrophobicContact CD2-CD1 3.99Å; L44-Y159 HydrophobicContact CD2-CE1 4.09Å; L44-Y159 HydrophobicContact CG-CD1 4.38Å; L44-Y159 HydrophobicContact CG-CE1 4.29Å; V63-Y159 WeakPolarHBondContact CA-OH 3.46Å; V63-Y159 HydrophobicContact CG1-CE2 4.35Å; M64-Y159 PolarHBondContact N-OH 3.49Å; V155-Y159 HydrophobicContact CG1-CD2 4.11Å; V155-Y159 HydrophobicContact CG1-CE2 4.11Å; V155-Y159 VanDerWaalsContact O-CD2 3.27Å; V155-Y159 WeakPolarHBondContact O-CD2 3.47Å; V155-Y159 PolarHBondContact O-N 2.76Å; R156-Y159 PolarHBondContact O-N 2.87Å; R156-Y159 VanDerWaalsContact O-N 3.11Å; Y159-Q163 WeakPolarHBondContact O-CG 3.25Å; Y159-Q163 PolarHBondContact O-N 3.27Å
160	T	89.9	Confident	89.1	Confident	91 Å²	91	49.3 Å²	49.3	56%	0.558	27%	0.268	S	S	*	.	H	α-helix	trans	-63.8	-45.5	176.4	-58	0	0	0	0	111.8	R156 L158 Q163 S164	R156-T160 PolarHBondContact O-N 3.27Å; R156-T160 PolarHBondContact O-OG1 2.91Å; R156-T160 VanDerWaalsContact O-OG1 3.09Å; L158-T160 PolarHBondContact O-N 3.41Å; T160-Q163 WeakPolarHBondContact O-CB 3.31Å; T160-Q163 PolarHBondContact O-N 2.87Å; T160-S164 PolarHBondContact O-N 3.16Å
161	L	88.8	Confident	89.1	Confident	29 Å²	29	54.1 Å²	54.1	15%	0.152	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-41.1	179.3	-172.8	78.3	0	0	0	111.5	K157 L158 Q163 S164 L165 L211 M213 M227	K157-L161 WeakPolarHBondContact O-CB 3.46Å; K157-L161 PolarHBondContact O-N 3.2Å; L158-L161 PolarHBondContact O-N 3.46Å; L161-Q163 PolarHBondContact O-N 3.06Å; L161-Q163 VanDerWaalsContact O-N 3.12Å; L161-S164 PolarHBondContact O-N 3.25Å; L161-S164 PolarHBondContact O-OG 3.48Å; L161-L165 WeakPolarHBondContact O-CG 2.82Å; L161-L165 PolarHBondContact O-N 2.97Å; L161-L211 HydrophobicContact CD1-CD1 3.81Å; L161-L211 HydrophobicContact CD2-CD1 3.62Å; L161-L211 HydrophobicContact CG-CD1 4.34Å; L161-M213 HydrophobicContact CB-CE 3.94Å; L161-M213 HydrophobicContact CB-SD 4.48Å; L161-M213 HydrophobicContact CD2-CE 3.1Å; L161-M213 HydrophobicContact CD2-SD 4.01Å; L161-M213 HydrophobicContact CG-CE 4.13Å; L161-M227 HydrophobicContact CD2-CE 4.2Å; L161-M227 HydrophobicContact CD2-CG 4.24Å; L161-M227 HydrophobicContact CD2-SD 3.28Å; L161-M227 WeakPolarHBondContact CD2-SD 3.35Å
162	M	88.1	Confident	89.3	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.039	30%	0.301	C	S	.	.	H	α-helix	trans	-59.5	-27.7	178.4	-67.2	-59.5	115	0	0	112.3	L44 R45 Y115 L158 L165 M213 M227	L44-M162 HydrophobicContact CB-CB 3.7Å; L44-M162 HydrophobicContact CB-CG 3.86Å; L44-M162 HydrophobicContact CD1-CB 3.73Å; L44-M162 HydrophobicContact CD1-CG 3.63Å; L44-M162 HydrophobicContact CG-CB 4.21Å; L44-M162 HydrophobicContact CG-CG 4.37Å; R45-M162 HydrophobicContact CG-SD 4.09Å; Y115-M162 HydrophobicContact CE1-CE 3.6Å; Y115-M162 HydrophobicContact CE1-SD 4.25Å; L158-M162 HydrophobicContact CD1-CE 3.68Å; L158-M162 HydrophobicContact CD1-CG 3.84Å; L158-M162 HydrophobicContact CD1-SD 4.27Å; L158-M162 HydrophobicContact CG-CG 4.48Å; L158-M162 VanDerWaalsContact O-CG 3.22Å; L158-M162 WeakPolarHBondContact O-CG 3.37Å; L158-M162 PolarHBondContact O-N 3.08Å; M162-L165 HydrophobicContact CE-CD1 3.8Å; M162-L165 HydrophobicContact SD-CD1 4.04Å; M162-M213 HydrophobicContact CE-CE 4.27Å; M162-M227 HydrophobicContact CE-CE 4.11Å; M162-M227 HydrophobicContact CE-SD 3.63Å
163	Q	82.3	Confident	89.5	Confident	151 Å²	151	56.9 Å²	56.9	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-73.5	-24.8	173.8	-68.3	168.9	-1.9	0	0	113.3	Y159 T160 L161	Y159-Q163 WeakPolarHBondContact O-CG 3.25Å; Y159-Q163 PolarHBondContact O-N 3.27Å; T160-Q163 WeakPolarHBondContact O-CB 3.31Å; T160-Q163 PolarHBondContact O-N 2.87Å; L161-Q163 PolarHBondContact O-N 3.06Å; L161-Q163 VanDerWaalsContact O-N 3.12Å
164	S	85.1	Confident	89.7	Confident	55 Å²	55	53.9 Å²	53.9	39%	0.385	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-1	176.4	70.2	0	0	0	0	113.5	T160 L161	T160-S164 PolarHBondContact O-N 3.16Å; L161-S164 PolarHBondContact O-N 3.25Å; L161-S164 PolarHBondContact O-OG 3.48Å
165	L	89.2	Confident	89.8	Confident	15 Å²	15	53.7 Å²	53.7	8%	0.079	29%	0.291	C	S	.	.	S	Bend	trans	-95.9	132.7	178.6	-65.1	176.5	0	0	0	111	E113 L161 M162 M227 T229 L234	E113-L165 WeakPolarHBondContact OE1-CD1 3.24Å; L161-L165 WeakPolarHBondContact O-CG 2.82Å; L161-L165 PolarHBondContact O-N 2.97Å; M162-L165 HydrophobicContact CE-CD1 3.8Å; M162-L165 HydrophobicContact SD-CD1 4.04Å; L165-M227 HydrophobicContact CD1-CE 3.78Å; L165-T229 HydrophobicContact CD2-CG2 3.84Å; L165-L234 HydrophobicContact CD2-CD1 4.08Å
166	G	88.3	Confident	89.9	Confident	8 Å²	8	53.8 Å²	53.8	8%	0.082	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-57.1	157.2	171	0	0	0	0	0	113.3	R45 R233	R45-G166 PolarHBondContact NH1-O 3.17Å; R45-G166 PolarHBondContact NH2-O 3.32Å; G166-R233 PolarHBondContact N-O 2.9Å; G166-R233 PolarHBondContact O-NH1 2.87Å
167	P	89.3	Confident	90.1	Very high	100 Å²	100	49.8 Å²	49.8	65%	0.649	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-62.1	148.2	-174.7	27.2	-35.5	0	0	0	112.1	R233	P167-R233 PolarHBondContact O-NH1 3.48Å
168	L	91.3	Very high	90.3	Very high	27 Å²	27	45.3 Å²	45.3	14%	0.141	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-65	155.7	169.3	-74.4	179.4	0	0	0	110.9	R45 I47 I101 V172	R45-L168 HydrophobicContact CB-CD1 3.76Å; R45-L168 HydrophobicContact CB-CG 4.5Å; I47-L168 HydrophobicContact CD1-CD1 3.58Å; I101-L168 HydrophobicContact CD1-CD1 3.87Å; I101-L168 HydrophobicContact CD1-CD2 4.26Å; I101-L168 HydrophobicContact CG2-CD1 4.24Å; I101-L168 HydrophobicContact CG2-CD2 4.01Å; L168-V172 HydrophobicContact CB-CG1 4.14Å; L168-V172 HydrophobicContact CD1-CG1 4.34Å; L168-V172 HydrophobicContact CD1-CG2 4.22Å; L168-V172 HydrophobicContact CD2-CG1 4.44Å
169	P	88.3	Confident	90.4	Very high	48 Å²	48	45.3 Å²	45.3	31%	0.312	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-65.9	158.9	170.8	-10.9	32.4	0	0	0	109.4	T103 N171 V172 R233	T103-P169 HydrophobicContact CG2-CB 4.29Å; T103-P169 HydrophobicContact CG2-CG 3.84Å; P169-N171 PolarHBondContact O-N 3.46Å; P169-N171 VanDerWaalsContact O-N 3.17Å; P169-V172 HydrophobicContact CG-CG1 4.44Å; P169-R233 VanDerWaalsContact CG-NH2 3.35Å
170	D	84.6	Confident	90.7	Very high	163 Å²	163	45 Å²	45	87%	0.872	26%	0.255	S	S	*	.	S	Bend	trans	-58.4	-35.1	-173.4	-59.1	-25.7	0	0	0	113.8
171	N	89.8	Confident	90.9	Very high	134 Å²	134	43.9 Å²	43.9	72%	0.717	24%	0.241	S	C	*	.	S	Bend	trans	-114.3	108.7	-179.8	-59.7	-64.2	0	0	0	109.4	P169	P169-N171 PolarHBondContact O-N 3.46Å; P169-N171 VanDerWaalsContact O-N 3.17Å
172	V	93.2	Very high	90.9	Very high	43 Å²	43	44.9 Å²	44.9	26%	0.261	25%	0.247	S	C	.	.			trans	-127.5	149.3	174.7	-68.8	0	0	0	0	110.5	I47 I101 Y102 T103 L168 P169	I47-V172 HydrophobicContact CD1-CG2 4.02Å; I101-V172 HydrophobicContact CG2-CB 3.85Å; I101-V172 HydrophobicContact CG2-CG1 3.85Å; Y102-V172 WeakPolarHBondContact O-CA 3.35Å; T103-V172 HydrophobicContact CG2-CG1 4.39Å; L168-V172 HydrophobicContact CB-CG1 4.14Å; L168-V172 HydrophobicContact CD1-CG1 4.34Å; L168-V172 HydrophobicContact CD1-CG2 4.22Å; L168-V172 HydrophobicContact CD2-CG1 4.44Å; P169-V172 HydrophobicContact CG-CG1 4.44Å
173	C	93.3	Very high	90.9	Very high	26 Å²	26	52.1 Å²	52.1	18%	0.176	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	150.9	170.7	-61.3	0	0	0	0	108.9	I101 Y102	I101-C173 WeakPolarHBondContact CA-O 3.4Å; Y102-C173 HydrophobicContact CD1-CB 4.07Å; Y102-C173 VanDerWaalsContact CD1-O 3.31Å; Y102-C173 WeakPolarHBondContact CD1-O 3.45Å; Y102-C173 HydrophobicContact CD2-CB 3.89Å; Y102-C173 HydrophobicContact CE1-CB 3.53Å; Y102-C173 WeakPolarHBondContact CE1-O 3.43Å; Y102-C173 HydrophobicContact CE2-CB 3.4Å; Y102-C173 HydrophobicContact CG-CB 4.22Å; Y102-C173 PolarHBondContact N-O 3.2Å; Y102-C173 VanDerWaalsContact N-O 3.1Å; Y102-C173 PolarHBondContact O-N 3.22Å; Y102-C173 WeakPolarHBondContact OH-CB 3.42Å
174	L	94.4	Very high	91.3	Very high	28 Å²	28	48.9 Å²	48.9	15%	0.147	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.2	177.8	-162.5	71.4	0	0	0	109.8	T42 I78 W81 M99 S100 I101	T42-L174 HydrophobicContact CG2-CD2 4.41Å; I78-L174 HydrophobicContact CD1-CD2 3.36Å; I78-L174 HydrophobicContact CG1-CD2 4.48Å; W81-L174 HydrophobicContact CH2-CB 4.48Å; W81-L174 HydrophobicContact CZ3-CB 4.44Å; W81-L174 HydrophobicContact CZ3-CD2 3.86Å; W81-L174 HydrophobicContact CZ3-CG 4.02Å; M99-L174 HydrophobicContact CG-CD1 3.68Å; M99-L174 HydrophobicContact CG-CD2 4.31Å; M99-L174 HydrophobicContact CG-CG 4.07Å; M99-L174 HydrophobicContact SD-CD1 4.04Å; M99-L174 HydrophobicContact SD-CD2 3.94Å; M99-L174 HydrophobicContact SD-CG 4.33Å; S100-L174 WeakPolarHBondContact O-CA 3.38Å; S100-L174 WeakPolarHBondContact O-CD1 3.48Å; I101-L174 HydrophobicContact CG1-CD1 3.8Å
175	N	93.3	Very high	91.7	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	148.5	172.8	-173.1	17.4	0	0	0	109.7	M99 S100 Y102 P368	M99-N175 CarbonylContact C-O 3.5Å; M99-N175 WeakPolarHBondContact CA-O 3.31Å; S100-N175 PolarHBondContact N-O 2.96Å; S100-N175 PolarHBondContact O-N 2.84Å; S100-N175 PolarHBondContact OG-O 3.24Å; Y102-N175 HydrophobicContact CD1-CB 4.37Å; Y102-N175 HydrophobicContact CE1-CB 3.65Å; N175-P368 WeakPolarHBondContact OD1-CD 3.15Å; N175-P368 WeakPolarHBondContact OD1-CG 3.45Å
176	M	95	Very high	91.9	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.02	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	120.4	175.1	-174.8	170	-74.2	0	0	110.6	V38 W81 C85 I98 M99 L178 F194 P368	V38-M176 HydrophobicContact CG2-CE 4.43Å; W81-M176 HydrophobicContact CB-SD 3.78Å; W81-M176 HydrophobicContact CD2-CB 3.9Å; W81-M176 HydrophobicContact CE3-CB 3.54Å; W81-M176 HydrophobicContact CE3-CE 4.35Å; W81-M176 HydrophobicContact CE3-SD 4.44Å; W81-M176 HydrophobicContact CG-CB 4.39Å; W81-M176 HydrophobicContact CG-SD 4.47Å; W81-M176 HydrophobicContact CZ3-CB 3.99Å; C85-M176 VanDerWaalsContact SG-SD 3.64Å; I98-M176 CarbonylContact O-C 3.53Å; I98-M176 VanDerWaalsContact O-CA 3.27Å; I98-M176 WeakPolarHBondContact O-CA 3.1Å; M99-M176 HydrophobicContact CB-CE 4.06Å; M99-M176 HydrophobicContact CG-CE 4.3Å; M99-M176 HydrophobicContact SD-CE 4.22Å; M176-L178 HydrophobicContact CG-CD2 4.2Å; M176-L178 HydrophobicContact SD-CD2 4.38Å; M176-F194 HydrophobicContact CB-CE1 4.27Å; M176-F194 HydrophobicContact CG-CE1 4.2Å; M176-F194 HydrophobicContact CG-CZ 4.23Å; M176-F194 WeakPolarHBondContact O-CE1 3.45Å; M176-F194 HydrophobicContact SD-CZ 4.13Å; M176-P368 VanDerWaalsContact O-CD 3.24Å; M176-P368 WeakPolarHBondContact O-CD 3.08Å
177	K	94.8	Very high	91.9	Very high	3 Å²	3	54.2 Å²	54.2	1%	0.013	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139.2	172.1	-67.9	-170.9	-177.5	-176.7	0	110.8	I98 G199 S366	I98-K177 HydrophobicContact CB-CB 4.46Å; I98-K177 PolarHBondContact N-O 2.92Å; I98-K177 PolarHBondContact O-N 3.34Å; K177-G199 PolarHBondContact NZ-O 2.73Å; K177-S366 CarbonylContact C-O 3.5Å; K177-S366 VanDerWaalsContact CA-O 3.28Å; K177-S366 WeakPolarHBondContact CA-O 3.35Å
178	L	96	Very high	91.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.5	173.7	-55.7	-172.8	0	0	0	109.2	C85 L94 A96 A97 M176 Y180 P191 F194 F365 S366	C85-L178 WeakPolarHBondContact SG-CD2 3.5Å; L94-L178 HydrophobicContact CD1-CB 3.73Å; L94-L178 HydrophobicContact CD1-CD1 4.28Å; L94-L178 HydrophobicContact CD1-CD2 3.99Å; L94-L178 HydrophobicContact CD1-CG 4.19Å; A96-L178 CarbonylContact O-C 3.29Å; A96-L178 WeakPolarHBondContact O-CA 3.44Å; A97-L178 HydrophobicContact CB-CD2 3.97Å; M176-L178 HydrophobicContact CG-CD2 4.2Å; M176-L178 HydrophobicContact SD-CD2 4.38Å; L178-Y180 HydrophobicContact CB-CE1 4.05Å; L178-Y180 HydrophobicContact CB-CE2 4.43Å; L178-Y180 WeakPolarHBondContact CB-OH 3.21Å; L178-P191 HydrophobicContact CD1-CB 4.33Å; L178-P191 HydrophobicContact CD1-CG 3.85Å; L178-F194 HydrophobicContact CD1-CD1 4.05Å; L178-F194 HydrophobicContact CD1-CD2 3.75Å; L178-F194 HydrophobicContact CD1-CE1 3.92Å; L178-F194 HydrophobicContact CD1-CE2 3.61Å; L178-F194 HydrophobicContact CD1-CG 4Å; L178-F194 HydrophobicContact CD1-CZ 3.7Å; L178-F194 HydrophobicContact CD2-CE1 4.23Å; L178-F194 HydrophobicContact CD2-CZ 4.09Å; L178-F194 HydrophobicContact CG-CD1 4.03Å; L178-F194 HydrophobicContact CG-CE1 3.71Å; L178-F194 HydrophobicContact CG-CE2 4.28Å; L178-F194 HydrophobicContact CG-CG 4.48Å; L178-F194 HydrophobicContact CG-CZ 3.85Å; L178-F365 CarbonylContact O-C 3.49Å; L178-F365 WeakPolarHBondContact O-CA 3.41Å; L178-S366 PolarHBondContact N-O 3.12Å; L178-S366 PolarHBondContact O-N 3.4Å
179	A	94.7	Very high	92.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	141.8	173	0	0	0	0	0	109.4	R95 A96 F365	R95-A179 WeakPolarHBondContact CA-O 3.45Å; R95-A179 PolarHBondContact N-O 3.49Å; A96-A179 HydrophobicContact CB-CB 4.11Å; A96-A179 PolarHBondContact N-O 2.89Å; A96-A179 VanDerWaalsContact N-O 3.09Å; A96-A179 PolarHBondContact O-N 3.2Å; A179-F365 HydrophobicContact CB-CD1 3.66Å; A179-F365 HydrophobicContact CB-CE1 3.42Å; A179-F365 VanDerWaalsContact CB-CE1 3.42Å; A179-F365 HydrophobicContact CB-CZ 4.31Å
180	Y	95	Very high	92.3	Very high	10 Å²	10	56.6 Å²	56.6	4%	0.039	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	168	-174.6	-51.7	-71.6	0	0	0	113.4	A88 Y93 L94 L178 T185 Y189 P191 K364 S366	A88-Y180 HydrophobicContact CB-CE1 4.19Å; Y93-Y180 CarbonylContact O-C 3.59Å; Y93-Y180 WeakPolarHBondContact O-CA 3.48Å; Y93-Y180 WeakPolarHBondContact O-CB 3.43Å; L94-Y180 HydrophobicContact CD1-CD1 4.3Å; L94-Y180 HydrophobicContact CD1-CE1 4.04Å; L178-Y180 HydrophobicContact CB-CE1 4.05Å; L178-Y180 HydrophobicContact CB-CE2 4.43Å; L178-Y180 WeakPolarHBondContact CB-OH 3.21Å; Y180-T185 HydrophobicContact CD1-CG2 4.4Å; Y180-T185 HydrophobicContact CG-CG2 4.1Å; Y180-Y189 HydrophobicContact CD1-CE1 4.36Å; Y180-Y189 HydrophobicContact CE1-CD1 4.38Å; Y180-Y189 AromaticContact CE1-CE1 3.85Å; Y180-Y189 HydrophobicContact CE1-CE1 3.85Å; Y180-P191 HydrophobicContact CE1-CG 4.35Å; Y180-P191 WeakPolarHBondContact OH-CD 3.37Å; Y180-P191 WeakPolarHBondContact OH-CG 3.4Å; Y180-K364 PolarHBondContact N-O 2.9Å; Y180-S366 VanDerWaalsContact CE2-OG 3.26Å; Y180-S366 WeakPolarHBondContact CE2-OG 3.5Å; Y180-S366 WeakPolarHBondContact OH-CB 3.47Å; Y180-S366 PolarHBondContact OH-OG 3.26Å
181	Y	93.5	Very high	92.7	Very high	67 Å²	67	48.9 Å²	48.9	26%	0.263	25%	0.253	S	S	.	.			trans	-85.4	115.7	165.9	-74.7	-74.6	0	0	0	110.3	Y93 R95 I119 Y121 E183 V184 T185	Y93-Y181 PolarHBondContact O-N 3.27Å; R95-Y181 HydrophobicContact CB-CD1 4.37Å; R95-Y181 HydrophobicContact CB-CD2 3.85Å; R95-Y181 HydrophobicContact CB-CE1 4.3Å; R95-Y181 HydrophobicContact CB-CE2 3.75Å; R95-Y181 HydrophobicContact CB-CG 4.17Å; R95-Y181 HydrophobicContact CG-CE1 4.15Å; R95-Y181 HydrophobicContact CG-CE2 4.27Å; I119-Y181 PolarHBondContact O-OH 3.11Å; Y121-Y181 HydrophobicContact CD2-CD2 4.2Å; Y121-Y181 AromaticContact CD2-CE2 3.73Å; Y121-Y181 HydrophobicContact CD2-CE2 3.73Å; Y121-Y181 HydrophobicContact CE2-CD2 4.05Å; Y121-Y181 AromaticContact CE2-CE2 3.68Å; Y121-Y181 HydrophobicContact CE2-CE2 3.68Å; Y181-E183 PolarHBondContact O-N 3.42Å; Y181-E183 VanDerWaalsContact O-N 3.13Å; Y181-V184 PolarHBondContact O-N 3.09Å; Y181-T185 VanDerWaalsContact O-CB 3.31Å; Y181-T185 WeakPolarHBondContact O-CB 3.39Å; Y181-T185 PolarHBondContact O-N 3.27Å; Y181-T185 PolarHBondContact O-OG1 2.79Å
182	D	88.9	Confident	92.9	Very high	50 Å²	50	45.3 Å²	45.3	27%	0.267	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.7	-174.9	-75.5	-4	0	0	0	114.2	K362 K364	D182-K362 HydrophobicContact CB-CD 3.95Å; D182-K362 PolarHBondContact O-NZ 3.15Å; D182-K364 WeakPolarHBondContact OD2-CE 3.39Å
183	E	88.7	Confident	92.8	Very high	160 Å²	160	43.4 Å²	43.4	75%	0.748	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-20.6	-174.1	-45.5	-51.6	177.1	0	0	113.9	Y181 K362	Y181-E183 PolarHBondContact O-N 3.42Å; Y181-E183 VanDerWaalsContact O-N 3.13Å; E183-K362 IonicContact OE2-NZ 3.06Å; E183-K362 PolarHBondContact OE2-NZ 3.21Å
184	V	90.4	Very high	92.9	Very high	82 Å²	82	42.1 Å²	42.1	50%	0.497	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-16.6	-175.8	-63.3	0	0	0	0	113.4	Y93 Y181 P186	Y93-V184 HydrophobicContact CD1-CB 4.48Å; Y93-V184 HydrophobicContact CD1-CG2 4.05Å; Y93-V184 WeakPolarHBondContact CE1-O 3.45Å; Y181-V184 PolarHBondContact O-N 3.09Å; V184-P186 WeakPolarHBondContact O-CD 3.37Å
185	T	93.2	Very high	92.7	Very high	24 Å²	24	45.3 Å²	45.3	15%	0.147	23%	0.228	C	C	.	.	S	Bend	trans	-89.9	120.5	-173.6	-50.1	0	0	0	0	110.6	Y93 Y180 Y181 Y189	Y93-T185 WeakPolarHBondContact CB-OG1 3.21Å; Y93-T185 HydrophobicContact CD2-CG2 4.07Å; Y93-T185 HydrophobicContact CG-CG2 4.04Å; Y180-T185 HydrophobicContact CD1-CG2 4.4Å; Y180-T185 HydrophobicContact CG-CG2 4.1Å; Y181-T185 VanDerWaalsContact O-CB 3.31Å; Y181-T185 WeakPolarHBondContact O-CB 3.39Å; Y181-T185 PolarHBondContact O-N 3.27Å; Y181-T185 PolarHBondContact O-OG1 2.79Å; T185-Y189 HydrophobicContact CG2-CD1 3.65Å; T185-Y189 HydrophobicContact CG2-CG 4.17Å
186	P	94	Very high	92.6	Very high	53 Å²	53	50.1 Å²	50.1	34%	0.344	25%	0.25	S	S	.	.			trans	-59.2	146	174.8	-23.8	34.3	0	0	0	112.3	Y93 V184 D188 Y189	Y93-P186 HydrophobicContact CE2-CG 4.44Å; Y93-P186 VanDerWaalsContact CZ-CD 3.45Å; Y93-P186 WeakPolarHBondContact OH-CD 3.41Å; V184-P186 WeakPolarHBondContact O-CD 3.37Å; P186-D188 VanDerWaalsContact C-N 3.26Å; P186-D188 VanDerWaalsContact CB-OD1 3.23Å; P186-D188 WeakPolarHBondContact CB-OD1 3.23Å; P186-D188 PolarHBondContact O-N 3.26Å; P186-Y189 VanDerWaalsContact O-CB 3.24Å; P186-Y189 WeakPolarHBondContact O-CB 3.3Å; P186-Y189 PolarHBondContact O-N 2.9Å; P186-Y189 VanDerWaalsContact O-N 3.14Å
187	Q	88	Confident	92.2	Very high	114 Å²	114	50.8 Å²	50.8	53%	0.533	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-29	-178.1	-68.1	-174.5	-1.4	0	0	113.3	Y189	Q187-Y189 VanDerWaalsContact C-N 3.34Å
188	D	90.4	Very high	91.2	Very high	139 Å²	139	56.5 Å²	56.5	74%	0.743	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.1	178.5	66.3	-31.4	0	0	0	113.1	P186 Q190	P186-D188 VanDerWaalsContact C-N 3.26Å; P186-D188 VanDerWaalsContact CB-OD1 3.23Å; P186-D188 WeakPolarHBondContact CB-OD1 3.23Å; P186-D188 PolarHBondContact O-N 3.26Å; D188-Q190 PolarHBondContact O-N 3.02Å
189	Y	93.9	Very high	90.1	Very high	21 Å²	21	58 Å²	58	8%	0.082	31%	0.307	C	S	.	.			trans	-64	127.7	-180	175.7	-111.5	0	0	0	111.5	D87 A88 K91 Y93 Y180 T185 P186 Q187 P191	D87-Y189 WeakPolarHBondContact OD2-CE2 3.45Å; D87-Y189 PolarHBondContact OD2-OH 3.24Å; A88-Y189 VanDerWaalsContact CA-OH 3.23Å; A88-Y189 WeakPolarHBondContact CA-OH 3.26Å; A88-Y189 HydrophobicContact CB-CE1 4.31Å; A88-Y189 WeakPolarHBondContact CB-OH 3.14Å; A88-Y189 PolarHBondContact N-OH 3.16Å; K91-Y189 HydrophobicContact CD-CE2 4.02Å; Y93-Y189 AromaticContact CD2-CD1 3.82Å; Y93-Y189 HydrophobicContact CD2-CD1 3.82Å; Y93-Y189 HydrophobicContact CD2-CD2 4.03Å; Y93-Y189 AromaticContact CD2-CE1 3.76Å; Y93-Y189 HydrophobicContact CD2-CE1 3.76Å; Y93-Y189 AromaticContact CD2-CE2 3.99Å; Y93-Y189 HydrophobicContact CD2-CE2 3.99Å; Y93-Y189 AromaticContact CD2-CG 3.95Å; Y93-Y189 HydrophobicContact CD2-CG 3.95Å; Y93-Y189 AromaticContact CD2-CZ 3.84Å; Y93-Y189 HydrophobicContact CE2-CD1 4.43Å; Y93-Y189 AromaticContact CE2-CD2 3.94Å; Y93-Y189 HydrophobicContact CE2-CD2 3.94Å; Y93-Y189 HydrophobicContact CE2-CE2 4.16Å; Y93-Y189 HydrophobicContact CE2-CG 4.09Å; Y180-Y189 HydrophobicContact CD1-CE1 4.36Å; Y180-Y189 HydrophobicContact CE1-CD1 4.38Å; Y180-Y189 AromaticContact CE1-CE1 3.85Å; Y180-Y189 HydrophobicContact CE1-CE1 3.85Å; T185-Y189 HydrophobicContact CG2-CD1 3.65Å; T185-Y189 HydrophobicContact CG2-CG 4.17Å; P186-Y189 VanDerWaalsContact O-CB 3.24Å; P186-Y189 WeakPolarHBondContact O-CB 3.3Å; P186-Y189 PolarHBondContact O-N 2.9Å; P186-Y189 VanDerWaalsContact O-N 3.14Å; Q187-Y189 VanDerWaalsContact C-N 3.34Å; Y189-P191 HydrophobicContact CE1-CB 4.29Å; Y189-P191 HydrophobicContact CE1-CG 3.9Å
190	Q	92.8	Very high	89.1	Confident	65 Å²	65	62.2 Å²	62.2	30%	0.304	33%	0.329	S	S	.	.			trans	-134	108.1	177	-172.5	65.2	72.6	0	0	109.9	D188 F194 R195	D188-Q190 PolarHBondContact O-N 3.02Å; Q190-F194 VanDerWaalsContact CG-O 3.32Å; Q190-F194 WeakPolarHBondContact CG-O 3.36Å; Q190-F194 PolarHBondContact NE2-O 2.88Å; Q190-R195 VanDerWaalsContact CD-CA 3.43Å; Q190-R195 VanDerWaalsContact NE2-N 3.16Å
191	P	93.8	Very high	88.4	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.006	34%	0.341	C	S	.	.			trans	-65	149	178.3	8.3	-10.6	0	0	0	111.8	L178 Y180 Y189 G193 F194	L178-P191 HydrophobicContact CD1-CB 4.33Å; L178-P191 HydrophobicContact CD1-CG 3.85Å; Y180-P191 HydrophobicContact CE1-CG 4.35Å; Y180-P191 WeakPolarHBondContact OH-CD 3.37Å; Y180-P191 WeakPolarHBondContact OH-CG 3.4Å; Y189-P191 HydrophobicContact CE1-CB 4.29Å; Y189-P191 HydrophobicContact CE1-CG 3.9Å; P191-G193 PolarHBondContact O-N 3.08Å; P191-F194 HydrophobicContact CB-CD2 4.05Å; P191-F194 HydrophobicContact CG-CB 4.06Å; P191-F194 HydrophobicContact CG-CD2 4.16Å; P191-F194 HydrophobicContact CG-CG 4.32Å; P191-F194 PolarHBondContact O-N 2.82Å; P191-F194 VanDerWaalsContact O-N 3.08Å
192	P	92.9	Very high	88	Confident	58 Å²	58	61 Å²	61	38%	0.377	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	131.5	171.5	-27	33.5	0	0	0	112.1	G84 D87 F194	G84-P192 WeakPolarHBondContact CA-O 3.39Å; D87-P192 HydrophobicContact CB-CG 4.36Å; P192-F194 VanDerWaalsContact C-N 3.3Å; P192-F194 WeakPolarHBondContact O-CD2 3.43Å; P192-F194 PolarHBondContact O-N 2.75Å
193	G	91.9	Very high	88.1	Confident	3 Å²	3	60.9 Å²	60.9	3%	0.031	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	-7.4	-179.4	0	0	0	0	0	116.3	P191 K369	P191-G193 PolarHBondContact O-N 3.08Å; G193-K369 PolarHBondContact O-N 3.01Å
194	F	94.8	Very high	88.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	161.6	-177.9	-63.6	-94.1	0	0	0	113	W81 M176 L178 Q190 P191 P192 E367 K369	W81-F194 HydrophobicContact CB-CE2 4.23Å; W81-F194 HydrophobicContact CB-CZ 3.75Å; W81-F194 AromaticContact CD1-CZ 3.95Å; W81-F194 HydrophobicContact CG-CE1 4.48Å; W81-F194 AromaticContact CG-CZ 3.94Å; W81-F194 HydrophobicContact CG-CZ 3.94Å; W81-F194 WeakPolarHBondContact O-CE2 3.49Å; M176-F194 HydrophobicContact CB-CE1 4.27Å; M176-F194 HydrophobicContact CG-CE1 4.2Å; M176-F194 HydrophobicContact CG-CZ 4.23Å; M176-F194 WeakPolarHBondContact O-CE1 3.45Å; M176-F194 HydrophobicContact SD-CZ 4.13Å; L178-F194 HydrophobicContact CD1-CD1 4.05Å; L178-F194 HydrophobicContact CD1-CD2 3.75Å; L178-F194 HydrophobicContact CD1-CE1 3.92Å; L178-F194 HydrophobicContact CD1-CE2 3.61Å; L178-F194 HydrophobicContact CD1-CG 4Å; L178-F194 HydrophobicContact CD1-CZ 3.7Å; L178-F194 HydrophobicContact CD2-CE1 4.23Å; L178-F194 HydrophobicContact CD2-CZ 4.09Å; L178-F194 HydrophobicContact CG-CD1 4.03Å; L178-F194 HydrophobicContact CG-CE1 3.71Å; L178-F194 HydrophobicContact CG-CE2 4.28Å; L178-F194 HydrophobicContact CG-CG 4.48Å; L178-F194 HydrophobicContact CG-CZ 3.85Å; Q190-F194 VanDerWaalsContact CG-O 3.32Å; Q190-F194 WeakPolarHBondContact CG-O 3.36Å; Q190-F194 PolarHBondContact NE2-O 2.88Å; P191-F194 HydrophobicContact CB-CD2 4.05Å; P191-F194 HydrophobicContact CG-CB 4.06Å; P191-F194 HydrophobicContact CG-CD2 4.16Å; P191-F194 HydrophobicContact CG-CG 4.32Å; P191-F194 PolarHBondContact O-N 2.82Å; P191-F194 VanDerWaalsContact O-N 3.08Å; P192-F194 VanDerWaalsContact C-N 3.3Å; P192-F194 WeakPolarHBondContact O-CD2 3.43Å; P192-F194 PolarHBondContact O-N 2.75Å; F194-E367 CarbonylContact C-O 3.57Å; F194-E367 WeakPolarHBondContact CA-O 3.27Å; F194-E367 WeakPolarHBondContact CB-O 3.24Å; F194-E367 VanDerWaalsContact CD1-C 3.49Å; F194-E367 WeakPolarHBondContact CD1-O 3.43Å; F194-K369 VanDerWaalsContact C-CG 3.48Å; F194-K369 WeakPolarHBondContact O-CE 3.27Å; F194-K369 WeakPolarHBondContact O-CG 3.44Å
195	R	91.8	Very high	87.9	Confident	94 Å²	94	53.1 Å²	53.1	36%	0.355	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	177.4	167.1	65.1	176.5	-174.6	-133.4	-4.3	110.1	Q190 R363 S366 E367 K369 H371	Q190-R195 VanDerWaalsContact CD-CA 3.43Å; Q190-R195 VanDerWaalsContact NE2-N 3.16Å; R195-R363 VanDerWaalsContact C-NH2 3.3Å; R195-R363 PolarHBondContact O-NH2 2.84Å; R195-S366 CarbonylContact O-C 3.52Å; R195-S366 WeakPolarHBondContact O-CA 3.32Å; R195-S366 WeakPolarHBondContact O-CB 3.25Å; R195-E367 HydrophobicContact CG-CG 3.83Å; R195-E367 IonicContact CZ-OE1 3.19Å; R195-E367 PolarHBondContact N-O 2.79Å; R195-E367 IonicContact NE-OE1 3.69Å; R195-E367 PolarHBondContact NE-OE1 3.49Å; R195-E367 IonicContact NH2-OE1 3.43Å; R195-E367 PolarHBondContact NH2-OE1 3.49Å; R195-E367 PolarHBondContact O-N 2.95Å; R195-K369 HydrophobicContact CB-CG 4.22Å; R195-K369 PolarHBondContact NH1-O 3.48Å; R195-H371 PolarHBondContact NH2-NE2 3.34Å; R195-H371 VanDerWaalsContact NH2-NE2 3.1Å
196	E	90	Very high	87.6	Confident	105 Å²	105	55 Å²	55	49%	0.491	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	134.9	173.8	-173.1	161.7	-164.6	0	0	111.4	R363	E196-R363 VanDerWaalsContact CA-CZ 3.45Å; E196-R363 VanDerWaalsContact CB-CZ 3.43Å; E196-R363 VanDerWaalsContact CD-CD 3.47Å; E196-R363 HydrophobicContact CG-CG 3.95Å; E196-R363 VanDerWaalsContact N-NH2 3.1Å; E196-R363 WeakPolarHBondContact OE1-CD 3.33Å; E196-R363 WeakPolarHBondContact OE1-CG 2.82Å
197	A	86.1	Confident	87.4	Confident	17 Å²	17	55.4 Å²	55.4	14%	0.14	30%	0.295	C	S	.	.			trans	-77.1	131.9	-179.2	0	0	0	0	0	111.6	G199 F365 E367	A197-G199 PolarHBondContact O-N 2.8Å; A197-F365 HydrophobicContact CB-CB 3.79Å; A197-F365 PolarHBondContact N-O 2.75Å; A197-E367 HydrophobicContact CB-CB 4.08Å; A197-E367 HydrophobicContact CB-CG 4.3Å
198	V	75.3	Confident	87.7	Confident	123 Å²	123	51 Å²	51	75%	0.745	28%	0.277	S	S	*	.	S	Bend	trans	-87.5	66.3	173.4	-168.2	0	0	0	0	108.4	E367	V198-E367 PolarHBondContact N-OE2 2.72Å
199	G	72.6	Confident	87.9	Confident	33 Å²	33	45.9 Å²	45.9	34%	0.34	25%	0.25	S	S	.	.			trans	120	148	176.5	0	0	0	0	0	115.4	K177 A197	K177-G199 PolarHBondContact NZ-O 2.73Å; A197-G199 PolarHBondContact O-N 2.8Å
200	N	73.2	Confident	87.8	Confident	87 Å²	87	50.1 Å²	50.1	47%	0.465	27%	0.269	S	S	.	.			trans	-111	7.8	-170.3	65.3	-9.7	0	0	0	114	I251 F365	N200-I251 WeakPolarHBondContact O-CD1 3.43Å; N200-F365 HydrophobicContact CB-CD2 3.59Å; N200-F365 HydrophobicContact CB-CE2 3.47Å; N200-F365 VanDerWaalsContact CB-CE2 3.47Å; N200-F365 HydrophobicContact CB-CZ 4.27Å
201	T	79.9	Confident	87.8	Confident	45 Å²	45	49.2 Å²	49.2	28%	0.276	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	143	-170.2	-15.5	0	0	0	0	110.8	Q109 I248	Q109-T201 PolarHBondContact OE1-O 2.8Å; T201-I248 HydrophobicContact CG2-CG2 4.49Å
202	I	85.9	Confident	87.7	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124	170.2	-69.8	175.2	0	0	0	105.7	I98 V111 Y114 V249 I251	I98-I202 HydrophobicContact CG2-CD1 3.79Å; V111-I202 HydrophobicContact CB-CG2 4.13Å; V111-I202 HydrophobicContact CG1-CG2 3.76Å; V111-I202 HydrophobicContact CG2-CG2 3.23Å; Y114-I202 HydrophobicContact CD1-CG2 4.42Å; I202-V249 CarbonylContact O-C 3.6Å; I202-V249 PolarHBondContact O-N 2.68Å; I202-I251 HydrophobicContact CD1-CD1 3.88Å; I202-I251 HydrophobicContact CD1-CG1 4.29Å; I202-I251 HydrophobicContact CG1-CD1 4.11Å; I202-I251 HydrophobicContact CG1-CG1 4.46Å
203	E	91.1	Very high	87.6	Confident	48 Å²	48	51.2 Å²	51.2	22%	0.224	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135	-179.9	-65.2	-173.3	-165.4	0	0	109	Q109 K110 V111 K246 I248	Q109-E203 PolarHBondContact O-N 3.19Å; K110-E203 CarbonylContact C-O 3.54Å; K110-E203 VanDerWaalsContact CA-O 3.28Å; K110-E203 WeakPolarHBondContact CA-O 3.29Å; V111-E203 PolarHBondContact N-O 3.43Å; E203-K246 IonicContact OE2-NZ 3Å; E203-I248 HydrophobicContact CG-CG1 4.29Å; E203-I248 HydrophobicContact CG-CG2 4.34Å
204	F	90.4	Very high	87.6	Confident	5 Å²	5	52 Å²	52	2%	0.022	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	139.3	170.7	-85	-100.1	0	0	0	110.5	V111 T112 Y114 Q206 P208 A228 E230 W247 V249	V111-F204 HydrophobicContact CG2-CD1 4.37Å; V111-F204 HydrophobicContact CG2-CD2 4.02Å; V111-F204 HydrophobicContact CG2-CE1 4.18Å; V111-F204 HydrophobicContact CG2-CE2 3.77Å; V111-F204 HydrophobicContact CG2-CG 4.3Å; V111-F204 HydrophobicContact CG2-CZ 3.86Å; V111-F204 WeakPolarHBondContact O-CA 3.5Å; T112-F204 WeakPolarHBondContact O-CE1 3.35Å; Y114-F204 AromaticContact CD1-CE2 3.51Å; Y114-F204 HydrophobicContact CD1-CE2 3.51Å; Y114-F204 AromaticContact CD1-CZ 3.52Å; Y114-F204 HydrophobicContact CD1-CZ 3.52Å; Y114-F204 AromaticContact CE1-CE2 3.56Å; Y114-F204 HydrophobicContact CE1-CE2 3.56Å; Y114-F204 AromaticContact CE1-CZ 3.83Å; Y114-F204 HydrophobicContact CE1-CZ 3.83Å; F204-Q206 VanDerWaalsContact C-N 3.31Å; F204-Q206 WeakPolarHBondContact CB-O 3.28Å; F204-P208 HydrophobicContact CB-CB 4.28Å; F204-P208 HydrophobicContact CB-CG 4.22Å; F204-P208 HydrophobicContact CD1-CB 3.67Å; F204-P208 HydrophobicContact CD2-CB 3.81Å; F204-P208 HydrophobicContact CD2-CG 4.09Å; F204-P208 HydrophobicContact CE1-CB 3.87Å; F204-P208 HydrophobicContact CE2-CB 4.02Å; F204-P208 HydrophobicContact CG-CB 3.64Å; F204-P208 HydrophobicContact CG-CG 4.01Å; F204-P208 HydrophobicContact CZ-CB 4.05Å; F204-A228 HydrophobicContact CE1-CB 4.49Å; F204-A228 HydrophobicContact CE2-CB 4.17Å; F204-A228 HydrophobicContact CZ-CB 3.66Å; F204-E230 HydrophobicContact CD1-CG 4.26Å; F204-W247 HydrophobicContact CB-CB 4.41Å; F204-W247 PolarHBondContact N-O 3.46Å; F204-V249 HydrophobicContact CD2-CG2 4.07Å; F204-V249 HydrophobicContact CE2-CG2 4.41Å
205	V	83.1	Confident	87.5	Confident	75 Å²	75	55.8 Å²	55.8	46%	0.455	30%	0.302	S	S	.	.	S	Bend	trans	-69.1	-34.4	175.3	-178.2	0	0	0	0	110.9	K110 V111	K110-V205 HydrophobicContact CB-CG2 3.93Å; V111-V205 PolarHBondContact O-N 2.94Å
206	Q	87.3	Confident	87.5	Confident	64 Å²	64	51.5 Å²	51.5	30%	0.299	29%	0.286	S	S	.	.	S	Bend	trans	-132.8	178.6	-179.5	-75.1	162.1	95.4	0	0	111.3	F204 P208 E230 R232	F204-Q206 VanDerWaalsContact C-N 3.31Å; F204-Q206 WeakPolarHBondContact CB-O 3.28Å; Q206-P208 VanDerWaalsContact O-CD 3.25Å; Q206-P208 WeakPolarHBondContact O-CD 3.29Å; Q206-E230 HydrophobicContact CB-CB 4.39Å; Q206-E230 HydrophobicContact CB-CG 3.99Å; Q206-E230 PolarHBondContact NE2-OE1 3.4Å; Q206-E230 PolarHBondContact NE2-OE2 3.19Å; Q206-R232 VanDerWaalsContact OE1-CZ 3.3Å; Q206-R232 VanDerWaalsContact OE1-NE 3.17Å
207	E	91.3	Very high	87.5	Confident	60 Å²	60	48.2 Å²	48.2	28%	0.28	28%	0.277	S	S	.	.			trans	-57.1	119	-179.7	-168.4	178.8	167	0	0	111.9	E230 R231 W247	E207-E230 CarbonylContact O-C 3.57Å; E207-E230 WeakPolarHBondContact O-CA 3.46Å; E207-R231 HydrophobicContact CB-CB 4.32Å; E207-R231 WeakPolarHBondContact O-CB 3.44Å; E207-R231 PolarHBondContact O-N 3.26Å; E207-R231 IonicContact OE1-CZ 2.71Å; E207-R231 IonicContact OE1-NE 3.53Å; E207-R231 PolarHBondContact OE1-NE 3.06Å; E207-R231 IonicContact OE1-NH2 2.89Å; E207-R231 PolarHBondContact OE1-NH2 2.8Å; E207-R231 WeakPolarHBondContact OE2-CD 3.47Å; E207-R231 IonicContact OE2-CZ 3.09Å; E207-R231 IonicContact OE2-NE 3.2Å; E207-R231 PolarHBondContact OE2-NE 3.43Å; E207-R231 VanDerWaalsContact OE2-NE 3.09Å; E207-W247 HydrophobicContact CB-CD2 4.39Å; E207-W247 HydrophobicContact CB-CG 4.49Å; E207-W247 HydrophobicContact CB-CZ2 4.05Å; E207-W247 VanDerWaalsContact CB-NE1 3.31Å; E207-W247 HydrophobicContact CG-CD2 4.1Å; E207-W247 HydrophobicContact CG-CH2 4.29Å; E207-W247 HydrophobicContact CG-CZ2 3.61Å
208	P	93.6	Very high	87.6	Confident	23 Å²	23	47.5 Å²	47.5	15%	0.149	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	143.2	176.6	31.8	-30.5	0	0	0	111.3	F204 Q206 T229 W247 V249	F204-P208 HydrophobicContact CB-CB 4.28Å; F204-P208 HydrophobicContact CB-CG 4.22Å; F204-P208 HydrophobicContact CD1-CB 3.67Å; F204-P208 HydrophobicContact CD2-CB 3.81Å; F204-P208 HydrophobicContact CD2-CG 4.09Å; F204-P208 HydrophobicContact CE1-CB 3.87Å; F204-P208 HydrophobicContact CE2-CB 4.02Å; F204-P208 HydrophobicContact CG-CB 3.64Å; F204-P208 HydrophobicContact CG-CG 4.01Å; F204-P208 HydrophobicContact CZ-CB 4.05Å; Q206-P208 VanDerWaalsContact O-CD 3.25Å; Q206-P208 WeakPolarHBondContact O-CD 3.29Å; P208-T229 CarbonylContact C-O 3.5Å; P208-T229 WeakPolarHBondContact CA-O 3.42Å; P208-W247 VanDerWaalsContact CD-CG 3.43Å; P208-W247 HydrophobicContact CG-CB 4.02Å; P208-V249 HydrophobicContact CG-CG2 4.19Å
209	V	93.4	Very high	88.2	Confident	30 Å²	30	42.5 Å²	42.5	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.3	161.6	178.5	0	0	0	0	107.6	L211 A228 T229 R231 L234	V209-L211 HydrophobicContact CG1-CD2 4.02Å; V209-L211 HydrophobicContact CG1-CG 4.19Å; V209-A228 WeakPolarHBondContact O-CA 3.26Å; V209-T229 PolarHBondContact N-O 2.79Å; V209-T229 PolarHBondContact O-N 3.38Å; V209-T229 VanDerWaalsContact O-N 3.09Å; V209-R231 HydrophobicContact CG2-CB 3.69Å; V209-R231 HydrophobicContact CG2-CG 3.9Å; V209-L234 HydrophobicContact CG1-CD2 4.37Å
210	K	93.5	Very high	89.1	Confident	111 Å²	111	43.3 Å²	43.3	48%	0.483	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.3	173.6	-68.1	-178.4	176.8	179.4	0	109.6	M227 A228	K210-M227 WeakPolarHBondContact CA-O 3.37Å; K210-A228 HydrophobicContact CB-CB 4.48Å; K210-A228 HydrophobicContact CG-CB 3.88Å
211	L	92.5	Very high	90	Very high	45 Å²	45	39.3 Å²	39.3	24%	0.236	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.3	-179.1	-62.1	170.7	0	0	0	109.7	L161 V209 M227	L161-L211 HydrophobicContact CD1-CD1 3.81Å; L161-L211 HydrophobicContact CD2-CD1 3.62Å; L161-L211 HydrophobicContact CG-CD1 4.34Å; V209-L211 HydrophobicContact CG1-CD2 4.02Å; V209-L211 HydrophobicContact CG1-CG 4.19Å; L211-M227 HydrophobicContact CB-CG 4.07Å; L211-M227 PolarHBondContact N-O 2.91Å; L211-M227 PolarHBondContact O-N 3.4Å
212	T	92.1	Very high	90.6	Very high	93 Å²	93	37.2 Å²	37.2	57%	0.571	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96	118.5	173.4	-69.3	0	0	0	0	109.3	D226	T212-D226 WeakPolarHBondContact CA-OD1 3.33Å; T212-D226 WeakPolarHBondContact CB-OD1 3.28Å; T212-D226 WeakPolarHBondContact CG2-OD1 3.3Å; T212-D226 PolarHBondContact OG1-OD1 3.22Å
213	M	90.1	Very high	91	Very high	8 Å²	8	37.3 Å²	37.3	4%	0.039	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	-39	-177.9	-65.4	-74	-155.9	0	0	111.6	K157 L158 L161 M162 F225 M227	K157-M213 WeakPolarHBondContact CD-O 3.27Å; K157-M213 PolarHBondContact NZ-O 3.33Å; L158-M213 HydrophobicContact CD1-CE 4.46Å; L161-M213 HydrophobicContact CB-CE 3.94Å; L161-M213 HydrophobicContact CB-SD 4.48Å; L161-M213 HydrophobicContact CD2-CE 3.1Å; L161-M213 HydrophobicContact CD2-SD 4.01Å; L161-M213 HydrophobicContact CG-CE 4.13Å; M162-M213 HydrophobicContact CE-CE 4.27Å; M213-F225 HydrophobicContact CB-CB 4.13Å; M213-F225 HydrophobicContact CB-CD1 3.42Å; M213-F225 VanDerWaalsContact CB-CD1 3.42Å; M213-F225 HydrophobicContact CB-CE1 4Å; M213-F225 HydrophobicContact CB-CG 3.93Å; M213-F225 WeakPolarHBondContact CB-O 3.31Å; M213-F225 HydrophobicContact CE-CE1 4.03Å; M213-F225 HydrophobicContact CE-CZ 4.27Å; M213-F225 HydrophobicContact CG-CD1 3.5Å; M213-F225 HydrophobicContact CG-CE1 3.56Å; M213-F225 HydrophobicContact CG-CG 4.08Å; M213-F225 HydrophobicContact CG-CZ 4.15Å; M213-F225 PolarHBondContact N-O 3.28Å; M213-F225 HydrophobicContact SD-CE1 4.41Å; M213-M227 HydrophobicContact CE-CG 3.93Å; M213-M227 HydrophobicContact CE-SD 3.35Å; M213-M227 WeakPolarHBondContact CE-SD 3.15Å
214	G	91.4	Very high	91.2	Very high	21 Å²	21	37.6 Å²	37.6	22%	0.216	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.4	-174.6	176.4	0	0	0	0	0	112.8	F225	G214-F225 PolarHBondContact N-O 2.92Å; G214-F225 PolarHBondContact O-N 3.38Å
215	K	92.6	Very high	91.5	Very high	79 Å²	79	37.4 Å²	37.4	34%	0.343	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.9	176.4	66	-170.4	-177.6	-171	0	110.7	D129 E131 V223 K224	D129-K215 IonicContact OD1-NZ 3.25Å; D129-K215 PolarHBondContact OD1-NZ 3.22Å; D129-K215 IonicContact OD2-NZ 2.77Å; D129-K215 PolarHBondContact OD2-NZ 3.12Å; E131-K215 IonicContact OE1-NZ 3.31Å; E131-K215 PolarHBondContact OE1-NZ 3.07Å; K215-V223 CarbonylContact C-O 3.59Å; K215-V223 WeakPolarHBondContact CA-O 3.22Å; K215-K224 HydrophobicContact CB-CB 4.39Å
216	V	91.9	Very high	92.1	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.9	170.8	176.7	0	0	0	0	107.3	L33 T147 A150 S151 L154 C222 V223	L33-V216 HydrophobicContact CD2-CB 3.85Å; L33-V216 HydrophobicContact CD2-CG1 4.18Å; L33-V216 HydrophobicContact CD2-CG2 3.75Å; T147-V216 HydrophobicContact CG2-CG1 3.98Å; A150-V216 HydrophobicContact CB-CG2 4.17Å; S151-V216 WeakPolarHBondContact OG-CG1 3.47Å; L154-V216 HydrophobicContact CB-CG2 4.3Å; L154-V216 HydrophobicContact CD1-CG2 3.82Å; V216-C222 WeakPolarHBondContact O-CA 3.21Å; V216-V223 PolarHBondContact N-O 3.36Å; V216-V223 PolarHBondContact O-N 3.47Å
217	A	90.3	Very high	92.5	Very high	36 Å²	36	31.5 Å²	31.5	30%	0.298	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.8	178.8	0	0	0	0	0	110.5	T147 C222	T147-A217 PolarHBondContact OG1-O 2.88Å; T147-A217 VanDerWaalsContact OG1-O 3.13Å; A217-C222 HydrophobicContact CB-CB 4.37Å
218	T	88.9	Confident	92.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	16%	0.155	C	C	.	.			trans	-125.3	168.9	167.4	62.3	0	0	0	0	107.4	V20 S26 V29 V128 T147 Y220 H221	V20-T218 HydrophobicContact CG1-CG2 4.37Å; V20-T218 HydrophobicContact CG2-CG2 4.28Å; S26-T218 WeakPolarHBondContact OG-CB 3.13Å; S26-T218 PolarHBondContact OG-OG1 3.1Å; V29-T218 HydrophobicContact CB-CG2 4.44Å; V29-T218 HydrophobicContact CG1-CG2 4.12Å; V128-T218 WeakPolarHBondContact CG2-O 3.43Å; T147-T218 HydrophobicContact CG2-CG2 3.62Å; T218-Y220 PolarHBondContact O-N 2.81Å; T218-H221 PolarHBondContact N-O 3.17Å; T218-H221 PolarHBondContact O-N 2.88Å; T218-H221 PolarHBondContact OG1-N 2.81Å; T218-H221 VanDerWaalsContact OG1-N 3.11Å; T218-H221 PolarHBondContact OG1-O 2.88Å
219	P	87.8	Confident	92.7	Very high	18 Å²	18	27.6 Å²	27.6	12%	0.117	15%	0.148	C	C	.	.	S	Bend	trans	-59	-25.9	-175.7	-26.4	34.7	0	0	0	114.1	T122 G125 F144	T122-P219 PolarHBondContact OG1-O 3.01Å; G125-P219 CarbonylContact C-O 3.49Å; G125-P219 WeakPolarHBondContact CA-O 3.22Å; F144-P219 HydrophobicContact CD1-CG 3.67Å; F144-P219 VanDerWaalsContact CE1-CA 3.45Å; F144-P219 HydrophobicContact CE1-CB 4.05Å; F144-P219 HydrophobicContact CE1-CG 3.62Å; F144-P219 HydrophobicContact CG-CG 4.27Å; F144-P219 HydrophobicContact CZ-CB 4.16Å; F144-P219 HydrophobicContact CZ-CG 4.11Å
220	Y	89.8	Confident	92.7	Very high	51 Å²	51	26.1 Å²	26.1	20%	0.2	14%	0.139	C	C	.	.	S	Bend	trans	-112.5	-17.7	-173	-52.4	-90.7	0	0	0	114.2	A21 S22 E23 T122 T218	A21-Y220 PolarHBondContact O-OH 2.71Å; A21-Y220 VanDerWaalsContact O-OH 3.08Å; S22-Y220 WeakPolarHBondContact O-CE2 3.25Å; E23-Y220 HydrophobicContact CB-CD1 3.71Å; E23-Y220 HydrophobicContact CB-CD2 4.19Å; E23-Y220 HydrophobicContact CB-CE1 3.91Å; E23-Y220 HydrophobicContact CB-CE2 4.39Å; E23-Y220 HydrophobicContact CB-CG 3.85Å; E23-Y220 HydrophobicContact CG-CD1 3.95Å; E23-Y220 HydrophobicContact CG-CG 3.99Å; E23-Y220 VanDerWaalsContact N-CE2 3.28Å; T122-Y220 PolarHBondContact N-O 2.97Å; T122-Y220 WeakPolarHBondContact OG1-CA 3.46Å; T122-Y220 PolarHBondContact OG1-O 2.81Å; T218-Y220 PolarHBondContact O-N 2.81Å
221	H	92.3	Very high	92.5	Very high	3 Å²	3	25.5 Å²	25.5	1%	0.014	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	142.2	-175.2	-59.7	83.6	0	0	0	112.1	S26 V30 Q120 Y121 T218	S26-H221 PolarHBondContact OG-ND1 2.52Å; V30-H221 HydrophobicContact CG2-CB 3.53Å; Q120-H221 WeakPolarHBondContact O-CA 3.22Å; Y121-H221 AromaticContact CD1-CD2 3.3Å; Y121-H221 WeakPolarHBondContact CD1-CD2 3.32Å; Y121-H221 AromaticContact CD1-NE2 3.52Å; Y121-H221 AromaticContact CE1-CD2 3.41Å; Y121-H221 VanDerWaalsContact CE1-CD2 3.41Å; Y121-H221 WeakPolarHBondContact CE1-CD2 3.19Å; Y121-H221 AromaticContact CE1-NE2 3.61Å; T218-H221 PolarHBondContact N-O 3.17Å; T218-H221 PolarHBondContact O-N 2.88Å; T218-H221 PolarHBondContact OG1-N 2.81Å; T218-H221 VanDerWaalsContact OG1-N 3.11Å; T218-H221 PolarHBondContact OG1-O 2.88Å
222	C	93	Very high	92.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.2	168.1	-174.2	0	0	0	0	109.8	I119 Q120 V128 F130 V216 A217	I119-C222 WeakPolarHBondContact CA-O 3.42Å; Q120-C222 HydrophobicContact CB-CB 4.45Å; Q120-C222 PolarHBondContact N-O 2.93Å; Q120-C222 PolarHBondContact O-N 3.35Å; V128-C222 HydrophobicContact CB-CB 3.55Å; V128-C222 HydrophobicContact CG1-CB 4.32Å; V128-C222 HydrophobicContact CG2-CB 3.43Å; V128-C222 VanDerWaalsContact CG2-CB 3.43Å; F130-C222 HydrophobicContact CE2-CB 4.2Å; F130-C222 VanDerWaalsContact CE2-SG 3.57Å; V216-C222 WeakPolarHBondContact O-CA 3.21Å; A217-C222 HydrophobicContact CB-CB 4.37Å
223	V	94.9	Very high	92.1	Very high	9 Å²	9	25 Å²	25	6%	0.055	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.9	177.2	-176.5	0	0	0	0	108.3	V30 F117 K118 I119 K215 V216	V30-V223 HydrophobicContact CB-CG2 4.21Å; V30-V223 HydrophobicContact CG1-CG2 3.67Å; V30-V223 HydrophobicContact CG2-CG2 3.74Å; F117-V223 HydrophobicContact CD1-CG1 4.45Å; K118-V223 CarbonylContact O-C 3.54Å; K118-V223 WeakPolarHBondContact O-CA 3.35Å; I119-V223 HydrophobicContact CG1-CG2 4.47Å; K215-V223 CarbonylContact C-O 3.59Å; K215-V223 WeakPolarHBondContact CA-O 3.22Å; V216-V223 PolarHBondContact N-O 3.36Å; V216-V223 PolarHBondContact O-N 3.47Å
224	K	95.8	Very high	91.8	Very high	54 Å²	54	27.6 Å²	27.6	24%	0.235	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.6	168.6	178.1	175	-179.8	178	0	109.2	F117 K118 F130 K215 D226	F117-K224 CarbonylContact C-O 3.58Å; F117-K224 WeakPolarHBondContact CA-O 3.32Å; K118-K224 HydrophobicContact CB-CB 4.36Å; K118-K224 PolarHBondContact N-O 3.04Å; K118-K224 PolarHBondContact O-N 2.9Å; F130-K224 HydrophobicContact CD1-CD 4.27Å; F130-K224 HydrophobicContact CD2-CB 3.92Å; F130-K224 HydrophobicContact CD2-CD 4.42Å; F130-K224 HydrophobicContact CE1-CB 4.13Å; F130-K224 HydrophobicContact CE1-CD 4.42Å; F130-K224 HydrophobicContact CE2-CB 3.38Å; F130-K224 HydrophobicContact CG-CD 4.27Å; F130-K224 HydrophobicContact CZ-CB 3.5Å; K215-K224 HydrophobicContact CB-CB 4.39Å; K224-D226 VanDerWaalsContact CE-OD1 3.22Å; K224-D226 WeakPolarHBondContact CE-OD1 3.43Å; K224-D226 WeakPolarHBondContact CE-OD2 3.45Å; K224-D226 IonicContact NZ-OD2 2.77Å
225	F	96.1	Very high	90.8	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	117.6	176.4	178.9	-148.2	0	0	0	109.7	I41 Y115 Q116 F117 L154 L158 M213 G214	I41-F225 HydrophobicContact CD1-CZ 4.14Å; Y115-F225 HydrophobicContact CD1-CE2 4.13Å; Y115-F225 HydrophobicContact CD1-CZ 4.02Å; Q116-F225 WeakPolarHBondContact O-CA 3.45Å; F117-F225 HydrophobicContact CD1-CB 4.26Å; F117-F225 AromaticContact CD1-CD2 3.92Å; F117-F225 HydrophobicContact CD1-CD2 3.92Å; F117-F225 HydrophobicContact CD1-CG 4.18Å; F117-F225 HydrophobicContact CE1-CB 4.33Å; F117-F225 HydrophobicContact CE1-CD1 4.32Å; F117-F225 AromaticContact CE1-CD2 3.59Å; F117-F225 HydrophobicContact CE1-CD2 3.59Å; F117-F225 AromaticContact CE1-CE2 3.97Å; F117-F225 HydrophobicContact CE1-CE2 3.97Å; F117-F225 AromaticContact CE1-CG 3.82Å; F117-F225 HydrophobicContact CE1-CG 3.82Å; F117-F225 HydrophobicContact CE1-CZ 4.47Å; F117-F225 HydrophobicContact CE2-CE2 4.38Å; F117-F225 AromaticContact CZ-CD2 3.91Å; F117-F225 HydrophobicContact CZ-CD2 3.91Å; F117-F225 AromaticContact CZ-CE2 3.82Å; F117-F225 HydrophobicContact CZ-CE2 3.82Å; F117-F225 HydrophobicContact CZ-CG 4.5Å; F117-F225 HydrophobicContact CZ-CZ 4.29Å; L154-F225 HydrophobicContact CD1-CB 3.99Å; L154-F225 HydrophobicContact CD2-CD1 3.86Å; L154-F225 HydrophobicContact CG-CD1 4.25Å; L158-F225 HydrophobicContact CB-CE1 4.28Å; L158-F225 HydrophobicContact CD1-CE1 3.89Å; L158-F225 HydrophobicContact CD1-CZ 4.06Å; L158-F225 HydrophobicContact CG-CE1 4.46Å; M213-F225 HydrophobicContact CB-CB 4.13Å; M213-F225 HydrophobicContact CB-CD1 3.42Å; M213-F225 VanDerWaalsContact CB-CD1 3.42Å; M213-F225 HydrophobicContact CB-CE1 4Å; M213-F225 HydrophobicContact CB-CG 3.93Å; M213-F225 WeakPolarHBondContact CB-O 3.31Å; M213-F225 HydrophobicContact CE-CE1 4.03Å; M213-F225 HydrophobicContact CE-CZ 4.27Å; M213-F225 HydrophobicContact CG-CD1 3.5Å; M213-F225 HydrophobicContact CG-CE1 3.56Å; M213-F225 HydrophobicContact CG-CG 4.08Å; M213-F225 HydrophobicContact CG-CZ 4.15Å; M213-F225 PolarHBondContact N-O 3.28Å; M213-F225 HydrophobicContact SD-CE1 4.41Å; G214-F225 PolarHBondContact N-O 2.92Å; G214-F225 PolarHBondContact O-N 3.38Å
226	D	95.4	Very high	89.1	Confident	14 Å²	14	34 Å²	34	8%	0.075	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	154.1	174.1	-66.7	-46	0	0	0	109	Q116 K118 T212 K224	Q116-D226 PolarHBondContact N-O 2.89Å; Q116-D226 PolarHBondContact O-N 2.86Å; K118-D226 IonicContact NZ-OD2 2.83Å; T212-D226 WeakPolarHBondContact CA-OD1 3.33Å; T212-D226 WeakPolarHBondContact CB-OD1 3.28Å; T212-D226 WeakPolarHBondContact CG2-OD1 3.3Å; T212-D226 PolarHBondContact OG1-OD1 3.22Å; K224-D226 VanDerWaalsContact CE-OD1 3.22Å; K224-D226 WeakPolarHBondContact CE-OD1 3.43Å; K224-D226 WeakPolarHBondContact CE-OD2 3.45Å; K224-D226 IonicContact NZ-OD2 2.77Å
227	M	95.1	Very high	87.1	Confident	1 Å²	1	40 Å²	40	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	162.8	169.3	70.7	169	-79.6	0	0	111.5	E113 Y114 Y115 L161 M162 L165 K210 L211 M213 T229	E113-M227 HydrophobicContact CG-CE 4.26Å; E113-M227 VanDerWaalsContact OE1-CE 3.31Å; E113-M227 WeakPolarHBondContact OE1-CE 3.35Å; Y114-M227 CarbonylContact O-C 3.54Å; Y114-M227 WeakPolarHBondContact O-CA 3.12Å; Y114-M227 VanDerWaalsContact O-CB 3.25Å; Y114-M227 WeakPolarHBondContact O-CB 3.46Å; Y115-M227 HydrophobicContact CD1-CB 3.8Å; Y115-M227 HydrophobicContact CD1-CE 4.43Å; Y115-M227 HydrophobicContact CD1-SD 4.14Å; Y115-M227 HydrophobicContact CE1-CB 4.31Å; Y115-M227 HydrophobicContact CE1-CE 3.78Å; Y115-M227 HydrophobicContact CE1-SD 3.82Å; L161-M227 HydrophobicContact CD2-CE 4.2Å; L161-M227 HydrophobicContact CD2-CG 4.24Å; L161-M227 HydrophobicContact CD2-SD 3.28Å; L161-M227 WeakPolarHBondContact CD2-SD 3.35Å; M162-M227 HydrophobicContact CE-CE 4.11Å; M162-M227 HydrophobicContact CE-SD 3.63Å; L165-M227 HydrophobicContact CD1-CE 3.78Å; K210-M227 WeakPolarHBondContact CA-O 3.37Å; L211-M227 HydrophobicContact CB-CG 4.07Å; L211-M227 PolarHBondContact N-O 2.91Å; L211-M227 PolarHBondContact O-N 3.4Å; M213-M227 HydrophobicContact CE-CG 3.93Å; M213-M227 HydrophobicContact CE-SD 3.35Å; M213-M227 WeakPolarHBondContact CE-SD 3.15Å; M227-T229 HydrophobicContact CE-CG2 4.36Å
228	A	95.1	Very high	84.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.5	165.9	0	0	0	0	0	110.6	E113 Y114 F204 V209 K210	E113-A228 CarbonylContact C-O 3.53Å; E113-A228 VanDerWaalsContact CA-O 3.29Å; E113-A228 WeakPolarHBondContact CA-O 3.27Å; Y114-A228 HydrophobicContact CD1-CB 3.94Å; Y114-A228 HydrophobicContact CE1-CB 3.36Å; Y114-A228 HydrophobicContact CE2-CB 4.39Å; Y114-A228 PolarHBondContact N-O 3.5Å; Y114-A228 PolarHBondContact O-N 2.96Å; F204-A228 HydrophobicContact CE1-CB 4.49Å; F204-A228 HydrophobicContact CE2-CB 4.17Å; F204-A228 HydrophobicContact CZ-CB 3.66Å; V209-A228 WeakPolarHBondContact O-CA 3.26Å; K210-A228 HydrophobicContact CB-CB 4.48Å; K210-A228 HydrophobicContact CG-CB 3.88Å
229	T	94.8	Very high	82.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.8	-178.2	-165.4	0	0	0	0	109.2	L165 P208 V209 M227 R231 R233	L165-T229 HydrophobicContact CD2-CG2 3.84Å; P208-T229 CarbonylContact C-O 3.5Å; P208-T229 WeakPolarHBondContact CA-O 3.42Å; V209-T229 PolarHBondContact N-O 2.79Å; V209-T229 PolarHBondContact O-N 3.38Å; V209-T229 VanDerWaalsContact O-N 3.09Å; M227-T229 HydrophobicContact CE-CG2 4.36Å; T229-R231 PolarHBondContact O-N 2.86Å; T229-R233 VanDerWaalsContact OG1-CD 3.28Å; T229-R233 WeakPolarHBondContact OG1-CD 3.35Å
230	E	93.3	Very high	80	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	130.2	174.3	-64.1	177.9	149.3	0	0	110.9	T112 F204 Q206 E207 R232 R233	T112-E230 PolarHBondContact O-N 3.11Å; F204-E230 HydrophobicContact CD1-CG 4.26Å; Q206-E230 HydrophobicContact CB-CB 4.39Å; Q206-E230 HydrophobicContact CB-CG 3.99Å; Q206-E230 PolarHBondContact NE2-OE1 3.4Å; Q206-E230 PolarHBondContact NE2-OE2 3.19Å; E207-E230 CarbonylContact O-C 3.57Å; E207-E230 WeakPolarHBondContact O-CA 3.46Å; E230-R232 VanDerWaalsContact C-N 3.27Å; E230-R232 HydrophobicContact CB-CG 4.11Å; E230-R232 PolarHBondContact O-N 2.98Å; E230-R232 VanDerWaalsContact O-N 3.15Å; E230-R232 IonicContact OE1-NH2 3.06Å; E230-R232 IonicContact OE2-CZ 3.59Å; E230-R232 VanDerWaalsContact OE2-CZ 3.25Å; E230-R232 IonicContact OE2-NE 3.68Å; E230-R232 PolarHBondContact OE2-NE 3.41Å; E230-R232 IonicContact OE2-NH2 2.85Å; E230-R232 PolarHBondContact OE2-NH2 2.84Å; E230-R233 HydrophobicContact CB-CG 4.4Å; E230-R233 VanDerWaalsContact O-CB 3.27Å; E230-R233 WeakPolarHBondContact O-CB 3.3Å; E230-R233 PolarHBondContact O-N 3.44Å; E230-R233 IonicContact OE2-NE 3.94Å
231	R	89.7	Confident	77.6	Confident	97 Å²	97	62.9 Å²	62.9	37%	0.366	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-45	-47.7	-177.7	178.5	-176.5	-79.5	-97.6	7.1	113.1	E207 V209 T229 R233 L234 E235	E207-R231 HydrophobicContact CB-CB 4.32Å; E207-R231 WeakPolarHBondContact O-CB 3.44Å; E207-R231 PolarHBondContact O-N 3.26Å; E207-R231 IonicContact OE1-CZ 2.71Å; E207-R231 IonicContact OE1-NE 3.53Å; E207-R231 PolarHBondContact OE1-NE 3.06Å; E207-R231 IonicContact OE1-NH2 2.89Å; E207-R231 PolarHBondContact OE1-NH2 2.8Å; E207-R231 WeakPolarHBondContact OE2-CD 3.47Å; E207-R231 IonicContact OE2-CZ 3.09Å; E207-R231 IonicContact OE2-NE 3.2Å; E207-R231 PolarHBondContact OE2-NE 3.43Å; E207-R231 VanDerWaalsContact OE2-NE 3.09Å; V209-R231 HydrophobicContact CG2-CB 3.69Å; V209-R231 HydrophobicContact CG2-CG 3.9Å; T229-R231 PolarHBondContact O-N 2.86Å; R231-R233 PolarHBondContact O-N 3.29Å; R231-L234 WeakPolarHBondContact O-CB 3.45Å; R231-L234 PolarHBondContact O-N 3.01Å; R231-E235 WeakPolarHBondContact CD-OE1 3.25Å; R231-E235 VanDerWaalsContact CG-CD 3.41Å; R231-E235 HydrophobicContact CG-CG 4.24Å; R231-E235 WeakPolarHBondContact CG-OE1 3.36Å; R231-E235 IonicContact NH1-OE1 3.19Å; R231-E235 PolarHBondContact O-N 3.25Å
232	R	87.8	Confident	75	Confident	117 Å²	117	67.8 Å²	67.8	44%	0.442	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-53.3	-24.7	177.7	67	175.5	-177.9	163.4	4.7	114.7	Q206 E230 L234 Q236	Q206-R232 VanDerWaalsContact OE1-CZ 3.3Å; Q206-R232 VanDerWaalsContact OE1-NE 3.17Å; E230-R232 VanDerWaalsContact C-N 3.27Å; E230-R232 HydrophobicContact CB-CG 4.11Å; E230-R232 PolarHBondContact O-N 2.98Å; E230-R232 VanDerWaalsContact O-N 3.15Å; E230-R232 IonicContact OE1-NH2 3.06Å; E230-R232 IonicContact OE2-CZ 3.59Å; E230-R232 VanDerWaalsContact OE2-CZ 3.25Å; E230-R232 IonicContact OE2-NE 3.68Å; E230-R232 PolarHBondContact OE2-NE 3.41Å; E230-R232 IonicContact OE2-NH2 2.85Å; E230-R232 PolarHBondContact OE2-NH2 2.84Å; R232-L234 VanDerWaalsContact C-N 3.34Å; R232-Q236 PolarHBondContact O-N 3.44Å
233	R	86.9	Confident	72.4	Confident	12 Å²	12	73.7 Å²	73.7	5%	0.045	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-77.7	-21.9	178.9	-66.7	178.3	168.8	-77.3	-7.1	112.6	G166 P167 P169 T229 E230 R231	G166-R233 PolarHBondContact N-O 2.9Å; G166-R233 PolarHBondContact O-NH1 2.87Å; P167-R233 PolarHBondContact O-NH1 3.48Å; P169-R233 VanDerWaalsContact CG-NH2 3.35Å; T229-R233 VanDerWaalsContact OG1-CD 3.28Å; T229-R233 WeakPolarHBondContact OG1-CD 3.35Å; E230-R233 HydrophobicContact CB-CG 4.4Å; E230-R233 VanDerWaalsContact O-CB 3.27Å; E230-R233 WeakPolarHBondContact O-CB 3.3Å; E230-R233 PolarHBondContact O-N 3.44Å; E230-R233 IonicContact OE2-NE 3.94Å; R231-R233 PolarHBondContact O-N 3.29Å
234	L	84.4	Confident	69.7	Low	62 Å²	62	82.8 Å²	82.8	33%	0.325	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-30.5	174.7	-165.8	66.2	0	0	0	111	L165 V209 R231 R232 Q236	L165-L234 HydrophobicContact CD2-CD1 4.08Å; V209-L234 HydrophobicContact CG1-CD2 4.37Å; R231-L234 WeakPolarHBondContact O-CB 3.45Å; R231-L234 PolarHBondContact O-N 3.01Å; R232-L234 VanDerWaalsContact C-N 3.34Å; L234-Q236 VanDerWaalsContact C-N 3.32Å; L234-Q236 PolarHBondContact O-N 2.84Å
235	E	70.5	Confident	67.2	Low	96 Å²	96	86.1 Å²	86.1	45%	0.449	45%	0.451	S	S	.	.			trans	-80.8	-4.4	-178.2	-69.5	171.8	171.3	0	0	114.3	R231 V237 E238	R231-E235 WeakPolarHBondContact CD-OE1 3.25Å; R231-E235 VanDerWaalsContact CG-CD 3.41Å; R231-E235 HydrophobicContact CG-CG 4.24Å; R231-E235 WeakPolarHBondContact CG-OE1 3.36Å; R231-E235 IonicContact NH1-OE1 3.19Å; R231-E235 PolarHBondContact O-N 3.25Å; E235-V237 PolarHBondContact O-N 2.89Å; E235-E238 PolarHBondContact O-N 3.42Å
236	Q	56.3	Low	64.3	Low	137 Å²	137	93.3 Å²	93.3	64%	0.64	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	24.4	177.9	-93.7	-176	-9.6	0	0	115.2	R232 L234	R232-Q236 PolarHBondContact O-N 3.44Å; L234-Q236 VanDerWaalsContact C-N 3.32Å; L234-Q236 PolarHBondContact O-N 2.84Å
237	V	49.8	Very low	62.1	Low	131 Å²	131	96.3 Å²	96.3	79%	0.794	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-24.9	159.8	-178.8	0	0	0	0	112.1	E235	E235-V237 PolarHBondContact O-N 2.89Å
238	E	35.3	Very low	59.9	Low	178 Å²	178	100.4 Å²	100.4	83%	0.832	51%	0.514	S	S	*	.	S	Bend	trans	-149.8	144.2	170.7	-69.6	-169.5	152.2	0	0	112.1	E235	E235-E238 PolarHBondContact O-N 3.42Å
239	E	42.1	Very low	57.6	Low	188 Å²	188	101.4 Å²	101.4	88%	0.879	52%	0.52	S	S	*	.			trans	-86.4	146.1	-163.1	-164.9	176.7	-172.3	0	0	115.4
240	S	42.3	Very low	55.3	Low	111 Å²	111	109.4 Å²	109.4	78%	0.776	55%	0.554	S	S	*	*			trans	84.2	106.7	152.1	69.6	0	0	0	0	122
241	A	39.2	Very low	53.3	Low	109 Å²	109	110.7 Å²	110.7	90%	0.901	56%	0.561	S	S	*	*				-179.6	147	117	0	0	0	0	0	110.7
242	S	38.2	Very low	51	Low	106 Å²	106	110 Å²	110	74%	0.741	56%	0.562	S	S	*	*			trans	-112.8	131.5	-174.1	-179.8	0	0	0	0	112.5
243	V	38.2	Very low	48.7	Very low	124 Å²	124	111.6 Å²	111.6	75%	0.752	57%	0.574	S	S	*	*			trans	-122.4	135.6	162.2	-179.4	0	0	0	0	108.5
244	K	38.5	Very low	46.3	Very low	200 Å²	200	118.6 Å²	118.6	87%	0.87	61%	0.608	S	S	*	*			trans	-101.5	103.3	179.9	-73.5	-179.5	179.8	176.1	0	110.2
245	E	42.3	Very low	43.7	Very low	125 Å²	125	122.2 Å²	122.2	58%	0.584	63%	0.632	S	S	*	*			trans	-125.3	154.3	159.2	-67.4	-169.3	170.4	0	0	109.6	W247	E245-W247 HydrophobicContact CB-CH2 4.29Å; E245-W247 HydrophobicContact CB-CZ2 3.71Å; E245-W247 PolarHBondContact O-NE1 3.37Å
246	K	34.8	Very low	41.8	Very low	151 Å²	151	123.3 Å²	123.3	66%	0.657	64%	0.641	S	S	*	*			trans	-95.5	120.8	-176.8	-172.9	-177.8	179.2	-170.3	0	109.2	E203	E203-K246 IonicContact OE2-NZ 3Å
247	W	50.1	Low	40.4	Very low	78 Å²	78	125.3 Å²	125.3	30%	0.295	65%	0.65	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.3	100.3	-171.8	-51.6	91.9	0	0	0	111.5	F204 E207 P208 E245	F204-W247 HydrophobicContact CB-CB 4.41Å; F204-W247 PolarHBondContact N-O 3.46Å; E207-W247 HydrophobicContact CB-CD2 4.39Å; E207-W247 HydrophobicContact CB-CG 4.49Å; E207-W247 HydrophobicContact CB-CZ2 4.05Å; E207-W247 VanDerWaalsContact CB-NE1 3.31Å; E207-W247 HydrophobicContact CG-CD2 4.1Å; E207-W247 HydrophobicContact CG-CH2 4.29Å; E207-W247 HydrophobicContact CG-CZ2 3.61Å; P208-W247 VanDerWaalsContact CD-CG 3.43Å; P208-W247 HydrophobicContact CG-CB 4.02Å; E245-W247 HydrophobicContact CB-CH2 4.29Å; E245-W247 HydrophobicContact CB-CZ2 3.71Å; E245-W247 PolarHBondContact O-NE1 3.37Å
248	I	48.1	Very low	39.5	Very low	87 Å²	87	124.3 Å²	124.3	45%	0.446	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.1	116.1	176.1	-60.7	175.3	0	0	0	108.4	T201 E203	T201-I248 HydrophobicContact CG2-CG2 4.49Å; E203-I248 HydrophobicContact CG-CG1 4.29Å; E203-I248 HydrophobicContact CG-CG2 4.34Å
249	V	47.3	Very low	39.1	Very low	20 Å²	20	123.9 Å²	123.9	12%	0.121	65%	0.649	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.3	102.3	173	-179.2	0	0	0	0	108.7	I202 F204 P208 I251	I202-V249 CarbonylContact O-C 3.6Å; I202-V249 PolarHBondContact O-N 2.68Å; F204-V249 HydrophobicContact CD2-CG2 4.07Å; F204-V249 HydrophobicContact CE2-CG2 4.41Å; P208-V249 HydrophobicContact CG-CG2 4.19Å; V249-I251 PolarHBondContact O-N 3.43Å
250	K	46.3	Very low	38.5	Very low	168 Å²	168	120.5 Å²	120.5	73%	0.73	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.1	131	167.3	-67.6	-178.8	-179.2	176.5	0	108.6	E252	K250-E252 PolarHBondContact O-N 2.98Å; K250-E252 VanDerWaalsContact O-N 3.08Å
251	I	50.6	Low	38.2	Very low	28 Å²	28	120.3 Å²	120.3	14%	0.144	64%	0.643	C	S	.	*			trans	-63.6	111.1	170.1	-57.7	177.9	0	0	0	106.3	I98 N200 I202 V249 E253 F365	I98-I251 HydrophobicContact CD1-CD1 3.89Å; I98-I251 HydrophobicContact CD1-CG2 4.23Å; N200-I251 WeakPolarHBondContact O-CD1 3.43Å; I202-I251 HydrophobicContact CD1-CD1 3.88Å; I202-I251 HydrophobicContact CD1-CG1 4.29Å; I202-I251 HydrophobicContact CG1-CD1 4.11Å; I202-I251 HydrophobicContact CG1-CG1 4.46Å; V249-I251 PolarHBondContact O-N 3.43Å; I251-E253 PolarHBondContact O-N 3.39Å; I251-F365 HydrophobicContact CB-CZ 4.43Å; I251-F365 HydrophobicContact CD1-CE1 4.03Å; I251-F365 HydrophobicContact CD1-CZ 4.33Å; I251-F365 HydrophobicContact CG2-CE1 4.09Å; I251-F365 HydrophobicContact CG2-CZ 4.05Å
252	E	41.3	Very low	37.5	Very low	82 Å²	82	122.7 Å²	122.7	38%	0.383	64%	0.635	S	S	.	*			trans	-43.1	121.8	-167.5	-70.7	162.2	168.1	0	0	114	R95 K118 K250	R95-E252 PolarHBondContact NH2-O 3.46Å; K118-E252 IonicContact NZ-OE2 3.94Å; K118-E252 PolarHBondContact NZ-OE2 3.2Å; K250-E252 PolarHBondContact O-N 2.98Å; K250-E252 VanDerWaalsContact O-N 3.08Å
253	E	39.4	Very low	37	Very low	150 Å²	150	125.6 Å²	125.6	70%	0.701	64%	0.641	S	S	*	*			trans	-105.8	97.9	160.8	-162.9	165.9	-133.9	0	0	103.4	I251 K364	I251-E253 PolarHBondContact O-N 3.39Å; E253-K364 IonicContact OE1-NZ 3.94Å; E253-K364 PolarHBondContact OE1-NZ 3.35Å
254	Q	36.8	Very low	36.4	Very low	160 Å²	160	126.8 Å²	126.8	75%	0.748	64%	0.639	S	S	*	*			trans	-86.6	113.1	178.9	-76.5	-169.7	-16	0	0	108.8
255	V	30.8	Very low	35.8	Very low	137 Å²	137	126.6 Å²	126.6	83%	0.83	64%	0.641	S	S	*	*			trans	-118.4	122.2	158.3	178.7	0	0	0	0	104.9
256	D	31.3	Very low	35.1	Very low	119 Å²	119	126.3 Å²	126.3	64%	0.636	65%	0.648	S	S	*	*			trans	-72.1	164.6	-178.4	-81.4	-47	0	0	0	113.7
257	E	26.8	Very low	35	Very low	179 Å²	179	128.5 Å²	128.5	84%	0.836	66%	0.66	S	S	*	*			trans	100.5	150.3	164.6	-85.1	-149.3	139.6	0	0	120.3
258	P	30.4	Very low	34	Very low	110 Å²	110	133.8 Å²	133.8	71%	0.714	69%	0.688	S	S	*	*				-128.1	173.3	-60.2	29.2	-7.7	0	0	0	112.9
259	L	27.5	Very low	32.9	Very low	169 Å²	169	133.8 Å²	133.8	89%	0.885	70%	0.701	S	S	*	*			trans	-58.8	153	-177.2	-82.8	128.8	0	0	0	116.7
260	S	28.1	Very low	32	Very low	118 Å²	118	142 Å²	142	83%	0.825	74%	0.739	S	S	*	*			trans	-157.4	156.2	146.8	-70.3	0	0	0	0	111
261	P	35.5	Very low	31.1	Very low	107 Å²	107	141.2 Å²	141.2	70%	0.695	74%	0.742	S	S	*	*			trans	-113.6	175.7	-139	41.2	-32.4	0	0	0	116.2
262	E	25.1	Very low	30.2	Very low	158 Å²	158	150.5 Å²	150.5	74%	0.738	78%	0.777	S	S	*	*			trans	70.4	121.6	154.7	-78.8	165.8	170.8	0	0	119.5
263	L	28.1	Very low	29.5	Very low	168 Å²	168	151 Å²	151	88%	0.88	80%	0.795	S	S	*	*				-143	123.8	106.2	-81.4	-176.2	0	0	0	110.2
264	E	24.6	Very low	29.2	Very low	149 Å²	149	150.4 Å²	150.4	70%	0.696	80%	0.801	S	S	*	*			trans	-55.9	143.8	163.5	-62.8	175.2	138.5	0	0	110.9
265	Q	27.5	Very low	28.7	Very low	195 Å²	195	149.6 Å²	149.6	91%	0.911	80%	0.803	S	S	*	*				-154.3	125.2	129.5	-109.6	157.8	80.1	0	0	110.9
266	V	27.8	Very low	28.7	Very low	120 Å²	120	148.8 Å²	148.8	73%	0.727	80%	0.798	S	S	*	*			trans	-65.2	139.8	179.4	177.8	0	0	0	0	109.9
267	E	31.5	Very low	28.6	Very low	196 Å²	196	150 Å²	150	92%	0.916	80%	0.804	S	S	*	*			trans	-157.2	153.4	136.1	-111.3	175.5	-152.8	0	0	111.2
268	E	28.3	Very low	28.9	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.883	80%	0.803	S	S	*	*			trans	-91.5	163.3	-139	-150.9	168.8	-178.5	0	0	113.9
269	A	27	Very low	28.9	Very low	88 Å²	88	149 Å²	149	73%	0.727	80%	0.803	S	S	*	*			trans	-71.9	143.5	-176.6	0	0	0	0	0	113.4
270	E	27.5	Very low	28.9	Very low	193 Å²	193	149.1 Å²	149.1	90%	0.902	80%	0.799	S	S	*	*			trans	-130.1	122.7	145.4	-73.7	-162.8	166.9	0	0	111.1
271	N	27.4	Very low	28.9	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	80%	0.797	S	S	*	*			trans	-84.7	122.6	-179.6	-125.7	-24.1	0	0	0	108.5
272	Y	31.2	Very low	28.5	Very low	223 Å²	223	154 Å²	154	88%	0.875	80%	0.803	S	S	*	*			trans	-139.9	111	149.6	-98.7	-83.4	0	0	0	109.4
273	A	27.8	Very low	28.5	Very low	91 Å²	91	154.1 Å²	154.1	75%	0.752	81%	0.805	S	S	*	*			trans	-74	135.2	166.5	0	0	0	0	0	109.2
274	T	32.3	Very low	28.4	Very low	138 Å²	138	153.5 Å²	153.5	85%	0.847	80%	0.803	S	S	*	*			trans	-148.6	134.1	150.6	-38.5	0	0	0	0	110.3
275	D	27.1	Very low	28.7	Very low	144 Å²	144	153.1 Å²	153.1	77%	0.77	80%	0.804	S	S	*	*			trans	-53.1	144.4	-178.9	-93.1	-44.3	0	0	0	116.2
276	V	31	Very low	28.5	Very low	120 Å²	120	152.3 Å²	152.3	73%	0.727	80%	0.8	S	S	*	*				37.9	114.4	127.5	-168.2	0	0	0	0	118.3
277	D	27.3	Very low	28.5	Very low	143 Å²	143	155.4 Å²	155.4	77%	0.765	81%	0.806	S	S	*	*				-154.2	132.4	117.6	-150.8	1.7	0	0	0	112.5
278	N	34.1	Very low	28.3	Very low	154 Å²	154	155.9 Å²	155.9	82%	0.824	81%	0.805	S	S	*	*			trans	-91.4	115.9	173.2	-83.9	-33.3	0	0	0	107.5
279	T	29.3	Very low	28.2	Very low	116 Å²	116	154.3 Å²	154.3	71%	0.712	80%	0.803	S	S	*	*			trans	-115.9	104.5	168.6	-33.7	0	0	0	0	110.6	I281	T279-I281 PolarHBondContact O-N 2.8Å
280	E	28	Very low	28.2	Very low	171 Å²	171	158.8 Å²	158.8	80%	0.799	81%	0.809	S	S	*	*			trans	-53.1	119.6	162	-87.1	179.5	144	0	0	110.3
281	I	28.9	Very low	28.1	Very low	153 Å²	153	161.3 Å²	161.3	79%	0.785	81%	0.81	S	S	*	*			trans	-92.7	101.1	165.8	-61	177.2	0	0	0	107.6	T279 M283	T279-I281 PolarHBondContact O-N 2.8Å; I281-M283 HydrophobicContact CG2-CG 4.21Å; I281-M283 PolarHBondContact O-N 2.79Å
282	Q	26.5	Very low	28	Very low	174 Å²	174	158.9 Å²	158.9	81%	0.813	81%	0.805	S	S	*	*			trans	-73.4	117.7	166.7	-67.8	-174.1	23	0	0	109.4
283	M	25.8	Very low	27.9	Very low	160 Å²	160	152.2 Å²	152.2	79%	0.788	80%	0.796	S	S	*	*			trans	-101.1	111.6	167.7	-68.5	-162.4	-59.1	0	0	109.9	I281	I281-M283 HydrophobicContact CG2-CG 4.21Å; I281-M283 PolarHBondContact O-N 2.79Å
284	N	26.5	Very low	27.9	Very low	156 Å²	156	157.4 Å²	157.4	83%	0.834	81%	0.805	S	S	*	*			trans	-92.1	110.8	176.7	-148.9	3	0	0	0	108
285	I	29.3	Very low	28	Very low	141 Å²	141	154.7 Å²	154.7	72%	0.723	79%	0.787	S	S	*	*			trans	-110.5	117.1	176.7	-61.6	178.7	0	0	0	108.9	E287	I285-E287 PolarHBondContact O-N 2.9Å
286	H	24.5	Very low	28.6	Very low	178 Å²	178	152.8 Å²	152.8	82%	0.824	78%	0.783	S	S	*	*			trans	-67.9	122	170.9	-101.2	59.2	0	0	0	110.6
287	E	28.3	Very low	29.7	Very low	184 Å²	184	149.1 Å²	149.1	86%	0.86	76%	0.758	S	S	*	*			trans	-75.7	125.1	170.5	-70.7	-174	146.2	0	0	111.1	I285	I285-E287 PolarHBondContact O-N 2.9Å
288	K	26.6	Very low	31.1	Very low	206 Å²	206	146 Å²	146	90%	0.896	74%	0.74	S	S	*	*			trans	-106.8	121.3	154.2	-91	-176.5	177.8	175.8	0	108.5
289	N	25.1	Very low	32.6	Very low	156 Å²	156	138.8 Å²	138.8	83%	0.834	70%	0.702	S	S	*	*			trans	-78.8	111.7	-174	-167.4	15.9	0	0	0	110.4
290	E	27.2	Very low	34	Very low	182 Å²	182	133.8 Å²	133.8	85%	0.85	67%	0.671	S	S	*	*			trans	-112.6	123	165.5	-77.6	-170.4	162.2	0	0	109.7	S292	E290-S292 PolarHBondContact O-N 2.77Å
291	R	25.8	Very low	35.2	Very low	247 Å²	247	129.9 Å²	129.9	93%	0.932	65%	0.653	S	S	*	*			trans	-62.8	115.3	177.6	-97.8	179.5	171.2	-174.5	-2.3	110.3
292	S	26.4	Very low	36.6	Very low	100 Å²	100	126 Å²	126	70%	0.699	63%	0.632	S	S	*	*			trans	-80.5	128.1	171.5	-167	0	0	0	0	110.7	E290	E290-S292 PolarHBondContact O-N 2.77Å
293	A	27.5	Very low	38	Very low	82 Å²	82	117.8 Å²	117.8	68%	0.678	59%	0.594	S	S	*	*			trans	-78.2	135.1	169.9	0	0	0	0	0	110.1	V295	A293-V295 PolarHBondContact O-N 3.19Å
294	E	29	Very low	39.3	Very low	201 Å²	201	111.7 Å²	111.7	94%	0.939	57%	0.567	S	S	*	*			trans	-71.2	109	177.9	-67.7	-179.6	171	0	0	110.3
295	V	33	Very low	40.1	Very low	80 Å²	80	109.3 Å²	109.3	49%	0.485	55%	0.554	S	S	.	*			trans	-113.8	132.4	170	-179.1	0	0	0	0	107.2	A293 E297	A293-V295 PolarHBondContact O-N 3.19Å; V295-E297 PolarHBondContact O-N 3.37Å
296	P	41.3	Very low	41	Very low	104 Å²	104	106.4 Å²	106.4	68%	0.675	54%	0.539	S	S	*	.			trans	-63.8	127.6	-176.7	22.3	-30.8	0	0	0	112.1
297	E	52.8	Low	41.7	Very low	44 Å²	44	105.3 Å²	105.3	21%	0.206	53%	0.534	C	S	.	.			trans	-98.8	98.6	-171	-68.5	163.7	132.3	0	0	111.4	K56 V295 M301	K56-E297 VanDerWaalsContact CE-OE1 3.31Å; K56-E297 WeakPolarHBondContact CE-OE1 3.28Å; K56-E297 WeakPolarHBondContact CE-OE2 3.44Å; K56-E297 WeakPolarHBondContact CG-OE1 3.2Å; K56-E297 IonicContact NZ-OE2 2.81Å; K56-E297 PolarHBondContact NZ-OE2 3.09Å; V295-E297 PolarHBondContact O-N 3.37Å; E297-M301 WeakPolarHBondContact O-CB 3.21Å; E297-M301 VanDerWaalsContact O-CG 3.22Å; E297-M301 WeakPolarHBondContact O-CG 3.47Å; E297-M301 PolarHBondContact O-N 2.77Å
298	I	58.1	Low	42.2	Very low	76 Å²	76	102.9 Å²	102.9	39%	0.39	53%	0.526	S	S	.	.	H	α-helix	trans	-74.3	-39.5	-166.5	-60	167.5	0	0	0	112.8	I300 M301 E302	I298-I300 PolarHBondContact O-N 2.69Å; I298-M301 PolarHBondContact O-N 3.41Å; I298-E302 HydrophobicContact CG2-CG 3.66Å; I298-E302 WeakPolarHBondContact CG2-OE1 3.38Å; I298-E302 WeakPolarHBondContact O-CB 3.35Å; I298-E302 VanDerWaalsContact O-CG 3.29Å; I298-E302 WeakPolarHBondContact O-CG 3.22Å; I298-E302 PolarHBondContact O-N 2.9Å
299	M	63.9	Low	42.6	Very low	4 Å²	4	97.1 Å²	97.1	2%	0.02	53%	0.526	C	S	.	.	H	α-helix	trans	-67.2	-44	-170.4	-167.7	-166.8	-87.8	0	0	113.9	A35 L66 I78 H79 M82 A303	A35-M299 HydrophobicContact CB-CG 4.27Å; A35-M299 HydrophobicContact CB-SD 3.88Å; L66-M299 HydrophobicContact CB-CE 3.78Å; L66-M299 HydrophobicContact CD2-CE 3.79Å; L66-M299 HydrophobicContact CG-CE 4.26Å; I78-M299 HydrophobicContact CG2-CE 4.01Å; H79-M299 WeakPolarHBondContact CD2-CE 3.15Å; H79-M299 WeakPolarHBondContact NE2-CE 3.43Å; M82-M299 HydrophobicContact CG-CE 4.08Å; M82-M299 HydrophobicContact CG-SD 4.44Å; M299-A303 WeakPolarHBondContact O-CB 3.36Å; M299-A303 PolarHBondContact O-N 3.31Å
300	I	60.1	Low	43	Very low	10 Å²	10	94.3 Å²	94.3	5%	0.051	51%	0.514	C	S	.	.	H	α-helix	trans	-75.5	-34.7	177.5	-69.8	177.8	0	0	0	111	R32 I36 K56 I65 I298 A303 S304	R32-I300 HydrophobicContact CG-CG2 4.46Å; I36-I300 HydrophobicContact CG1-CD1 4.12Å; K56-I300 HydrophobicContact CD-CD1 3.85Å; I65-I300 HydrophobicContact CB-CD1 4.36Å; I65-I300 HydrophobicContact CD1-CD1 3.56Å; I65-I300 HydrophobicContact CG1-CD1 3.68Å; I65-I300 HydrophobicContact CG2-CD1 3.76Å; I65-I300 HydrophobicContact CG2-CG1 3.9Å; I298-I300 PolarHBondContact O-N 2.69Å; I300-A303 WeakPolarHBondContact O-CB 3.33Å; I300-A303 PolarHBondContact O-N 2.93Å; I300-S304 PolarHBondContact O-N 2.86Å; I300-S304 PolarHBondContact O-OG 3.3Å
301	M	53.6	Low	43.3	Very low	89 Å²	89	95.6 Å²	95.6	44%	0.438	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-44.3	174.3	-73	-176.6	74	0	0	111.2	E297 I298 A303 S304 D305	E297-M301 WeakPolarHBondContact O-CB 3.21Å; E297-M301 VanDerWaalsContact O-CG 3.22Å; E297-M301 WeakPolarHBondContact O-CG 3.47Å; E297-M301 PolarHBondContact O-N 2.77Å; I298-M301 PolarHBondContact O-N 3.41Å; M301-A303 VanDerWaalsContact C-N 3.27Å; M301-A303 PolarHBondContact O-N 3.06Å; M301-S304 WeakPolarHBondContact CA-OG 3.31Å; M301-S304 CarbonylContact O-C 3.42Å; M301-S304 WeakPolarHBondContact O-CA 3.28Å; M301-S304 PolarHBondContact O-N 2.92Å; M301-S304 PolarHBondContact O-OG 2.95Å; M301-D305 WeakPolarHBondContact O-CB 3.33Å; M301-D305 VanDerWaalsContact O-CG 3.26Å; M301-D305 PolarHBondContact O-N 3.37Å
302	E	57.2	Low	43.7	Very low	71 Å²	71	91.9 Å²	91.9	33%	0.332	50%	0.503	S	S	.	.	H	α-helix	trans	-61.2	-36.7	171.9	-77.9	-175.2	173.7	0	0	111.5	Q83 I298 S304	Q83-E302 PolarHBondContact NE2-OE2 3.36Å; Q83-E302 VanDerWaalsContact NE2-OE2 3.17Å; I298-E302 HydrophobicContact CG2-CG 3.66Å; I298-E302 WeakPolarHBondContact CG2-OE1 3.38Å; I298-E302 WeakPolarHBondContact O-CB 3.35Å; I298-E302 VanDerWaalsContact O-CG 3.29Å; I298-E302 WeakPolarHBondContact O-CG 3.22Å; I298-E302 PolarHBondContact O-N 2.9Å; E302-S304 PolarHBondContact O-N 3.46Å
303	A	56.7	Low	44.8	Very low	3 Å²	3	91.3 Å²	91.3	3%	0.025	50%	0.495	C	S	.	.	H	α-helix	trans	-64.4	-26.5	172.8	0	0	0	0	0	113	K31 R32 F86 M299 I300 M301	K31-A303 HydrophobicContact CB-CB 4.2Å; R32-A303 HydrophobicContact CG-CB 4.33Å; F86-A303 HydrophobicContact CE2-CB 3.87Å; F86-A303 HydrophobicContact CZ-CB 3.94Å; M299-A303 WeakPolarHBondContact O-CB 3.36Å; M299-A303 PolarHBondContact O-N 3.31Å; I300-A303 WeakPolarHBondContact O-CB 3.33Å; I300-A303 PolarHBondContact O-N 2.93Å; M301-A303 VanDerWaalsContact C-N 3.27Å; M301-A303 PolarHBondContact O-N 3.06Å
304	S	51.8	Low	45.5	Very low	31 Å²	31	100 Å²	100	22%	0.217	51%	0.51	C	S	.	.	H	α-helix	trans	-96.6	-30.2	177.7	60.9	0	0	0	0	115.6	I300 M301 E302	I300-S304 PolarHBondContact O-N 2.86Å; I300-S304 PolarHBondContact O-OG 3.3Å; M301-S304 WeakPolarHBondContact CA-OG 3.31Å; M301-S304 CarbonylContact O-C 3.42Å; M301-S304 WeakPolarHBondContact O-CA 3.28Å; M301-S304 PolarHBondContact O-N 2.92Å; M301-S304 PolarHBondContact O-OG 2.95Å; E302-S304 PolarHBondContact O-N 3.46Å
305	D	43.9	Very low	46.3	Very low	106 Å²	106	95.4 Å²	95.4	57%	0.567	50%	0.5	S	S	*	.	H	α-helix	trans	-100	2.9	-166.9	-66.7	-0.4	0	0	0	112.9	M301 E307	M301-D305 WeakPolarHBondContact O-CB 3.33Å; M301-D305 VanDerWaalsContact O-CG 3.26Å; M301-D305 PolarHBondContact O-N 3.37Å; D305-E307 PolarHBondContact O-N 3.31Å
306	M	48.1	Very low	46.6	Very low	81 Å²	81	94.2 Å²	94.2	40%	0.399	50%	0.504	S	S	.	.			trans	-75.6	58.9	174.9	-152.4	151.4	77.6	0	0	110.9	F86	F86-M306 HydrophobicContact CB-CE 3.72Å
307	E	39.2	Very low	46.1	Very low	154 Å²	154	98.8 Å²	98.8	72%	0.72	51%	0.508	S	S	*	.			trans	-73	135.4	167	-84.4	-164.3	161.7	0	0	110.3	D305	D305-E307 PolarHBondContact O-N 3.31Å
308	L	39.4	Very low	45.3	Very low	133 Å²	133	102.3 Å²	102.3	70%	0.696	53%	0.527	S	S	*	.			trans	-54.1	137.8	174.6	-65	165.4	0	0	0	110.9	V310	L308-V310 PolarHBondContact O-N 3.11Å
309	G	34.7	Very low	44.1	Very low	86 Å²	86	105.7 Å²	105.7	89%	0.887	54%	0.544	S	S	*	.			trans	-51.3	94	-174.8	0	0	0	0	0	114.5
310	V	33	Very low	42.6	Very low	96 Å²	96	114 Å²	114	58%	0.582	58%	0.58	S	S	*	*			trans	-113.8	100.8	161.7	-178.1	0	0	0	0	106.7	L308 R312	L308-V310 PolarHBondContact O-N 3.11Å; V310-R312 PolarHBondContact O-N 3.09Å
311	K	33.7	Very low	41.2	Very low	209 Å²	209	119 Å²	119	91%	0.909	62%	0.615	S	S	*	*			trans	-63.7	102.7	174.4	-67.9	-177.7	-179.9	178.8	0	108.8
312	R	34.8	Very low	40.2	Very low	170 Å²	170	121.8 Å²	121.8	64%	0.642	63%	0.631	S	S	*	*			trans	-79.1	130.3	168.5	-79.5	-179.4	172.6	127.1	-1.4	109.4	V310	V310-R312 PolarHBondContact O-N 3.09Å
313	T	49.6	Very low	38.9	Very low	87 Å²	87	124.8 Å²	124.8	53%	0.534	65%	0.654	S	S	.	*			trans	-81.9	159.8	165.4	58.6	0	0	0	0	110	S315 G316	T313-S315 PolarHBondContact O-N 2.63Å; T313-G316 PolarHBondContact O-N 2.85Å
314	R	41.7	Very low	37.6	Very low	266 Å²	266	132.7 Å²	132.7	100%	1.004	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	3.2	-176.9	-150.2	177	91.1	-169.6	7.5	115.6
315	S	45.8	Very low	36.5	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	4.1	179.1	-175.9	0	0	0	0	113.8	T313 R317	T313-S315 PolarHBondContact O-N 2.63Å; S315-R317 VanDerWaalsContact C-N 3.35Å; S315-R317 PolarHBondContact O-N 2.94Å
316	G	39.5	Very low	35.9	Very low	55 Å²	55	138.6 Å²	138.6	57%	0.567	72%	0.724	S	S	*	*			trans	72.8	15.4	172.6	0	0	0	0	0	116.3	T313	T313-G316 PolarHBondContact O-N 2.85Å
317	R	31.5	Very low	34.9	Very low	200 Å²	200	141.6 Å²	141.6	76%	0.755	75%	0.746	S	S	*	*			trans	-86.7	129.5	173.2	-96.6	-177.3	-177.8	163.3	1.6	111.9	S315	S315-R317 VanDerWaalsContact C-N 3.35Å; S315-R317 PolarHBondContact O-N 2.94Å
318	I	35.2	Very low	34.4	Very low	118 Å²	118	140.1 Å²	140.1	61%	0.605	75%	0.748	S	S	*	*			trans	-87.1	119.8	172.7	-58.6	170.7	0	0	0	107.9
319	I	33.5	Very low	33.9	Very low	148 Å²	148	140.5 Å²	140.5	76%	0.759	76%	0.756	S	S	*	*			trans	-99.4	114.1	171.4	-57.7	176.2	0	0	0	107.4
320	K	31.4	Very low	33.5	Very low	179 Å²	179	145 Å²	145	78%	0.778	75%	0.751	S	S	*	*			trans	-80.2	116.8	166	-71.3	-177.9	177.4	-177.8	0	107.8	I322	K320-I322 PolarHBondContact O-N 3.18Å
321	S	32.1	Very low	33.2	Very low	113 Å²	113	147.3 Å²	147.3	79%	0.79	76%	0.76	S	S	*	*			trans	-76.8	100	168.9	54.2	0	0	0	0	108.9
322	I	31.4	Very low	32.9	Very low	148 Å²	148	144.2 Å²	144.2	76%	0.759	76%	0.759	S	S	*	*			trans	-87.1	125.5	164.8	-62.1	167.4	0	0	0	106.3	K320	K320-I322 PolarHBondContact O-N 3.18Å
323	T	30.5	Very low	32.6	Very low	135 Å²	135	144.3 Å²	144.3	83%	0.828	77%	0.767	S	S	*	*			trans	-128.5	99.3	162.8	47.2	0	0	0	0	108.6
324	E	29.2	Very low	32.1	Very low	169 Å²	169	145.3 Å²	145.3	79%	0.79	77%	0.774	S	S	*	*			trans	-130.7	131.4	154.4	-88.6	-167.1	167.7	0	0	111
325	T	28.4	Very low	31.4	Very low	114 Å²	114	138.4 Å²	138.4	70%	0.699	76%	0.762	S	S	*	*			trans	77.5	121.4	144.4	51.3	0	0	0	0	123.6
326	N	30.8	Very low	30.5	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	76%	0.764	S	S	*	*			trans	61.8	115.5	132.1	-65.2	-21.1	0	0	0	121.5
327	V	28.8	Very low	30	Very low	144 Å²	144	139.4 Å²	139.4	87%	0.873	77%	0.771	S	S	*	*			trans	-140.3	124.7	142.4	179.3	0	0	0	0	110.7
328	T	27.1	Very low	29.9	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	77%	0.774	S	S	*	*			trans	-81.2	135	171.5	-49.6	0	0	0	0	111.4
329	V	29	Very low	29.5	Very low	140 Å²	140	139.6 Å²	139.6	85%	0.848	78%	0.775	S	S	*	*			trans	-149.3	144.1	147.6	-176.4	0	0	0	0	111.3
330	K	26.8	Very low	29.3	Very low	181 Å²	181	140.5 Å²	140.5	79%	0.787	77%	0.774	S	S	*	*			trans	-79.4	160.4	-164	-64.5	170.2	170.2	175	0	117.2
331	N	26.2	Very low	29.1	Very low	144 Å²	144	137.7 Å²	137.7	77%	0.77	77%	0.772	S	S	*	*			trans	62.7	118.9	139.4	-89.3	5.8	0	0	0	121.3
332	T	27.8	Very low	28.9	Very low	145 Å²	145	138.7 Å²	138.7	89%	0.89	77%	0.772	S	S	*	*				-168.2	127	100.2	11.7	0	0	0	0	111.5
333	Q	29.6	Very low	28.7	Very low	171 Å²	171	136 Å²	136	80%	0.799	77%	0.767	S	S	*	*			trans	-95.8	163.2	157.1	-132.9	-173.5	2.4	0	0	107.2
334	P	38.7	Very low	28.5	Very low	108 Å²	108	138.6 Å²	138.6	70%	0.701	77%	0.769	S	S	*	*				-143	178.9	65.4	37.2	-15	0	0	0	111.6
335	T	25.9	Very low	28.4	Very low	122 Å²	122	139.2 Å²	139.2	75%	0.748	77%	0.766	S	S	*	*			cis	-170.8	140.1	27.2	-18.4	0	0	0	0	109.7
336	A	27.4	Very low	28.2	Very low	91 Å²	91	141.7 Å²	141.7	75%	0.752	78%	0.775	S	S	*	*			trans	45	124.3	140	0	0	0	0	0	123.5
337	A	29.3	Very low	28.1	Very low	87 Å²	87	140.5 Å²	140.5	72%	0.719	77%	0.767	S	S	*	*				165.5	118.5	96.2	0	0	0	0	0	109.6
338	K	29.1	Very low	28	Very low	190 Å²	190	141.4 Å²	141.4	83%	0.826	77%	0.766	S	S	*	*				62	130.3	108.3	-70.7	-172.8	178.8	-176.4	0	113.3
339	E	27.6	Very low	27.8	Very low	132 Å²	132	140.8 Å²	140.8	62%	0.617	77%	0.767	S	S	*	*			cis	-177.1	151.7	30	-119.2	176.8	147.8	0	0	108.9
340	K	28.4	Very low	27.9	Very low	168 Å²	168	139.1 Å²	139.1	73%	0.73	76%	0.762	S	S	*	*			trans	54.4	146.3	138.2	-69.1	170.4	177.4	161.7	0	119.6
341	T	27.9	Very low	28.2	Very low	120 Å²	120	139.6 Å²	139.6	74%	0.736	77%	0.767	S	S	*	*			cis	-174.1	129.5	5.2	9	0	0	0	0	107.7
342	V	26.3	Very low	28.4	Very low	133 Å²	133	142.1 Å²	142.1	81%	0.806	77%	0.774	S	S	*	*				36.6	113.5	124.1	-175.1	0	0	0	0	120.7
343	S	28.3	Very low	28.6	Very low	91 Å²	91	140.7 Å²	140.7	64%	0.636	77%	0.77	S	S	*	*				45.6	126.3	128.7	178.5	0	0	0	0	121.8
344	Q	26.5	Very low	28.6	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	77%	0.769	S	S	*	*				-158.9	139.6	122.5	-158.8	161.3	-9.8	0	0	112.3
345	Y	26	Very low	28.5	Very low	182 Å²	182	138.6 Å²	138.6	71%	0.714	78%	0.776	S	S	*	*			trans	-78.7	158.9	-178.4	-80.5	-103.6	0	0	0	113.4	I347	Y345-I347 HydrophobicContact CD1-CG1 4.36Å
346	D	25.1	Very low	28.8	Very low	167 Å²	167	137 Å²	137	89%	0.893	78%	0.776	S	S	*	*				-158.3	158.1	125.2	-101.7	-29.9	0	0	0	112.9
347	I	28.3	Very low	29	Very low	120 Å²	120	137.8 Å²	137.8	62%	0.615	78%	0.776	S	S	*	*			trans	-120.8	145.5	-139.7	-79.3	175	0	0	0	113	Y345	Y345-I347 HydrophobicContact CD1-CG1 4.36Å
348	L	26.9	Very low	29.2	Very low	164 Å²	164	139.9 Å²	139.9	86%	0.859	78%	0.78	S	S	*	*			trans	51.1	128.2	152.4	-66.4	161.2	0	0	0	122.8
349	S	23.6	Very low	29.6	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	77%	0.774	S	S	*	*				168.9	138.3	113.4	-159.7	0	0	0	0	107
350	S	30.3	Very low	30.3	Very low	106 Å²	106	134.2 Å²	134.2	74%	0.741	77%	0.774	S	S	*	*			cis	-152.3	155.7	26.1	-53	0	0	0	0	110.1
351	Q	33.8	Very low	31.4	Very low	190 Å²	190	135.6 Å²	135.6	89%	0.888	78%	0.779	S	S	*	*			trans	-57.2	134.9	163.1	-68.6	165.8	-56.7	0	0	110.7
352	E	29.3	Very low	32.6	Very low	198 Å²	198	134.5 Å²	134.5	93%	0.925	76%	0.764	S	S	*	*			trans	-143.8	115.8	134.2	-122.8	176.6	-177.9	0	0	109.2
353	S	32.3	Very low	34.3	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	73%	0.734	S	S	*	*			trans	-79.2	123.5	175.4	48.4	0	0	0	0	109.8
354	S	29	Very low	36.6	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	72%	0.719	S	S	*	*			trans	-142.4	97.5	146.1	65.6	0	0	0	0	108.9	A356	S354-A356 PolarHBondContact O-N 3.09Å; S354-A356 VanDerWaalsContact O-N 3.13Å
355	S	37.3	Very low	39.4	Very low	122 Å²	122	121.4 Å²	121.4	85%	0.853	68%	0.681	S	S	*	*			trans	-41.8	105.1	165.8	38.1	0	0	0	0	112.6
356	A	31.9	Very low	42.3	Very low	89 Å²	89	112.8 Å²	112.8	74%	0.736	65%	0.647	S	S	*	*			trans	-106.8	78.5	154.7	0	0	0	0	0	107.6	S354 T358	S354-A356 PolarHBondContact O-N 3.09Å; S354-A356 VanDerWaalsContact O-N 3.13Å; A356-T358 PolarHBondContact O-N 2.74Å
357	S	31.3	Very low	45.3	Very low	108 Å²	108	105.5 Å²	105.5	76%	0.755	61%	0.608	S	S	*	*			trans	-68	93	156.9	62	0	0	0	0	106.4	A359	S357-A359 PolarHBondContact O-N 2.71Å
358	T	33.3	Very low	48	Very low	130 Å²	130	99.8 Å²	99.8	80%	0.798	58%	0.579	S	S	*	*			trans	-60.6	92.3	159.5	16	0	0	0	0	106.6	A356 I360	A356-T358 PolarHBondContact O-N 2.74Å; T358-I360 VanDerWaalsContact C-N 3.32Å; T358-I360 PolarHBondContact O-N 2.89Å
359	A	37.6	Very low	50.7	Low	86 Å²	86	96.3 Å²	96.3	71%	0.711	56%	0.557	S	S	*	*			trans	-59.2	101.3	167.4	0	0	0	0	0	106.4	S357 K361	S357-A359 PolarHBondContact O-N 2.71Å; A359-K361 PolarHBondContact O-N 2.98Å
360	I	43.6	Very low	53.2	Low	118 Å²	118	95.9 Å²	95.9	61%	0.605	54%	0.542	S	S	*	.			trans	-57.6	108.7	171.7	-62.1	170.9	0	0	0	105	T358 K362	T358-I360 VanDerWaalsContact C-N 3.32Å; T358-I360 PolarHBondContact O-N 2.89Å; I360-K362 PolarHBondContact O-N 2.86Å
361	K	50.3	Low	54.8	Low	196 Å²	196	95.2 Å²	95.2	85%	0.852	53%	0.527	S	S	*	.			trans	-58	106.7	178.6	-75.6	-177.6	177.5	178.7	0	107	A359 R363	A359-K361 PolarHBondContact O-N 2.98Å; K361-R363 PolarHBondContact O-N 2.9Å
362	K	53.7	Low	55.5	Low	97 Å²	97	97.3 Å²	97.3	42%	0.422	53%	0.529	S	S	.	.			trans	-56	126.6	173	-73.2	-169.1	178.4	-171.5	0	107.5	D182 E183 I360 K364	D182-K362 HydrophobicContact CB-CD 3.95Å; D182-K362 PolarHBondContact O-NZ 3.15Å; E183-K362 IonicContact OE2-NZ 3.06Å; E183-K362 PolarHBondContact OE2-NZ 3.21Å; I360-K362 PolarHBondContact O-N 2.86Å; K362-K364 PolarHBondContact O-N 2.85Å
363	R	62.8	Low	56.8	Low	42 Å²	42	92.3 Å²	92.3	16%	0.158	51%	0.509	C	S	.	.			trans	-70.5	110.5	-179.8	177	177.8	167.9	-177.6	-9	109.4	R195 E196 K361 S366	R195-R363 VanDerWaalsContact C-NH2 3.3Å; R195-R363 PolarHBondContact O-NH2 2.84Å; E196-R363 VanDerWaalsContact CA-CZ 3.45Å; E196-R363 VanDerWaalsContact CB-CZ 3.43Å; E196-R363 VanDerWaalsContact CD-CD 3.47Å; E196-R363 HydrophobicContact CG-CG 3.95Å; E196-R363 VanDerWaalsContact N-NH2 3.1Å; E196-R363 WeakPolarHBondContact OE1-CD 3.33Å; E196-R363 WeakPolarHBondContact OE1-CG 2.82Å; K361-R363 PolarHBondContact O-N 2.9Å; R363-S366 PolarHBondContact NH2-OG 3.3Å
364	K	76.4	Confident	58.1	Low	77 Å²	77	91.1 Å²	91.1	34%	0.335	49%	0.494	S	S	.	.			trans	-92.7	-22.4	-173.1	-65.4	-173	177.2	-172.7	0	114.4	Y180 D182 E253 K362	Y180-K364 PolarHBondContact N-O 2.9Å; D182-K364 WeakPolarHBondContact OD2-CE 3.39Å; E253-K364 IonicContact OE1-NZ 3.94Å; E253-K364 PolarHBondContact OE1-NZ 3.35Å; K362-K364 PolarHBondContact O-N 2.85Å
365	F	84.4	Confident	59.7	Low	21 Å²	21	89.9 Å²	89.9	9%	0.092	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	152.4	-171.4	-60.6	-90.1	0	0	0	114.5	L178 A179 A197 N200 I251	L178-F365 CarbonylContact O-C 3.49Å; L178-F365 WeakPolarHBondContact O-CA 3.41Å; A179-F365 HydrophobicContact CB-CD1 3.66Å; A179-F365 HydrophobicContact CB-CE1 3.42Å; A179-F365 VanDerWaalsContact CB-CE1 3.42Å; A179-F365 HydrophobicContact CB-CZ 4.31Å; A197-F365 HydrophobicContact CB-CB 3.79Å; A197-F365 PolarHBondContact N-O 2.75Å; N200-F365 HydrophobicContact CB-CD2 3.59Å; N200-F365 HydrophobicContact CB-CE2 3.47Å; N200-F365 VanDerWaalsContact CB-CE2 3.47Å; N200-F365 HydrophobicContact CB-CZ 4.27Å; I251-F365 HydrophobicContact CB-CZ 4.43Å; I251-F365 HydrophobicContact CD1-CE1 4.03Å; I251-F365 HydrophobicContact CD1-CZ 4.33Å; I251-F365 HydrophobicContact CG2-CE1 4.09Å; I251-F365 HydrophobicContact CG2-CZ 4.05Å
366	S	87	Confident	61	Low	0 Å²	0	88 Å²	88	0%	0	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	151.8	168.6	-62.4	0	0	0	0	112	K177 L178 Y180 R195 R363	K177-S366 CarbonylContact C-O 3.5Å; K177-S366 VanDerWaalsContact CA-O 3.28Å; K177-S366 WeakPolarHBondContact CA-O 3.35Å; L178-S366 PolarHBondContact N-O 3.12Å; L178-S366 PolarHBondContact O-N 3.4Å; Y180-S366 VanDerWaalsContact CE2-OG 3.26Å; Y180-S366 WeakPolarHBondContact CE2-OG 3.5Å; Y180-S366 WeakPolarHBondContact OH-CB 3.47Å; Y180-S366 PolarHBondContact OH-OG 3.26Å; R195-S366 CarbonylContact O-C 3.52Å; R195-S366 WeakPolarHBondContact O-CA 3.32Å; R195-S366 WeakPolarHBondContact O-CB 3.25Å; R363-S366 PolarHBondContact NH2-OG 3.3Å
367	E	87.3	Confident	62.8	Low	14 Å²	14	87.9 Å²	87.9	7%	0.065	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	164.6	178.3	71.4	-177.8	-155.8	0	0	110.9	F194 R195 A197 V198	F194-E367 CarbonylContact C-O 3.57Å; F194-E367 WeakPolarHBondContact CA-O 3.27Å; F194-E367 WeakPolarHBondContact CB-O 3.24Å; F194-E367 VanDerWaalsContact CD1-C 3.49Å; F194-E367 WeakPolarHBondContact CD1-O 3.43Å; R195-E367 HydrophobicContact CG-CG 3.83Å; R195-E367 IonicContact CZ-OE1 3.19Å; R195-E367 PolarHBondContact N-O 2.79Å; R195-E367 IonicContact NE-OE1 3.69Å; R195-E367 PolarHBondContact NE-OE1 3.49Å; R195-E367 IonicContact NH2-OE1 3.43Å; R195-E367 PolarHBondContact NH2-OE1 3.49Å; R195-E367 PolarHBondContact O-N 2.95Å; A197-E367 HydrophobicContact CB-CB 4.08Å; A197-E367 HydrophobicContact CB-CG 4.3Å; V198-E367 PolarHBondContact N-OE2 2.72Å
368	P	86.1	Confident	64.9	Low	0 Å²	0	86.6 Å²	86.6	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	145.3	-179.6	-29.7	42.7	0	0	0	113.3	W81 N175 M176 H370	W81-P368 HydrophobicContact CD2-CG 4.27Å; W81-P368 HydrophobicContact CH2-CG 4.18Å; W81-P368 HydrophobicContact CZ2-CB 3.67Å; W81-P368 HydrophobicContact CZ2-CG 3.34Å; W81-P368 VanDerWaalsContact NE1-CB 3.29Å; N175-P368 WeakPolarHBondContact OD1-CD 3.15Å; N175-P368 WeakPolarHBondContact OD1-CG 3.45Å; M176-P368 VanDerWaalsContact O-CD 3.24Å; M176-P368 WeakPolarHBondContact O-CD 3.08Å; P368-H370 VanDerWaalsContact C-N 3.31Å; P368-H370 PolarHBondContact O-N 3.46Å
369	K	84	Confident	67.2	Low	92 Å²	92	83.5 Å²	83.5	40%	0.4	39%	0.389	S	S	.	.	S	Bend	trans	-67	-32.5	174	-71.2	-174	-177.9	-174.4	0	113.2	G193 F194 R195	G193-K369 PolarHBondContact O-N 3.01Å; F194-K369 VanDerWaalsContact C-CG 3.48Å; F194-K369 WeakPolarHBondContact O-CE 3.27Å; F194-K369 WeakPolarHBondContact O-CG 3.44Å; R195-K369 HydrophobicContact CB-CG 4.22Å; R195-K369 PolarHBondContact NH1-O 3.48Å
370	H	75.6	Confident	69.5	Low	101 Å²	101	83.3 Å²	83.3	47%	0.468	36%	0.364	S	S	.	.			trans	-126.6	141.2	-176.6	-56.9	-68.2	0	0	0	109.8	P368 Y372	P368-H370 VanDerWaalsContact C-N 3.31Å; P368-H370 PolarHBondContact O-N 3.46Å; H370-Y372 HydrophobicContact CB-CD2 4.34Å; H370-Y372 HydrophobicContact CB-CE2 4.05Å
371	H	62.8	Low	71.6	Confident	92 Å²	92	80.4 Å²	80.4	43%	0.426	34%	0.344	S	S	.	.			trans	-109.7	133.7	168.7	-57.1	-69.2	0	0	0	106.9	R195	R195-H371 PolarHBondContact NH2-NE2 3.34Å; R195-H371 VanDerWaalsContact NH2-NE2 3.1Å
372	Y	49.2	Very low	73.6	Confident	233 Å²	233	69.9 Å²	69.9	91%	0.914	30%	0.298	S	S	*	.			trans	-124.9	0	175.6	-84.2	-78.6	0	0	0	109.8	H370	H370-Y372 HydrophobicContact CB-CD2 4.34Å; H370-Y372 HydrophobicContact CB-CE2 4.05Å

Retrieved 372 of 372 residues in 122.9 ms (Link to these results)

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