A0A077Z5J1_TRITR Loading...

Translation initiation factor 4E

AlphaFold DB , UniProt , Accession A0A077Z5J1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 239 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	31.6	Very low	34.9	Very low	236 Å²	236	143.1 Å²	143.1	100%	1.163	73%	0.725	S	S	*	*				0	139.4	0	-81.2	-171.1	-86.9	0	0	107.8
2	V	31.7	Very low	36.9	Very low	133 Å²	133	137.7 Å²	137.7	81%	0.806	70%	0.704	S	S	*	*			trans	84.7	63	-179.6	-140.2	0	0	0	0	117.4
3	Y	26.9	Very low	38.7	Very low	240 Å²	240	128.2 Å²	128.2	94%	0.941	66%	0.657	S	S	*	*			trans	-142.7	66.3	162.1	-80.6	-80.3	0	0	0	110.7
4	E	29.3	Very low	40.1	Very low	180 Å²	180	120 Å²	120	84%	0.841	62%	0.616	S	S	*	*			trans	-152.8	31.8	177.6	-147.7	158.8	-172.2	0	0	116.1
5	V	31.7	Very low	41.7	Very low	120 Å²	120	117.7 Å²	117.7	73%	0.727	61%	0.609	S	S	*	*	S	Bend	trans	-121.2	-12.8	-177.4	-172.5	0	0	0	0	114.6
6	A	33.2	Very low	43.2	Very low	85 Å²	85	113 Å²	113	70%	0.702	59%	0.587	S	S	*	*	S	Bend	trans	-84.1	-28.7	-173.8	0	0	0	0	0	115.5	L8	A6-L8 PolarHBondContact O-N 2.86Å
7	R	30.9	Very low	44.8	Very low	237 Å²	237	106.4 Å²	106.4	89%	0.894	55%	0.553	S	S	*	*	H	α-helix	trans	-73.9	-21.7	-175	-81.3	-174.1	175.6	-177.6	-0.5	114.7
8	L	27.2	Very low	46.2	Very low	125 Å²	125	100.5 Å²	100.5	65%	0.654	52%	0.522	S	S	*	.	H	α-helix	trans	-73.2	-32.4	-178.1	-87.9	140	0	0	0	113.2	A6 S11 T12	A6-L8 PolarHBondContact O-N 2.86Å; L8-S11 PolarHBondContact O-N 3.04Å; L8-T12 PolarHBondContact O-N 3.23Å; L8-T12 PolarHBondContact O-OG1 3.18Å
9	K	42.5	Very low	47.5	Very low	87 Å²	87	99.4 Å²	99.4	38%	0.378	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-44.4	-175.8	-85.3	-168.8	160.7	-153	0	113.2	S11 T12 V13 E84 D87	K9-S11 VanDerWaalsContact C-N 3.31Å; K9-S11 PolarHBondContact O-N 3.03Å; K9-T12 PolarHBondContact O-N 2.92Å; K9-V13 VanDerWaalsContact O-CB 3.31Å; K9-V13 WeakPolarHBondContact O-CB 3.28Å; K9-V13 WeakPolarHBondContact O-CG2 3.48Å; K9-V13 PolarHBondContact O-N 3.26Å; K9-E84 PolarHBondContact NZ-O 2.78Å; K9-D87 IonicContact NZ-OD1 2.89Å; K9-D87 PolarHBondContact NZ-OD1 2.86Å; K9-D87 IonicContact NZ-OD2 3.83Å
10	V	45	Very low	48.5	Very low	56 Å²	56	99 Å²	99	34%	0.339	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-41.7	-177.5	-178.5	0	0	0	0	110.7	V14	V10-V14 HydrophobicContact CG1-CG2 4.12Å; V10-V14 WeakPolarHBondContact O-CB 3.27Å; V10-V14 WeakPolarHBondContact O-CG2 3.44Å; V10-V14 PolarHBondContact O-N 3.04Å
11	S	53.7	Low	49.5	Very low	75 Å²	75	100.5 Å²	100.5	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-46.6	178.1	179.9	0	0	0	0	112.5	L8 K9 V14 V15	L8-S11 PolarHBondContact O-N 3.04Å; K9-S11 VanDerWaalsContact C-N 3.31Å; K9-S11 PolarHBondContact O-N 3.03Å; S11-V14 PolarHBondContact O-N 2.99Å; S11-V15 VanDerWaalsContact O-CG2 3.27Å; S11-V15 WeakPolarHBondContact O-CG2 3.35Å; S11-V15 PolarHBondContact O-N 3.13Å
12	T	58.6	Low	51.2	Low	78 Å²	78	90 Å²	90	48%	0.479	47%	0.469	S	S	.	.	H	α-helix	trans	-68.2	-41	-179.6	-51.6	0	0	0	0	112.2	L8 K9 V15 T16	L8-T12 PolarHBondContact O-N 3.23Å; L8-T12 PolarHBondContact O-OG1 3.18Å; K9-T12 PolarHBondContact O-N 2.92Å; T12-V15 PolarHBondContact O-N 2.89Å; T12-T16 VanDerWaalsContact O-CB 3.27Å; T12-T16 WeakPolarHBondContact O-CB 3.42Å; T12-T16 PolarHBondContact O-N 3.37Å; T12-T16 PolarHBondContact O-OG1 2.74Å
13	V	60.2	Low	52.8	Low	15 Å²	15	85.1 Å²	85.1	9%	0.091	44%	0.439	C	S	.	.	H	α-helix	trans	-62.5	-47.4	176.5	171.3	0	0	0	0	109.7	K9 V15 T16 L17 F72 D87 V89	K9-V13 VanDerWaalsContact O-CB 3.31Å; K9-V13 WeakPolarHBondContact O-CB 3.28Å; K9-V13 WeakPolarHBondContact O-CG2 3.48Å; K9-V13 PolarHBondContact O-N 3.26Å; V13-V15 PolarHBondContact O-N 3.08Å; V13-T16 PolarHBondContact O-N 3.31Å; V13-L17 HydrophobicContact CG1-CD1 3.4Å; V13-L17 HydrophobicContact CG1-CG 4.15Å; V13-L17 WeakPolarHBondContact O-CB 3.49Å; V13-L17 WeakPolarHBondContact O-CG 2.98Å; V13-L17 PolarHBondContact O-N 3.37Å; V13-F72 HydrophobicContact CG1-CD1 4.22Å; V13-F72 HydrophobicContact CG2-CD1 4.49Å; V13-D87 HydrophobicContact CG2-CB 4.37Å; V13-V89 HydrophobicContact CG1-CG1 4.47Å; V13-V89 HydrophobicContact CG1-CG2 3.94Å
14	V	59.4	Low	54.5	Low	13 Å²	13	77 Å²	77	8%	0.079	42%	0.417	C	S	.	.	H	α-helix	trans	-60.4	-45.7	177.7	167.5	0	0	0	0	111.8	V10 S11 T16 L17 L18 V23	V10-V14 HydrophobicContact CG1-CG2 4.12Å; V10-V14 WeakPolarHBondContact O-CB 3.27Å; V10-V14 WeakPolarHBondContact O-CG2 3.44Å; V10-V14 PolarHBondContact O-N 3.04Å; S11-V14 PolarHBondContact O-N 2.99Å; V14-T16 VanDerWaalsContact C-N 3.34Å; V14-T16 PolarHBondContact O-N 2.83Å; V14-L17 PolarHBondContact O-N 3.29Å; V14-L18 HydrophobicContact CG1-CB 4.49Å; V14-L18 HydrophobicContact CG1-CD1 3.85Å; V14-L18 HydrophobicContact CG1-CG 4.24Å; V14-L18 WeakPolarHBondContact O-CA 3.46Å; V14-L18 VanDerWaalsContact O-CB 3.22Å; V14-L18 WeakPolarHBondContact O-CB 3.33Å; V14-L18 WeakPolarHBondContact O-CG 3.5Å; V14-L18 PolarHBondContact O-N 3.07Å; V14-V23 HydrophobicContact CG1-CB 4.38Å; V14-V23 HydrophobicContact CG1-CG1 3.59Å; V14-V23 HydrophobicContact CG1-CG2 3.87Å
15	V	62.8	Low	56.2	Low	85 Å²	85	73.3 Å²	73.3	52%	0.515	40%	0.4	S	S	.	.	H	α-helix	trans	-68.1	-34.4	178.7	173.9	0	0	0	0	112.1	S11 T12 V13 K106	S11-V15 VanDerWaalsContact O-CG2 3.27Å; S11-V15 WeakPolarHBondContact O-CG2 3.35Å; S11-V15 PolarHBondContact O-N 3.13Å; T12-V15 PolarHBondContact O-N 2.89Å; V13-V15 PolarHBondContact O-N 3.08Å; V15-K106 PolarHBondContact O-NZ 3.38Å
16	T	66.7	Low	57.7	Low	43 Å²	43	67.6 Å²	67.6	26%	0.264	37%	0.366	S	S	.	.	H	α-helix	trans	-72.8	-37.7	179.5	-57.3	0	0	0	0	111.1	T12 V13 V14 F72 K106	T12-T16 VanDerWaalsContact O-CB 3.27Å; T12-T16 WeakPolarHBondContact O-CB 3.42Å; T12-T16 PolarHBondContact O-N 3.37Å; T12-T16 PolarHBondContact O-OG1 2.74Å; V13-T16 PolarHBondContact O-N 3.31Å; V14-T16 VanDerWaalsContact C-N 3.34Å; V14-T16 PolarHBondContact O-N 2.83Å; T16-F72 HydrophobicContact CG2-CZ 3.88Å; T16-K106 WeakPolarHBondContact O-CD 3.42Å; T16-K106 WeakPolarHBondContact O-CE 3.42Å; T16-K106 PolarHBondContact O-NZ 3.11Å
17	L	70.5	Confident	59.1	Low	1 Å²	1	66.3 Å²	66.3	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-94.5	-37.9	-171.6	-71.5	-176.5	0	0	0	115.2	V13 V14 F72 V89 K106 F117	V13-L17 HydrophobicContact CG1-CD1 3.4Å; V13-L17 HydrophobicContact CG1-CG 4.15Å; V13-L17 WeakPolarHBondContact O-CB 3.49Å; V13-L17 WeakPolarHBondContact O-CG 2.98Å; V13-L17 PolarHBondContact O-N 3.37Å; V14-L17 PolarHBondContact O-N 3.29Å; L17-F72 HydrophobicContact CD1-CB 3.59Å; L17-F72 HydrophobicContact CD1-CD1 4.02Å; L17-F72 HydrophobicContact CD1-CD2 4.11Å; L17-F72 HydrophobicContact CD1-CG 3.67Å; L17-F72 HydrophobicContact CD2-CB 4.21Å; L17-F72 HydrophobicContact CD2-CD1 4.21Å; L17-F72 HydrophobicContact CD2-CD2 3.14Å; L17-F72 HydrophobicContact CD2-CE1 4.31Å; L17-F72 HydrophobicContact CD2-CE2 3.17Å; L17-F72 HydrophobicContact CD2-CG 3.62Å; L17-F72 HydrophobicContact CD2-CZ 3.81Å; L17-F72 HydrophobicContact CG-CB 4.39Å; L17-F72 HydrophobicContact CG-CD1 4.2Å; L17-F72 HydrophobicContact CG-CD2 3.99Å; L17-F72 HydrophobicContact CG-CE1 4.38Å; L17-F72 HydrophobicContact CG-CE2 4.07Å; L17-F72 HydrophobicContact CG-CG 3.96Å; L17-F72 HydrophobicContact CG-CZ 4.29Å; L17-V89 HydrophobicContact CD1-CB 4.27Å; L17-V89 HydrophobicContact CD1-CG1 3.78Å; L17-V89 HydrophobicContact CD1-CG2 3.47Å; L17-V89 VanDerWaalsContact CD1-CG2 3.47Å; L17-K106 WeakPolarHBondContact O-CB 3.46Å; L17-K106 WeakPolarHBondContact O-CG 3.1Å; L17-K106 PolarHBondContact O-N 2.71Å; L17-F117 HydrophobicContact CD1-CE1 4.29Å; L17-F117 HydrophobicContact CD2-CD1 4.37Å; L17-F117 HydrophobicContact CD2-CE1 3.26Å; L17-F117 HydrophobicContact CD2-CZ 3.5Å; L17-F117 HydrophobicContact CG-CE1 4.32Å
18	L	70.1	Confident	60.5	Low	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-96.8	145.8	-173	-50.8	-170.2	0	0	0	109.7	V14 V23 F26 S104 K106	V14-L18 HydrophobicContact CG1-CB 4.49Å; V14-L18 HydrophobicContact CG1-CD1 3.85Å; V14-L18 HydrophobicContact CG1-CG 4.24Å; V14-L18 WeakPolarHBondContact O-CA 3.46Å; V14-L18 VanDerWaalsContact O-CB 3.22Å; V14-L18 WeakPolarHBondContact O-CB 3.33Å; V14-L18 WeakPolarHBondContact O-CG 3.5Å; V14-L18 PolarHBondContact O-N 3.07Å; L18-V23 HydrophobicContact CB-CG2 3.89Å; L18-F26 HydrophobicContact CD1-CB 4.07Å; L18-F26 HydrophobicContact CD1-CD1 3.33Å; L18-F26 HydrophobicContact CD1-CD2 4.1Å; L18-F26 HydrophobicContact CD1-CE1 3.62Å; L18-F26 HydrophobicContact CD1-CE2 4.38Å; L18-F26 HydrophobicContact CD1-CG 3.57Å; L18-F26 HydrophobicContact CD1-CZ 4.14Å; L18-S104 CarbonylContact C-O 3.49Å; L18-S104 WeakPolarHBondContact CA-O 3.39Å; L18-K106 WeakPolarHBondContact O-CE 3.32Å
19	R	70.1	Confident	61.9	Low	79 Å²	79	57 Å²	57	30%	0.298	31%	0.312	S	S	.	.			trans	-63.1	124.9	168.2	-64.4	-177.6	-177.5	173.3	-1.1	107.8	E21 T22 V23 S104 K106 E107	R19-E21 HydrophobicContact CB-CG 4.25Å; R19-E21 WeakPolarHBondContact CB-OE1 3.29Å; R19-E21 PolarHBondContact O-N 3.48Å; R19-T22 PolarHBondContact O-N 3.14Å; R19-T22 PolarHBondContact O-OG1 2.67Å; R19-V23 PolarHBondContact O-N 3.3Å; R19-S104 PolarHBondContact N-O 3.13Å; R19-K106 HydrophobicContact CG-CG 4.17Å; R19-E107 IonicContact CZ-OE1 2.94Å; R19-E107 IonicContact CZ-OE2 3.96Å; R19-E107 IonicContact NE-OE2 2.95Å; R19-E107 IonicContact NH2-OE1 3.03Å; R19-E107 PolarHBondContact NH2-OE1 3.47Å; R19-E107 IonicContact NH2-OE2 3.26Å; R19-E107 PolarHBondContact NH2-OE2 3.19Å
20	P	67.7	Low	62.5	Low	91 Å²	91	53.1 Å²	53.1	59%	0.591	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-51	-36.8	-174	-29.1	35.3	0	0	0	113.8	T22 V23	P20-T22 VanDerWaalsContact C-N 3.29Å; P20-T22 PolarHBondContact O-N 2.89Å; P20-V23 PolarHBondContact O-N 3.27Å
21	E	70.7	Confident	62.9	Low	132 Å²	132	58.9 Å²	58.9	62%	0.617	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-65.4	-23.3	-179.7	59.5	-88.8	-159.9	0	0	114.8	R19	R19-E21 HydrophobicContact CB-CG 4.25Å; R19-E21 WeakPolarHBondContact CB-OE1 3.29Å; R19-E21 PolarHBondContact O-N 3.48Å
22	T	66.6	Low	62.6	Low	15 Å²	15	60.8 Å²	60.8	9%	0.092	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-103.4	-4.1	-178.7	50.2	0	0	0	0	113.1	R19 P20 S24 E25 F26 S104	R19-T22 PolarHBondContact O-N 3.14Å; R19-T22 PolarHBondContact O-OG1 2.67Å; P20-T22 VanDerWaalsContact C-N 3.29Å; P20-T22 PolarHBondContact O-N 2.89Å; T22-S24 VanDerWaalsContact C-N 3.29Å; T22-S24 PolarHBondContact O-N 2.88Å; T22-E25 PolarHBondContact O-N 2.86Å; T22-F26 VanDerWaalsContact O-CB 3.28Å; T22-F26 WeakPolarHBondContact O-CB 3.25Å; T22-F26 PolarHBondContact O-N 2.84Å; T22-S104 VanDerWaalsContact OG1-CA 3.3Å; T22-S104 WeakPolarHBondContact OG1-CA 3.44Å
23	V	64.6	Low	62.3	Low	30 Å²	30	60.1 Å²	60.1	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-38.1	-177.1	173.7	0	0	0	0	112	V14 L18 R19 P20 N27	V14-V23 HydrophobicContact CG1-CB 4.38Å; V14-V23 HydrophobicContact CG1-CG1 3.59Å; V14-V23 HydrophobicContact CG1-CG2 3.87Å; L18-V23 HydrophobicContact CB-CG2 3.89Å; R19-V23 PolarHBondContact O-N 3.3Å; P20-V23 PolarHBondContact O-N 3.27Å; V23-N27 WeakPolarHBondContact CG1-ND2 3.08Å; V23-N27 VanDerWaalsContact O-CB 3.27Å; V23-N27 WeakPolarHBondContact O-CB 3.18Å; V23-N27 PolarHBondContact O-N 2.73Å; V23-N27 PolarHBondContact O-ND2 3.15Å; V23-N27 VanDerWaalsContact O-ND2 3.14Å
24	S	62.7	Low	61.9	Low	70 Å²	70	59.9 Å²	59.9	49%	0.49	31%	0.311	S	S	.	.	H	α-helix	trans	-65.6	-49.2	177.5	52.6	0	0	0	0	111.7	T22 F26 N27 E28	T22-S24 VanDerWaalsContact C-N 3.29Å; T22-S24 PolarHBondContact O-N 2.88Å; S24-F26 VanDerWaalsContact C-N 3.31Å; S24-F26 PolarHBondContact O-N 3.47Å; S24-N27 PolarHBondContact O-N 3.26Å; S24-E28 WeakPolarHBondContact O-CG 3.2Å; S24-E28 PolarHBondContact O-N 2.87Å
25	E	65.3	Low	61.6	Low	103 Å²	103	62 Å²	62	48%	0.481	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-40	178.9	-64.4	-178.9	173.9	0	0	111.5	T22 E28 T29	T22-E25 PolarHBondContact O-N 2.86Å; E25-E28 PolarHBondContact O-N 3.26Å; E25-T29 WeakPolarHBondContact O-CB 3.4Å; E25-T29 PolarHBondContact O-N 3.41Å; E25-T29 PolarHBondContact O-OG1 3.2Å
26	F	63.4	Low	61.1	Low	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-47.1	174.2	-174.8	-97.5	0	0	0	111	L18 T22 S24 A30 L34 L36 A90 V100 L101 S104	L18-F26 HydrophobicContact CD1-CB 4.07Å; L18-F26 HydrophobicContact CD1-CD1 3.33Å; L18-F26 HydrophobicContact CD1-CD2 4.1Å; L18-F26 HydrophobicContact CD1-CE1 3.62Å; L18-F26 HydrophobicContact CD1-CE2 4.38Å; L18-F26 HydrophobicContact CD1-CG 3.57Å; L18-F26 HydrophobicContact CD1-CZ 4.14Å; T22-F26 VanDerWaalsContact O-CB 3.28Å; T22-F26 WeakPolarHBondContact O-CB 3.25Å; T22-F26 PolarHBondContact O-N 2.84Å; S24-F26 VanDerWaalsContact C-N 3.31Å; S24-F26 PolarHBondContact O-N 3.47Å; F26-A30 WeakPolarHBondContact O-CA 3.13Å; F26-A30 WeakPolarHBondContact O-CB 3.3Å; F26-A30 PolarHBondContact O-N 3.42Å; F26-L34 HydrophobicContact CD2-CD2 4.32Å; F26-L34 HydrophobicContact CE1-CD2 3.89Å; F26-L34 HydrophobicContact CE2-CD2 3.37Å; F26-L34 HydrophobicContact CZ-CD2 3.13Å; F26-L36 HydrophobicContact CE1-CD2 3.78Å; F26-L36 HydrophobicContact CZ-CD2 4.17Å; F26-A90 HydrophobicContact CZ-CB 4.36Å; F26-V100 HydrophobicContact CB-CG1 4.35Å; F26-V100 HydrophobicContact CD2-CG1 3.9Å; F26-L101 HydrophobicContact CE2-CB 4.45Å; F26-L101 HydrophobicContact CE2-CD1 3.79Å; F26-L101 HydrophobicContact CZ-CD1 4.22Å; F26-S104 WeakPolarHBondContact CB-OG 3.11Å; F26-S104 WeakPolarHBondContact CD2-OG 3.43Å
27	N	62.4	Low	60.4	Low	58 Å²	58	61.9 Å²	61.9	31%	0.31	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-37.2	179	-75.2	-26.1	0	0	0	112.6	V23 S24 A30 K31	V23-N27 WeakPolarHBondContact CG1-ND2 3.08Å; V23-N27 VanDerWaalsContact O-CB 3.27Å; V23-N27 WeakPolarHBondContact O-CB 3.18Å; V23-N27 PolarHBondContact O-N 2.73Å; V23-N27 PolarHBondContact O-ND2 3.15Å; V23-N27 VanDerWaalsContact O-ND2 3.14Å; S24-N27 PolarHBondContact O-N 3.26Å; N27-A30 PolarHBondContact O-N 3.45Å; N27-K31 VanDerWaalsContact O-CG 3.28Å; N27-K31 WeakPolarHBondContact O-CG 3.45Å; N27-K31 PolarHBondContact O-N 3.19Å
28	E	60.2	Low	58.9	Low	130 Å²	130	67.7 Å²	67.7	61%	0.607	35%	0.349	S	S	*	.	H	α-helix	trans	-67	-51.4	175.6	-76.1	-178.2	174.4	0	0	111.4	S24 E25 A30 K31 D32	S24-E28 WeakPolarHBondContact O-CG 3.2Å; S24-E28 PolarHBondContact O-N 2.87Å; E25-E28 PolarHBondContact O-N 3.26Å; E28-A30 PolarHBondContact O-N 3.13Å; E28-K31 WeakPolarHBondContact O-CB 3.48Å; E28-K31 PolarHBondContact O-N 3.45Å; E28-D32 PolarHBondContact O-N 2.92Å
29	T	56.5	Low	57.5	Low	35 Å²	35	70.7 Å²	70.7	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-64.2	-31.5	175.7	-50.2	0	0	0	0	110.8	E25 D32 H33 L34 V100	E25-T29 WeakPolarHBondContact O-CB 3.4Å; E25-T29 PolarHBondContact O-N 3.41Å; E25-T29 PolarHBondContact O-OG1 3.2Å; T29-D32 PolarHBondContact O-N 3.4Å; T29-H33 HydrophobicContact CG2-CB 4.17Å; T29-H33 WeakPolarHBondContact O-CA 3.27Å; T29-H33 WeakPolarHBondContact O-CB 3.25Å; T29-H33 PolarHBondContact O-N 3.38Å; T29-L34 PolarHBondContact O-N 3.35Å; T29-V100 HydrophobicContact CG2-CB 4.17Å; T29-V100 HydrophobicContact CG2-CG1 4.22Å; T29-V100 HydrophobicContact CG2-CG2 3.8Å
30	A	55.2	Low	55.9	Low	7 Å²	7	70.9 Å²	70.9	6%	0.058	39%	0.392	C	S	.	.	H	α-helix	trans	-65.5	-44.3	176.8	0	0	0	0	0	112.2	F26 N27 E28 D32 H33 L34 L36	F26-A30 WeakPolarHBondContact O-CA 3.13Å; F26-A30 WeakPolarHBondContact O-CB 3.3Å; F26-A30 PolarHBondContact O-N 3.42Å; N27-A30 PolarHBondContact O-N 3.45Å; E28-A30 PolarHBondContact O-N 3.13Å; A30-D32 PolarHBondContact O-N 3.42Å; A30-H33 PolarHBondContact O-N 3.37Å; A30-L34 CarbonylContact C-O 3.48Å; A30-L34 HydrophobicContact CB-CB 3.64Å; A30-L34 HydrophobicContact CB-CD2 4.23Å; A30-L34 CarbonylContact O-C 3.43Å; A30-L34 PolarHBondContact O-N 3.1Å; A30-L36 HydrophobicContact CB-CD1 3.81Å; A30-L36 HydrophobicContact CB-CG 3.94Å
31	K	53.4	Low	54.6	Low	176 Å²	176	76 Å²	76	77%	0.765	41%	0.405	S	S	*	.	H	α-helix	trans	-54.7	-37.8	174.9	-74.4	168.4	-177.5	178.5	0	112.4	N27 E28	N27-K31 VanDerWaalsContact O-CG 3.28Å; N27-K31 WeakPolarHBondContact O-CG 3.45Å; N27-K31 PolarHBondContact O-N 3.19Å; E28-K31 WeakPolarHBondContact O-CB 3.48Å; E28-K31 PolarHBondContact O-N 3.45Å
32	D	48.2	Very low	52.9	Low	115 Å²	115	77.3 Å²	77.3	62%	0.615	41%	0.411	S	S	*	.	H	α-helix	trans	-93.7	-25.6	-175.5	-69.9	-12.7	0	0	0	113.9	E28 T29 A30	E28-D32 PolarHBondContact O-N 2.92Å; T29-D32 PolarHBondContact O-N 3.4Å; A30-D32 PolarHBondContact O-N 3.42Å
33	H	50.8	Low	51.3	Low	64 Å²	64	81 Å²	81	30%	0.296	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.1	-26.2	-166.1	-58.4	-64.5	0	0	0	115.4	T29 A30 Q97	T29-H33 HydrophobicContact CG2-CB 4.17Å; T29-H33 WeakPolarHBondContact O-CA 3.27Å; T29-H33 WeakPolarHBondContact O-CB 3.25Å; T29-H33 PolarHBondContact O-N 3.38Å; A30-H33 PolarHBondContact O-N 3.37Å; H33-Q97 HydrophobicContact CB-CG 3.7Å; H33-Q97 WeakPolarHBondContact O-CG 3.44Å; H33-Q97 PolarHBondContact O-NE2 3.48Å
34	L	52.2	Low	49.8	Very low	10 Å²	10	85.8 Å²	85.8	5%	0.052	47%	0.472	C	S	.	.			trans	-104.4	118.7	-178.4	-156.6	78.3	0	0	0	110.6	F26 T29 A30 L36 A90 A91 V92 Q97	F26-L34 HydrophobicContact CD2-CD2 4.32Å; F26-L34 HydrophobicContact CE1-CD2 3.89Å; F26-L34 HydrophobicContact CE2-CD2 3.37Å; F26-L34 HydrophobicContact CZ-CD2 3.13Å; T29-L34 PolarHBondContact O-N 3.35Å; A30-L34 CarbonylContact C-O 3.48Å; A30-L34 HydrophobicContact CB-CB 3.64Å; A30-L34 HydrophobicContact CB-CD2 4.23Å; A30-L34 CarbonylContact O-C 3.43Å; A30-L34 PolarHBondContact O-N 3.1Å; L34-L36 HydrophobicContact CD2-CD2 4.1Å; L34-L36 PolarHBondContact O-N 3.34Å; L34-A90 HydrophobicContact CD1-CB 4.34Å; L34-A90 HydrophobicContact CD2-CB 3.73Å; L34-A90 HydrophobicContact CG-CB 4.21Å; L34-A91 WeakPolarHBondContact CD1-O 3.38Å; L34-V92 HydrophobicContact CD1-CG1 3.49Å; L34-V92 VanDerWaalsContact CD1-CG1 3.49Å; L34-Q97 HydrophobicContact CD1-CB 4.1Å
35	T	53.8	Low	48.6	Very low	58 Å²	58	87.9 Å²	87.9	36%	0.356	49%	0.487	S	S	.	.			trans	-75	94.6	172.2	-47.3	0	0	0	0	108.8	M37 Q57	T35-M37 HydrophobicContact CG2-CE 4.44Å; T35-M37 HydrophobicContact CG2-CG 4.07Å; T35-M37 PolarHBondContact O-N 3.02Å; T35-Q57 PolarHBondContact OG1-NE2 2.9Å
36	L	52.5	Low	47.2	Very low	61 Å²	61	86.9 Å²	86.9	32%	0.319	50%	0.496	S	S	.	.			trans	-67	109.2	162	-65.5	175.1	0	0	0	106.4	F26 A30 L34 D38 V89	F26-L36 HydrophobicContact CE1-CD2 3.78Å; F26-L36 HydrophobicContact CZ-CD2 4.17Å; A30-L36 HydrophobicContact CB-CD1 3.81Å; A30-L36 HydrophobicContact CB-CG 3.94Å; L34-L36 HydrophobicContact CD2-CD2 4.1Å; L34-L36 PolarHBondContact O-N 3.34Å; L36-D38 PolarHBondContact O-N 2.98Å; L36-V89 WeakPolarHBondContact CD2-O 3.35Å
37	M	50.8	Low	45.7	Very low	64 Å²	64	93.1 Å²	93.1	32%	0.315	53%	0.534	S	S	.	.			trans	-85.3	112.7	174.1	-72.4	-169.3	153.6	0	0	107.5	T35 A39 K88	T35-M37 HydrophobicContact CG2-CE 4.44Å; T35-M37 HydrophobicContact CG2-CG 4.07Å; T35-M37 PolarHBondContact O-N 3.02Å; M37-A39 PolarHBondContact O-N 2.88Å; M37-K88 HydrophobicContact CB-CD 4.21Å; M37-K88 HydrophobicContact CG-CD 4.46Å; M37-K88 HydrophobicContact SD-CD 3.86Å; M37-K88 VanDerWaalsContact SD-CE 3.6Å; M37-K88 PolarHBondContact SD-NZ 3.43Å
38	D	40.2	Very low	44.4	Very low	124 Å²	124	96.7 Å²	96.7	66%	0.663	56%	0.559	S	S	*	*			trans	-52.3	134.4	163.1	-75.8	-32.8	0	0	0	107.9	L36 A40	L36-D38 PolarHBondContact O-N 2.98Å; D38-A40 PolarHBondContact O-N 3.3Å
39	A	40.7	Very low	43.3	Very low	63 Å²	63	95.8 Å²	95.8	52%	0.521	57%	0.566	S	S	.	*	S	Bend	trans	-69.2	39.4	-176.3	0	0	0	0	0	113.6	M37 K41	M37-A39 PolarHBondContact O-N 2.88Å; A39-K41 PolarHBondContact O-N 2.91Å
40	A	36.9	Very low	42.4	Very low	82 Å²	82	100.3 Å²	100.3	68%	0.678	59%	0.594	S	S	*	*			trans	-77.9	109.9	167.3	0	0	0	0	0	108.2	D38 E42	D38-A40 PolarHBondContact O-N 3.3Å; A40-E42 PolarHBondContact O-N 3.37Å; A40-E42 VanDerWaalsContact O-N 3.11Å
41	K	38.8	Very low	41.5	Very low	200 Å²	200	109.6 Å²	109.6	87%	0.87	64%	0.636	S	S	*	*			trans	-40.6	116.7	172.1	-68.4	173.1	175.4	177.8	0	110.2	A39 A43	A39-K41 PolarHBondContact O-N 2.91Å; K41-A43 PolarHBondContact O-N 2.84Å
42	E	35.7	Very low	40.8	Very low	159 Å²	159	109.8 Å²	109.8	74%	0.743	64%	0.64	S	S	*	*			trans	-64	88.9	166.1	-83.1	176.2	164.9	0	0	108.4	A40	A40-E42 PolarHBondContact O-N 3.37Å; A40-E42 VanDerWaalsContact O-N 3.11Å
43	A	32.2	Very low	40.2	Very low	92 Å²	92	114.2 Å²	114.2	76%	0.76	65%	0.654	S	S	*	*			trans	-107.9	106.2	154.4	0	0	0	0	0	105.7	K41	K41-A43 PolarHBondContact O-N 2.84Å
44	T	34.7	Very low	39.7	Very low	130 Å²	130	115 Å²	115	80%	0.798	67%	0.672	S	S	*	*			trans	-132.1	95	173.5	-30.7	0	0	0	0	109.4
45	S	35.9	Very low	39.2	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	71%	0.706	S	S	*	*			trans	-94.2	130	153	176.3	0	0	0	0	107.9
46	A	36.9	Very low	38.6	Very low	82 Å²	82	129 Å²	129	68%	0.678	73%	0.733	S	S	*	*			trans	63.1	100.8	155.9	0	0	0	0	0	120.8
47	T	32.8	Very low	38.6	Very low	130 Å²	130	132.4 Å²	132.4	80%	0.798	75%	0.747	S	S	*	*				40	109.6	124.7	-43.6	0	0	0	0	119.7
48	T	34.8	Very low	38.9	Very low	134 Å²	134	139.2 Å²	139.2	82%	0.822	77%	0.769	S	S	*	*				-153.1	125.6	129.1	-56	0	0	0	0	108.9
49	S	35.7	Very low	40	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	77%	0.773	S	S	*	*			trans	-68.5	123.9	-178	46.3	0	0	0	0	113.1
50	T	37.9	Very low	41.5	Very low	131 Å²	131	136.8 Å²	136.8	80%	0.804	76%	0.755	S	S	*	*			trans	-139.3	115.8	154.5	-22.5	0	0	0	0	107.2	E52	T50-E52 VanDerWaalsContact C-N 3.3Å; T50-E52 PolarHBondContact O-N 2.71Å
51	E	37	Very low	43.8	Very low	201 Å²	201	142.4 Å²	142.4	94%	0.939	76%	0.759	S	S	*	*			trans	-70.4	84.1	177.3	-70.4	-179.2	156.6	0	0	110.1
52	E	39	Very low	46.3	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	74%	0.743	S	S	*	*			trans	-92.4	116.4	166.5	-148.3	168.3	-162.1	0	0	107.9	T50 A54	T50-E52 VanDerWaalsContact C-N 3.3Å; T50-E52 PolarHBondContact O-N 2.71Å; E52-A54 PolarHBondContact O-N 2.79Å
53	K	35.7	Very low	49.1	Very low	208 Å²	208	136.2 Å²	136.2	90%	0.904	74%	0.736	S	S	*	*			trans	-50.9	103.4	178.6	-87.2	177.8	175.2	171.1	0	109.8
54	A	39.7	Very low	52.1	Low	81 Å²	81	132.9 Å²	132.9	67%	0.669	71%	0.705	S	S	*	*			trans	-55.5	135.4	173.4	0	0	0	0	0	109.9	E52 R56	E52-A54 PolarHBondContact O-N 2.79Å; A54-R56 PolarHBondContact O-N 2.83Å
55	P	41.2	Very low	55	Low	118 Å²	118	132.6 Å²	132.6	77%	0.766	69%	0.694	S	S	*	*			trans	-58.4	128.9	175.7	24.1	-31.5	0	0	0	108.6	Q57	P55-Q57 VanDerWaalsContact C-N 3.3Å; P55-Q57 PolarHBondContact O-N 2.84Å
56	R	41.6	Very low	57.9	Low	244 Å²	244	130 Å²	130	92%	0.921	67%	0.667	S	S	*	*			trans	-62	91.5	175.9	-71.1	179.7	177.9	-178	-1.5	108.6	A54 R58	A54-R56 PolarHBondContact O-N 2.83Å; R56-R58 PolarHBondContact O-N 2.71Å
57	Q	53.3	Low	60.8	Low	132 Å²	132	128.7 Å²	128.7	62%	0.617	65%	0.651	S	S	*	*			trans	-58.1	112.9	169.2	-82.3	-178.9	-25.2	0	0	107.6	T35 P55 V59	T35-Q57 PolarHBondContact OG1-NE2 2.9Å; P55-Q57 VanDerWaalsContact C-N 3.3Å; P55-Q57 PolarHBondContact O-N 2.84Å; Q57-V59 PolarHBondContact O-N 3.29Å
58	R	56.2	Low	63.8	Low	206 Å²	206	122.8 Å²	122.8	78%	0.777	61%	0.614	S	S	*	*			trans	-63.6	110.1	172.2	-72.3	-175.5	172.6	-166.3	-1	106.9	R56 G60	R56-R58 PolarHBondContact O-N 2.71Å; R58-G60 PolarHBondContact O-N 3.49Å; R58-G60 VanDerWaalsContact O-N 3.13Å
59	V	62.4	Low	66.7	Low	123 Å²	123	116.4 Å²	116.4	75%	0.745	58%	0.575	S	S	*	*			trans	-57.7	117.8	171.4	-176	0	0	0	0	106.5	Q57 P63	Q57-V59 PolarHBondContact O-N 3.29Å; V59-P63 HydrophobicContact CG1-CB 4.38Å
60	G	72.2	Confident	69.5	Low	14 Å²	14	111.2 Å²	111.2	14%	0.144	54%	0.538	C	S	.	.			trans	-55	159.5	178	0	0	0	0	0	111.4	R58 Y62	R58-G60 PolarHBondContact O-N 3.49Å; R58-G60 VanDerWaalsContact O-N 3.13Å; G60-Y62 PolarHBondContact O-N 3.31Å; G60-Y62 VanDerWaalsContact O-N 3.08Å
61	R	85.4	Confident	72.2	Confident	200 Å²	200	105.6 Å²	105.6	76%	0.755	50%	0.502	S	S	*	.	S	Bend	trans	-64	-22.9	-171.3	-61.4	176.6	-78.3	-166.2	-7.4	112.2	E96	R61-E96 WeakPolarHBondContact CA-OE1 3.32Å; R61-E96 WeakPolarHBondContact CB-OE1 3.33Å; R61-E96 PolarHBondContact N-OE1 3.31Å; R61-E96 IonicContact NE-OE1 3.19Å; R61-E96 PolarHBondContact NE-OE1 2.91Å
62	Y	91.6	Very high	74.8	Confident	139 Å²	139	96 Å²	96	55%	0.545	46%	0.458	S	S	.	.	S	Bend	trans	-127.6	84.3	-177.7	-53.5	-75.2	0	0	0	110.4	G60 C94 L95	G60-Y62 PolarHBondContact O-N 3.31Å; G60-Y62 VanDerWaalsContact O-N 3.08Å; Y62-C94 CarbonylContact O-C 3.43Å; Y62-C94 VanDerWaalsContact O-CA 3.25Å; Y62-C94 WeakPolarHBondContact O-CA 3.3Å; Y62-C94 VanDerWaalsContact O-CB 3.29Å; Y62-C94 WeakPolarHBondContact O-CB 3.46Å; Y62-L95 HydrophobicContact CG-CD1 4.42Å; Y62-L95 PolarHBondContact O-N 3.43Å
63	P	94.1	Very high	77.4	Confident	90 Å²	90	87.6 Å²	87.6	58%	0.584	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	144.5	179.5	27.8	-34.8	0	0	0	111.4	V59	V59-P63 HydrophobicContact CG1-CB 4.38Å
64	L	95.3	Very high	80	Confident	22 Å²	22	78.8 Å²	78.8	12%	0.115	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	153	174.3	-56.8	-177.8	0	0	0	110.8	Y66 V92 S93 L95 V162	L64-Y66 VanDerWaalsContact CB-O 3.26Å; L64-Y66 WeakPolarHBondContact CB-O 3.45Å; L64-Y66 PolarHBondContact O-N 3.27Å; L64-V92 HydrophobicContact CD1-CG2 4.16Å; L64-S93 PolarHBondContact N-O 3.35Å; L64-L95 HydrophobicContact CD2-CD2 3.56Å; L64-L95 HydrophobicContact CD2-CG 3.77Å; L64-V162 HydrophobicContact CD1-CB 4.02Å; L64-V162 HydrophobicContact CD1-CG1 3.88Å; L64-V162 HydrophobicContact CD2-CB 3.93Å
65	Q	96.8	Very high	82.4	Confident	123 Å²	123	75 Å²	75	58%	0.575	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61	-32.5	173.3	-178.7	60.8	44.7	0	0	112.8	N164	Q65-N164 HydrophobicContact CB-CB 4.3Å
66	Y	96.9	Very high	84.6	Confident	62 Å²	62	72.8 Å²	72.8	24%	0.243	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	146.3	177.4	-58.1	-81	0	0	0	109.1	L64 W68 K121 K171	L64-Y66 VanDerWaalsContact CB-O 3.26Å; L64-Y66 WeakPolarHBondContact CB-O 3.45Å; L64-Y66 PolarHBondContact O-N 3.27Å; Y66-W68 HydrophobicContact CD2-CZ2 4.33Å; Y66-K121 HydrophobicContact CD1-CD 3.87Å; Y66-K121 HydrophobicContact CE1-CD 4.29Å; Y66-K121 HydrophobicContact CG-CD 4.01Å; Y66-K121 HydrophobicContact CG-CG 4.35Å; Y66-K171 WeakPolarHBondContact OH-CA 3.28Å
67	T	96.1	Very high	86.7	Confident	53 Å²	53	63.2 Å²	63.2	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130.2	163.8	-60.2	0	0	0	0	108.6	A91 V92 S93 K121 Q122	T67-A91 HydrophobicContact CG2-CB 4.37Å; T67-V92 CarbonylContact C-O 3.59Å; T67-V92 VanDerWaalsContact CA-O 3.27Å; T67-V92 WeakPolarHBondContact CA-O 3.49Å; T67-V92 WeakPolarHBondContact CG2-O 3.32Å; T67-S93 WeakPolarHBondContact OG1-CB 3.27Å; T67-K121 WeakPolarHBondContact O-CA 3.26Å; T67-Q122 HydrophobicContact CG2-CB 3.9Å; T67-Q122 HydrophobicContact CG2-CG 4.39Å; T67-Q122 PolarHBondContact O-N 2.9Å
68	W	96.7	Very high	88.1	Confident	6 Å²	6	63.1 Å²	63.1	2%	0.023	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.9	-179.2	-64.6	92	0	0	0	110.9	Y66 A91 V92 F119 F120 K121 A161 F176	Y66-W68 HydrophobicContact CD2-CZ2 4.33Å; W68-A91 CarbonylContact O-C 3.53Å; W68-A91 VanDerWaalsContact O-CA 3.3Å; W68-A91 WeakPolarHBondContact O-CA 3.31Å; W68-V92 HydrophobicContact CB-CG2 3.94Å; W68-V92 PolarHBondContact N-O 2.97Å; W68-V92 PolarHBondContact O-N 3.41Å; W68-F119 HydrophobicContact CB-CD1 4.11Å; W68-F119 HydrophobicContact CB-CD2 4.27Å; W68-F119 HydrophobicContact CB-CE1 3.42Å; W68-F119 VanDerWaalsContact CB-CE1 3.42Å; W68-F119 HydrophobicContact CB-CE2 3.61Å; W68-F119 HydrophobicContact CB-CZ 3.15Å; W68-F119 HydrophobicContact CD2-CD1 4.04Å; W68-F119 AromaticContact CD2-CE1 3.69Å; W68-F119 HydrophobicContact CD2-CE1 3.69Å; W68-F119 HydrophobicContact CD2-CZ 4.37Å; W68-F119 AromaticContact CE3-CD1 3.75Å; W68-F119 HydrophobicContact CE3-CD1 3.75Å; W68-F119 AromaticContact CE3-CE1 3.91Å; W68-F119 HydrophobicContact CE3-CE1 3.91Å; W68-F119 HydrophobicContact CE3-CG 4.5Å; W68-F119 HydrophobicContact CG-CD1 4.22Å; W68-F119 AromaticContact CG-CE1 3.48Å; W68-F119 HydrophobicContact CG-CE1 3.48Å; W68-F119 VanDerWaalsContact CG-CE1 3.48Å; W68-F119 AromaticContact CG-CZ 3.71Å; W68-F119 HydrophobicContact CG-CZ 3.71Å; W68-F120 CarbonylContact C-O 3.58Å; W68-F120 WeakPolarHBondContact CA-O 3.18Å; W68-K121 HydrophobicContact CD2-CG 4.34Å; W68-K121 HydrophobicContact CE3-CG 3.98Å; W68-K121 HydrophobicContact CH2-CD 4.34Å; W68-K121 HydrophobicContact CH2-CG 3.73Å; W68-K121 HydrophobicContact CZ2-CG 4.14Å; W68-K121 HydrophobicContact CZ3-CG 3.66Å; W68-A161 HydrophobicContact CD2-CB 4.29Å; W68-A161 HydrophobicContact CE3-CB 4.43Å; W68-A161 HydrophobicContact CH2-CB 4Å; W68-A161 HydrophobicContact CZ2-CB 3.79Å; W68-A161 HydrophobicContact CZ3-CB 4.3Å; W68-A161 PolarHBondContact NE1-O 3.44Å; W68-F176 HydrophobicContact CH2-CD2 4.27Å; W68-F176 AromaticContact CH2-CE2 3.56Å; W68-F176 HydrophobicContact CH2-CE2 3.56Å; W68-F176 HydrophobicContact CZ2-CE2 4.41Å; W68-F176 AromaticContact CZ3-CD2 3.89Å; W68-F176 HydrophobicContact CZ3-CD2 3.89Å; W68-F176 AromaticContact CZ3-CE2 3.66Å; W68-F176 HydrophobicContact CZ3-CE2 3.66Å
69	C	95.5	Very high	89.6	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.1	-177.7	-63.9	0	0	0	0	109.7	Y71 K88 A90 F119 F120 Q122	C69-Y71 HydrophobicContact CB-CD2 4.23Å; C69-Y71 HydrophobicContact CB-CE2 3.47Å; C69-Y71 VanDerWaalsContact CB-CE2 3.47Å; C69-K88 WeakPolarHBondContact SG-CE 3.32Å; C69-K88 PolarHBondContact SG-NZ 2.79Å; C69-A90 CarbonylContact C-O 3.55Å; C69-A90 VanDerWaalsContact CA-O 3.25Å; C69-A90 WeakPolarHBondContact CA-O 3.28Å; C69-F119 CarbonylContact O-C 3.49Å; C69-F119 WeakPolarHBondContact O-CA 3.3Å; C69-F120 PolarHBondContact N-O 3.13Å; C69-F120 PolarHBondContact O-N 3.25Å; C69-Q122 PolarHBondContact SG-OE1 3.06Å
70	L	94.9	Very high	90.9	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	127.5	168.5	-174.6	71.2	0	0	0	109.1	V89 A90 L101 M105 F117 Y118 F119	L70-V89 HydrophobicContact CD2-CB 4.29Å; L70-V89 HydrophobicContact CD2-CG1 4.4Å; L70-V89 HydrophobicContact CG-CB 4.45Å; L70-V89 PolarHBondContact O-N 2.76Å; L70-A90 HydrophobicContact CB-CB 4.32Å; L70-A90 PolarHBondContact N-O 3.43Å; L70-A90 PolarHBondContact O-N 2.79Å; L70-L101 HydrophobicContact CB-CD2 4.34Å; L70-L101 HydrophobicContact CD2-CD1 3.9Å; L70-M105 HydrophobicContact CD1-CE 3.87Å; L70-M105 HydrophobicContact CD1-SD 4.38Å; L70-M105 HydrophobicContact CD2-CE 3.91Å; L70-M105 HydrophobicContact CD2-CG 4.12Å; L70-M105 HydrophobicContact CD2-SD 3.72Å; L70-F117 HydrophobicContact CD1-CB 4.3Å; L70-F117 HydrophobicContact CD1-CD1 3.97Å; L70-F117 HydrophobicContact CD1-CG 4.37Å; L70-F117 HydrophobicContact CD2-CD1 4.48Å; L70-F117 HydrophobicContact CD2-CE1 4.31Å; L70-F117 HydrophobicContact CG-CD1 4.42Å; L70-Y118 CarbonylContact C-O 3.55Å; L70-Y118 WeakPolarHBondContact CA-O 3.32Å; L70-F119 HydrophobicContact CB-CD2 4.24Å; L70-F119 HydrophobicContact CD1-CD2 4.26Å
71	Y	93.6	Very high	91.8	Very high	13 Å²	13	58.2 Å²	58.2	5%	0.051	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.6	166.5	-50.2	-107.5	0	0	0	109.5	C69 L86 D87 K88 F117 Y118 F120 L125 P126	C69-Y71 HydrophobicContact CB-CD2 4.23Å; C69-Y71 HydrophobicContact CB-CE2 3.47Å; C69-Y71 VanDerWaalsContact CB-CE2 3.47Å; Y71-L86 HydrophobicContact CD1-CD2 4.39Å; Y71-D87 CarbonylContact C-O 3.51Å; Y71-D87 WeakPolarHBondContact CA-O 3.19Å; Y71-K88 HydrophobicContact CD1-CB 3.64Å; Y71-K88 HydrophobicContact CD1-CG 4.02Å; Y71-K88 HydrophobicContact CE1-CB 3.61Å; Y71-K88 HydrophobicContact CE1-CD 3.93Å; Y71-K88 HydrophobicContact CE1-CG 3.73Å; Y71-F117 WeakPolarHBondContact O-CA 3.29Å; Y71-Y118 PolarHBondContact N-O 3.43Å; Y71-Y118 PolarHBondContact O-N 3.46Å; Y71-F120 HydrophobicContact CE2-CB 4.2Å; Y71-L125 HydrophobicContact CE1-CD2 4.46Å; Y71-P126 HydrophobicContact CD1-CG 4.27Å; Y71-P126 HydrophobicContact CD2-CG 4.01Å; Y71-P126 HydrophobicContact CE2-CG 4.4Å; Y71-P126 HydrophobicContact CG-CG 3.96Å
72	F	92.4	Very high	92	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.4	178.8	167.2	-110.5	0	0	0	109.8	V13 T16 L17 D74 L86 D87 V89 T115 F117	V13-F72 HydrophobicContact CG1-CD1 4.22Å; V13-F72 HydrophobicContact CG2-CD1 4.49Å; T16-F72 HydrophobicContact CG2-CZ 3.88Å; L17-F72 HydrophobicContact CD1-CB 3.59Å; L17-F72 HydrophobicContact CD1-CD1 4.02Å; L17-F72 HydrophobicContact CD1-CD2 4.11Å; L17-F72 HydrophobicContact CD1-CG 3.67Å; L17-F72 HydrophobicContact CD2-CB 4.21Å; L17-F72 HydrophobicContact CD2-CD1 4.21Å; L17-F72 HydrophobicContact CD2-CD2 3.14Å; L17-F72 HydrophobicContact CD2-CE1 4.31Å; L17-F72 HydrophobicContact CD2-CE2 3.17Å; L17-F72 HydrophobicContact CD2-CG 3.62Å; L17-F72 HydrophobicContact CD2-CZ 3.81Å; L17-F72 HydrophobicContact CG-CB 4.39Å; L17-F72 HydrophobicContact CG-CD1 4.2Å; L17-F72 HydrophobicContact CG-CD2 3.99Å; L17-F72 HydrophobicContact CG-CE1 4.38Å; L17-F72 HydrophobicContact CG-CE2 4.07Å; L17-F72 HydrophobicContact CG-CG 3.96Å; L17-F72 HydrophobicContact CG-CZ 4.29Å; F72-D74 HydrophobicContact CD1-CB 4.46Å; F72-D74 HydrophobicContact CE1-CB 3.76Å; F72-D74 HydrophobicContact CZ-CB 4.34Å; F72-L86 WeakPolarHBondContact O-CA 3.08Å; F72-D87 PolarHBondContact N-O 3.34Å; F72-D87 PolarHBondContact O-N 2.92Å; F72-V89 HydrophobicContact CB-CG2 3.6Å; F72-T115 HydrophobicContact CD2-CG2 3.8Å; F72-T115 HydrophobicContact CE2-CG2 3.29Å; F72-T115 HydrophobicContact CZ-CG2 4.27Å; F72-F117 HydrophobicContact CB-CD1 4.37Å; F72-F117 HydrophobicContact CB-CE1 4.46Å; F72-F117 HydrophobicContact CD2-CD1 4.16Å; F72-F117 HydrophobicContact CD2-CE1 4.01Å
73	L	93.3	Very high	91.9	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.4	167.9	-167.8	81.9	0	0	0	109	G75 W82 R85 L86 T115 D116 Y118	L73-G75 PolarHBondContact O-N 2.8Å; L73-W82 HydrophobicContact CD1-CD2 4.25Å; L73-W82 HydrophobicContact CD1-CG 4.2Å; L73-W82 HydrophobicContact CD1-CZ2 4.44Å; L73-W82 WeakPolarHBondContact CD1-O 3.22Å; L73-R85 CarbonylContact C-O 3.55Å; L73-R85 WeakPolarHBondContact CA-O 3.4Å; L73-R85 HydrophobicContact CD1-CB 3.78Å; L73-R85 HydrophobicContact CG-CB 4.25Å; L73-L86 HydrophobicContact CB-CD1 4.36Å; L73-L86 HydrophobicContact CD1-CB 3.96Å; L73-L86 HydrophobicContact CD1-CD1 4.24Å; L73-T115 WeakPolarHBondContact O-CA 3.21Å; L73-D116 HydrophobicContact CB-CB 3.78Å; L73-D116 HydrophobicContact CD2-CB 4.23Å; L73-D116 WeakPolarHBondContact CD2-OD2 3.24Å; L73-D116 PolarHBondContact N-O 2.81Å; L73-D116 PolarHBondContact O-N 3.26Å; L73-Y118 HydrophobicContact CB-CE2 4.11Å
74	D	90.8	Very high	91.6	Very high	24 Å²	24	52 Å²	52	13%	0.128	28%	0.275	C	S	.	.			trans	-69.7	116.1	178	-175.4	-4.4	0	0	0	110.8	F72 T76 C77 R85	F72-D74 HydrophobicContact CD1-CB 4.46Å; F72-D74 HydrophobicContact CE1-CB 3.76Å; F72-D74 HydrophobicContact CZ-CB 4.34Å; D74-T76 VanDerWaalsContact C-N 3.27Å; D74-T76 VanDerWaalsContact CG-OG1 3.27Å; D74-T76 PolarHBondContact O-N 3.45Å; D74-T76 VanDerWaalsContact OD1-CB 3.3Å; D74-T76 WeakPolarHBondContact OD1-CB 3.15Å; D74-T76 VanDerWaalsContact OD1-CG2 3.3Å; D74-T76 WeakPolarHBondContact OD1-CG2 3.16Å; D74-T76 PolarHBondContact OD1-N 3.41Å; D74-T76 PolarHBondContact OD1-OG1 3.12Å; D74-T76 PolarHBondContact OD2-OG1 3.4Å; D74-T76 VanDerWaalsContact OD2-OG1 3.06Å; D74-C77 PolarHBondContact OD2-SG 2.9Å; D74-R85 PolarHBondContact N-O 3.45Å; D74-R85 PolarHBondContact O-NE 3.25Å; D74-R85 PolarHBondContact O-NH2 2.86Å
75	G	89.7	Confident	91.4	Very high	2 Å²	2	52.5 Å²	52.5	2%	0.021	28%	0.275	C	S	.	.	S	Bend	trans	-74.1	-11.9	177.7	0	0	0	0	0	115.1	L73 Q78 G114 T115	L73-G75 PolarHBondContact O-N 2.8Å; G75-Q78 WeakPolarHBondContact O-CG 3.27Å; G75-Q78 PolarHBondContact O-NE2 3.3Å; G75-G114 WeakPolarHBondContact CA-O 3.33Å; G75-T115 PolarHBondContact N-OG1 3.33Å
76	T	87.3	Confident	91.1	Very high	70 Å²	70	48 Å²	48	43%	0.429	26%	0.255	S	S	.	.	S	Bend	trans	-90.3	-31	-171.4	74	0	0	0	0	113.3	D74 Q78 K112	D74-T76 VanDerWaalsContact C-N 3.27Å; D74-T76 VanDerWaalsContact CG-OG1 3.27Å; D74-T76 PolarHBondContact O-N 3.45Å; D74-T76 VanDerWaalsContact OD1-CB 3.3Å; D74-T76 WeakPolarHBondContact OD1-CB 3.15Å; D74-T76 VanDerWaalsContact OD1-CG2 3.3Å; D74-T76 WeakPolarHBondContact OD1-CG2 3.16Å; D74-T76 PolarHBondContact OD1-N 3.41Å; D74-T76 PolarHBondContact OD1-OG1 3.12Å; D74-T76 PolarHBondContact OD2-OG1 3.4Å; D74-T76 VanDerWaalsContact OD2-OG1 3.06Å; T76-Q78 PolarHBondContact O-N 2.92Å; T76-K112 HydrophobicContact CG2-CB 4.44Å; T76-K112 HydrophobicContact CG2-CD 3.64Å; T76-K112 HydrophobicContact CG2-CG 4.36Å
77	C	85.3	Confident	90.8	Very high	43 Å²	43	45.8 Å²	45.8	29%	0.291	25%	0.247	S	C	.	.			trans	-94.3	51.8	-177.3	-61.9	0	0	0	0	112.2	D74 S79 L80 R85	D74-C77 PolarHBondContact OD2-SG 2.9Å; C77-S79 PolarHBondContact O-N 3.29Å; C77-L80 HydrophobicContact CB-CD1 3.78Å; C77-L80 HydrophobicContact CB-CG 4.13Å; C77-L80 PolarHBondContact O-N 3.3Å; C77-L80 VanDerWaalsContact O-N 3.07Å; C77-R85 HydrophobicContact CB-CG 4.38Å; C77-R85 WeakPolarHBondContact O-CD 3.27Å; C77-R85 PolarHBondContact O-NE 3.22Å
78	Q	83.1	Confident	90.5	Very high	130 Å²	130	44.9 Å²	44.9	61%	0.607	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.3	-174.1	-61.5	-174.2	11	0	0	114.7	G75 T76	G75-Q78 WeakPolarHBondContact O-CG 3.27Å; G75-Q78 PolarHBondContact O-NE2 3.3Å; T76-Q78 PolarHBondContact O-N 2.92Å
79	S	88.5	Confident	90.1	Very high	119 Å²	119	45.1 Å²	45.1	83%	0.832	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.1	174.5	53	0	0	0	0	114.1	C77	C77-S79 PolarHBondContact O-N 3.29Å
80	L	89.5	Confident	89.8	Confident	74 Å²	74	45.1 Å²	45.1	39%	0.387	24%	0.241	S	C	.	.	S	Bend	trans	-83	157.9	178.6	-62.1	-179.5	0	0	0	111.3	C77 E84 R85	C77-L80 HydrophobicContact CB-CD1 3.78Å; C77-L80 HydrophobicContact CB-CG 4.13Å; C77-L80 PolarHBondContact O-N 3.3Å; C77-L80 VanDerWaalsContact O-N 3.07Å; L80-E84 HydrophobicContact CB-CB 4.18Å; L80-R85 HydrophobicContact CB-CG 3.82Å
81	A	90.4	Very high	89.7	Confident	47 Å²	47	45.5 Å²	45.5	39%	0.388	24%	0.244	S	C	.	.			trans	-61.3	154.2	172.2	0	0	0	0	0	110.8	E83 E84 R85	A81-E83 VanDerWaalsContact C-N 3.26Å; A81-E83 PolarHBondContact O-N 3.46Å; A81-E84 HydrophobicContact CB-CG 4.18Å; A81-E84 WeakPolarHBondContact CB-OE2 3.32Å; A81-E84 PolarHBondContact N-OE2 2.98Å; A81-E84 VanDerWaalsContact N-OE2 3.08Å; A81-E84 PolarHBondContact O-N 3.46Å; A81-E84 VanDerWaalsContact O-N 3.08Å; A81-R85 WeakPolarHBondContact O-CG 3.49Å; A81-R85 PolarHBondContact O-N 3.41Å
82	W	90.2	Very high	89.6	Confident	79 Å²	79	44.9 Å²	44.9	30%	0.299	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-57.8	-41.2	-175.8	179	91	0	0	0	111.8	L73 E84 R85 L86 Y118 P126 R127	L73-W82 HydrophobicContact CD1-CD2 4.25Å; L73-W82 HydrophobicContact CD1-CG 4.2Å; L73-W82 HydrophobicContact CD1-CZ2 4.44Å; L73-W82 WeakPolarHBondContact CD1-O 3.22Å; W82-E84 VanDerWaalsContact C-N 3.31Å; W82-E84 PolarHBondContact O-N 3.46Å; W82-R85 PolarHBondContact O-N 3.41Å; W82-L86 HydrophobicContact CH2-CD1 4.4Å; W82-L86 HydrophobicContact CH2-CD2 3.66Å; W82-L86 HydrophobicContact CH2-CG 4.42Å; W82-L86 HydrophobicContact CZ2-CD1 4.37Å; W82-L86 HydrophobicContact CZ2-CD2 4.41Å; W82-L86 HydrophobicContact CZ3-CD2 3.95Å; W82-L86 PolarHBondContact O-N 3.45Å; W82-Y118 HydrophobicContact CZ2-CE2 4.45Å; W82-P126 WeakPolarHBondContact CH2-O 3.47Å; W82-R127 HydrophobicContact CH2-CG 3.85Å; W82-R127 HydrophobicContact CZ3-CG 3.71Å
83	E	88.7	Confident	89.7	Confident	116 Å²	116	47 Å²	47	54%	0.542	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-64.4	-34.1	179.1	-65.7	74.2	-165.9	0	0	112.5	A81 R85 L86	A81-E83 VanDerWaalsContact C-N 3.26Å; A81-E83 PolarHBondContact O-N 3.46Å; E83-R85 VanDerWaalsContact C-N 3.26Å; E83-R85 PolarHBondContact O-N 2.86Å; E83-L86 PolarHBondContact O-N 2.89Å
84	E	89.1	Confident	89.7	Confident	104 Å²	104	47 Å²	47	49%	0.486	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-74.9	-21.5	-179.1	-64	-178.6	110.6	0	0	112.7	K9 L80 A81 W82	K9-E84 PolarHBondContact NZ-O 2.78Å; L80-E84 HydrophobicContact CB-CB 4.18Å; A81-E84 HydrophobicContact CB-CG 4.18Å; A81-E84 WeakPolarHBondContact CB-OE2 3.32Å; A81-E84 PolarHBondContact N-OE2 2.98Å; A81-E84 VanDerWaalsContact N-OE2 3.08Å; A81-E84 PolarHBondContact O-N 3.46Å; A81-E84 VanDerWaalsContact O-N 3.08Å; W82-E84 VanDerWaalsContact C-N 3.31Å; W82-E84 PolarHBondContact O-N 3.46Å
85	R	90.6	Very high	89.8	Confident	32 Å²	32	49.5 Å²	49.5	12%	0.121	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-89	-12.5	177.8	-62.8	168.1	60.9	-169.3	-10.6	112.8	L73 D74 C77 L80 A81 W82 E83 G114	L73-R85 CarbonylContact C-O 3.55Å; L73-R85 WeakPolarHBondContact CA-O 3.4Å; L73-R85 HydrophobicContact CD1-CB 3.78Å; L73-R85 HydrophobicContact CG-CB 4.25Å; D74-R85 PolarHBondContact N-O 3.45Å; D74-R85 PolarHBondContact O-NE 3.25Å; D74-R85 PolarHBondContact O-NH2 2.86Å; C77-R85 HydrophobicContact CB-CG 4.38Å; C77-R85 WeakPolarHBondContact O-CD 3.27Å; C77-R85 PolarHBondContact O-NE 3.22Å; L80-R85 HydrophobicContact CB-CG 3.82Å; A81-R85 WeakPolarHBondContact O-CG 3.49Å; A81-R85 PolarHBondContact O-N 3.41Å; W82-R85 PolarHBondContact O-N 3.41Å; E83-R85 VanDerWaalsContact C-N 3.26Å; E83-R85 PolarHBondContact O-N 2.86Å; R85-G114 PolarHBondContact NH2-O 2.72Å
86	L	91.4	Very high	89.8	Confident	29 Å²	29	52.1 Å²	52.1	15%	0.152	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.6	-178	-174.8	81	0	0	0	110.1	Y71 F72 L73 W82 E83 Y118 P126	Y71-L86 HydrophobicContact CD1-CD2 4.39Å; F72-L86 WeakPolarHBondContact O-CA 3.08Å; L73-L86 HydrophobicContact CB-CD1 4.36Å; L73-L86 HydrophobicContact CD1-CB 3.96Å; L73-L86 HydrophobicContact CD1-CD1 4.24Å; W82-L86 HydrophobicContact CH2-CD1 4.4Å; W82-L86 HydrophobicContact CH2-CD2 3.66Å; W82-L86 HydrophobicContact CH2-CG 4.42Å; W82-L86 HydrophobicContact CZ2-CD1 4.37Å; W82-L86 HydrophobicContact CZ2-CD2 4.41Å; W82-L86 HydrophobicContact CZ3-CD2 3.95Å; W82-L86 PolarHBondContact O-N 3.45Å; E83-L86 PolarHBondContact O-N 2.89Å; L86-Y118 HydrophobicContact CD1-CD2 3.72Å; L86-Y118 HydrophobicContact CD1-CE2 3.71Å; L86-P126 HydrophobicContact CD1-CG 4.34Å; L86-P126 HydrophobicContact CD2-CG 3.73Å
87	D	90.1	Very high	89.8	Confident	15 Å²	15	49.3 Å²	49.3	8%	0.08	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.5	175.9	-64.6	-59.8	0	0	0	110.4	K9 V13 Y71 F72	K9-D87 IonicContact NZ-OD1 2.89Å; K9-D87 PolarHBondContact NZ-OD1 2.86Å; K9-D87 IonicContact NZ-OD2 3.83Å; V13-D87 HydrophobicContact CG2-CB 4.37Å; Y71-D87 CarbonylContact C-O 3.51Å; Y71-D87 WeakPolarHBondContact CA-O 3.19Å; F72-D87 PolarHBondContact N-O 3.34Å; F72-D87 PolarHBondContact O-N 2.92Å
88	K	89.9	Confident	90.1	Very high	35 Å²	35	48 Å²	48	15%	0.152	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	120.7	167.9	-173.9	175.7	176.7	173.2	0	108	M37 C69 Y71	M37-K88 HydrophobicContact CB-CD 4.21Å; M37-K88 HydrophobicContact CG-CD 4.46Å; M37-K88 HydrophobicContact SD-CD 3.86Å; M37-K88 VanDerWaalsContact SD-CE 3.6Å; M37-K88 PolarHBondContact SD-NZ 3.43Å; C69-K88 WeakPolarHBondContact SG-CE 3.32Å; C69-K88 PolarHBondContact SG-NZ 2.79Å; Y71-K88 HydrophobicContact CD1-CB 3.64Å; Y71-K88 HydrophobicContact CD1-CG 4.02Å; Y71-K88 HydrophobicContact CE1-CB 3.61Å; Y71-K88 HydrophobicContact CE1-CD 3.93Å; Y71-K88 HydrophobicContact CE1-CG 3.73Å
89	V	88.6	Confident	90.5	Very high	10 Å²	10	43 Å²	43	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-41.8	-170.4	-175.6	0	0	0	0	111.4	V13 L17 L36 L70 F72	V13-V89 HydrophobicContact CG1-CG1 4.47Å; V13-V89 HydrophobicContact CG1-CG2 3.94Å; L17-V89 HydrophobicContact CD1-CB 4.27Å; L17-V89 HydrophobicContact CD1-CG1 3.78Å; L17-V89 HydrophobicContact CD1-CG2 3.47Å; L17-V89 VanDerWaalsContact CD1-CG2 3.47Å; L36-V89 WeakPolarHBondContact CD2-O 3.35Å; L70-V89 HydrophobicContact CD2-CB 4.29Å; L70-V89 HydrophobicContact CD2-CG1 4.4Å; L70-V89 HydrophobicContact CG-CB 4.45Å; L70-V89 PolarHBondContact O-N 2.76Å; F72-V89 HydrophobicContact CB-CG2 3.6Å
90	A	89.2	Confident	90.5	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	157	-172	0	0	0	0	0	111.7	F26 L34 C69 L70 L101	F26-A90 HydrophobicContact CZ-CB 4.36Å; L34-A90 HydrophobicContact CD1-CB 4.34Å; L34-A90 HydrophobicContact CD2-CB 3.73Å; L34-A90 HydrophobicContact CG-CB 4.21Å; C69-A90 CarbonylContact C-O 3.55Å; C69-A90 VanDerWaalsContact CA-O 3.25Å; C69-A90 WeakPolarHBondContact CA-O 3.28Å; L70-A90 HydrophobicContact CB-CB 4.32Å; L70-A90 PolarHBondContact N-O 3.43Å; L70-A90 PolarHBondContact O-N 2.79Å; A90-L101 HydrophobicContact CB-CD1 3.76Å; A90-L101 HydrophobicContact CB-CD2 4.38Å
91	A	91.5	Very high	90.5	Very high	9 Å²	9	35.3 Å²	35.3	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	128.6	166.2	0	0	0	0	0	110.1	L34 T67 W68	L34-A91 WeakPolarHBondContact CD1-O 3.38Å; T67-A91 HydrophobicContact CG2-CB 4.37Å; W68-A91 CarbonylContact O-C 3.53Å; W68-A91 VanDerWaalsContact O-CA 3.3Å; W68-A91 WeakPolarHBondContact O-CA 3.31Å
92	V	92.5	Very high	90.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.3	-179.3	-58.7	0	0	0	0	110.5	L34 L64 T67 W68 Q97 F98 L101 F119	L34-V92 HydrophobicContact CD1-CG1 3.49Å; L34-V92 VanDerWaalsContact CD1-CG1 3.49Å; L64-V92 HydrophobicContact CD1-CG2 4.16Å; T67-V92 CarbonylContact C-O 3.59Å; T67-V92 VanDerWaalsContact CA-O 3.27Å; T67-V92 WeakPolarHBondContact CA-O 3.49Å; T67-V92 WeakPolarHBondContact CG2-O 3.32Å; W68-V92 HydrophobicContact CB-CG2 3.94Å; W68-V92 PolarHBondContact N-O 2.97Å; W68-V92 PolarHBondContact O-N 3.41Å; V92-Q97 HydrophobicContact CB-CB 4.06Å; V92-Q97 HydrophobicContact CG1-CB 3.97Å; V92-F98 HydrophobicContact CG2-CB 4.42Å; V92-L101 HydrophobicContact CG1-CB 4.11Å; V92-L101 HydrophobicContact CG1-CD2 3.72Å; V92-F119 HydrophobicContact CG2-CE2 4.11Å; V92-F119 HydrophobicContact CG2-CZ 3.87Å
93	S	94.1	Very high	90.3	Very high	46 Å²	46	38.8 Å²	38.8	32%	0.322	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	-5.1	179.2	64.9	0	0	0	0	113.2	L64 T67 Q97	L64-S93 PolarHBondContact N-O 3.35Å; T67-S93 WeakPolarHBondContact OG1-CB 3.27Å; S93-Q97 PolarHBondContact OG-OE1 3.41Å
94	C	92.7	Very high	90.2	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	164.4	171.1	75.4	0	0	0	0	112.1	Y62 E96 Q97 F98	Y62-C94 CarbonylContact O-C 3.43Å; Y62-C94 VanDerWaalsContact O-CA 3.25Å; Y62-C94 WeakPolarHBondContact O-CA 3.3Å; Y62-C94 VanDerWaalsContact O-CB 3.29Å; Y62-C94 WeakPolarHBondContact O-CB 3.46Å; C94-E96 VanDerWaalsContact C-N 3.3Å; C94-E96 PolarHBondContact O-N 2.8Å; C94-E96 PolarHBondContact SG-OE2 3.15Å; C94-Q97 PolarHBondContact O-N 3.04Å; C94-Q97 WeakPolarHBondContact SG-CG 3.21Å; C94-F98 PolarHBondContact O-N 2.91Å; C94-F98 VanDerWaalsContact O-N 3.13Å
95	L	92.8	Very high	90.2	Very high	77 Å²	77	28.9 Å²	28.9	40%	0.403	15%	0.149	S	C	.	.	H	α-helix	trans	-64.9	-31.8	179.9	-71.8	176.3	0	0	0	113	Y62 L64 F98 G99 V162	Y62-L95 HydrophobicContact CG-CD1 4.42Å; Y62-L95 PolarHBondContact O-N 3.43Å; L64-L95 HydrophobicContact CD2-CD2 3.56Å; L64-L95 HydrophobicContact CD2-CG 3.77Å; L95-F98 PolarHBondContact O-N 2.99Å; L95-G99 PolarHBondContact O-N 2.79Å; L95-V162 HydrophobicContact CD2-CB 4.45Å; L95-V162 HydrophobicContact CD2-CG2 4.13Å
96	E	89.5	Confident	90.1	Very high	56 Å²	56	29.8 Å²	29.8	26%	0.262	15%	0.154	S	C	.	.	H	α-helix	trans	-64.6	-45.2	177.9	-62.3	95.7	148.5	0	0	111.8	R61 C94 F98 G99 V100	R61-E96 WeakPolarHBondContact CA-OE1 3.32Å; R61-E96 WeakPolarHBondContact CB-OE1 3.33Å; R61-E96 PolarHBondContact N-OE1 3.31Å; R61-E96 IonicContact NE-OE1 3.19Å; R61-E96 PolarHBondContact NE-OE1 2.91Å; C94-E96 VanDerWaalsContact C-N 3.3Å; C94-E96 PolarHBondContact O-N 2.8Å; C94-E96 PolarHBondContact SG-OE2 3.15Å; E96-F98 VanDerWaalsContact C-N 3.31Å; E96-F98 PolarHBondContact O-N 2.98Å; E96-G99 PolarHBondContact O-N 3.38Å; E96-V100 PolarHBondContact O-N 2.81Å; E96-V100 VanDerWaalsContact O-N 3.1Å
97	Q	89	Confident	90.2	Very high	12 Å²	12	32 Å²	32	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-40.6	174.6	-69.6	161.6	3.9	0	0	111.2	H33 L34 V92 S93 C94 V100 L101	H33-Q97 HydrophobicContact CB-CG 3.7Å; H33-Q97 WeakPolarHBondContact O-CG 3.44Å; H33-Q97 PolarHBondContact O-NE2 3.48Å; L34-Q97 HydrophobicContact CD1-CB 4.1Å; V92-Q97 HydrophobicContact CB-CB 4.06Å; V92-Q97 HydrophobicContact CG1-CB 3.97Å; S93-Q97 PolarHBondContact OG-OE1 3.41Å; C94-Q97 PolarHBondContact O-N 3.04Å; C94-Q97 WeakPolarHBondContact SG-CG 3.21Å; Q97-V100 PolarHBondContact O-N 3.16Å; Q97-L101 WeakPolarHBondContact O-CB 3.4Å; Q97-L101 PolarHBondContact O-N 3.31Å
98	F	91.7	Very high	90.4	Very high	16 Å²	16	31.5 Å²	31.5	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-62.8	-41.9	174	174.8	-103	0	0	0	112.2	V92 C94 L95 E96 V100 L101 Y102 F119 L158 V162	V92-F98 HydrophobicContact CG2-CB 4.42Å; C94-F98 PolarHBondContact O-N 2.91Å; C94-F98 VanDerWaalsContact O-N 3.13Å; L95-F98 PolarHBondContact O-N 2.99Å; E96-F98 VanDerWaalsContact C-N 3.31Å; E96-F98 PolarHBondContact O-N 2.98Å; F98-V100 VanDerWaalsContact C-N 3.31Å; F98-V100 PolarHBondContact O-N 2.61Å; F98-L101 PolarHBondContact O-N 3.27Å; F98-Y102 HydrophobicContact CE1-CD2 4.3Å; F98-Y102 HydrophobicContact CZ-CD2 4.19Å; F98-Y102 VanDerWaalsContact O-CB 3.27Å; F98-Y102 WeakPolarHBondContact O-CB 3.41Å; F98-Y102 PolarHBondContact O-N 3.06Å; F98-F119 HydrophobicContact CD2-CZ 4.33Å; F98-F119 HydrophobicContact CE2-CZ 4.44Å; F98-L158 HydrophobicContact CE2-CB 3.97Å; F98-L158 HydrophobicContact CZ-CB 3.96Å; F98-V162 HydrophobicContact CB-CG1 4.42Å; F98-V162 HydrophobicContact CD1-CG1 4.49Å; F98-V162 HydrophobicContact CD1-CG2 3.83Å; F98-V162 HydrophobicContact CD2-CG1 3.6Å; F98-V162 HydrophobicContact CD2-CG2 4.34Å; F98-V162 HydrophobicContact CE1-CG2 3.82Å; F98-V162 HydrophobicContact CE2-CG1 3.93Å; F98-V162 HydrophobicContact CE2-CG2 4.34Å; F98-V162 HydrophobicContact CG-CB 4.42Å; F98-V162 HydrophobicContact CG-CG1 3.9Å; F98-V162 HydrophobicContact CG-CG2 4.09Å; F98-V162 HydrophobicContact CZ-CG2 4.08Å
99	G	91.1	Very high	90.6	Very high	23 Å²	23	31.9 Å²	31.9	24%	0.237	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-40.9	178.1	0	0	0	0	0	112.5	L95 E96 Q103	L95-G99 PolarHBondContact O-N 2.79Å; E96-G99 PolarHBondContact O-N 3.38Å; G99-Q103 VanDerWaalsContact O-CG 3.32Å; G99-Q103 WeakPolarHBondContact O-CG 3.35Å; G99-Q103 PolarHBondContact O-N 3.25Å; G99-Q103 VanDerWaalsContact O-N 3.13Å; G99-Q103 PolarHBondContact O-NE2 3.09Å
100	V	88.8	Confident	90.7	Very high	31 Å²	31	34.7 Å²	34.7	19%	0.188	19%	0.188	C	C	.	.	H	α-helix	trans	-70.5	-42.8	175.6	174.2	0	0	0	0	111.7	F26 T29 E96 Q97 F98 Y102 Q103 S104	F26-V100 HydrophobicContact CB-CG1 4.35Å; F26-V100 HydrophobicContact CD2-CG1 3.9Å; T29-V100 HydrophobicContact CG2-CB 4.17Å; T29-V100 HydrophobicContact CG2-CG1 4.22Å; T29-V100 HydrophobicContact CG2-CG2 3.8Å; E96-V100 PolarHBondContact O-N 2.81Å; E96-V100 VanDerWaalsContact O-N 3.1Å; Q97-V100 PolarHBondContact O-N 3.16Å; F98-V100 VanDerWaalsContact C-N 3.31Å; F98-V100 PolarHBondContact O-N 2.61Å; V100-Y102 PolarHBondContact O-N 3.09Å; V100-Q103 PolarHBondContact O-N 3.43Å; V100-S104 WeakPolarHBondContact O-CB 3.17Å; V100-S104 PolarHBondContact O-N 3.11Å; V100-S104 VanDerWaalsContact O-N 3.12Å; V100-S104 PolarHBondContact O-OG 2.64Å
101	L	89.4	Confident	90.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-56.8	-49.6	173.6	179	64.7	0	0	0	111.4	F26 L70 A90 V92 Q97 F98 Q103 S104 M105 F119	F26-L101 HydrophobicContact CE2-CB 4.45Å; F26-L101 HydrophobicContact CE2-CD1 3.79Å; F26-L101 HydrophobicContact CZ-CD1 4.22Å; L70-L101 HydrophobicContact CB-CD2 4.34Å; L70-L101 HydrophobicContact CD2-CD1 3.9Å; A90-L101 HydrophobicContact CB-CD1 3.76Å; A90-L101 HydrophobicContact CB-CD2 4.38Å; V92-L101 HydrophobicContact CG1-CB 4.11Å; V92-L101 HydrophobicContact CG1-CD2 3.72Å; Q97-L101 WeakPolarHBondContact O-CB 3.4Å; Q97-L101 PolarHBondContact O-N 3.31Å; F98-L101 PolarHBondContact O-N 3.27Å; L101-Q103 PolarHBondContact O-N 3.48Å; L101-S104 PolarHBondContact O-N 2.98Å; L101-S104 VanDerWaalsContact O-N 3.15Å; L101-M105 HydrophobicContact CD1-CG 4.14Å; L101-M105 HydrophobicContact CD1-SD 4.11Å; L101-M105 HydrophobicContact CD2-SD 4.37Å; L101-M105 HydrophobicContact CG-CG 4.34Å; L101-M105 HydrophobicContact CG-SD 3.84Å; L101-M105 VanDerWaalsContact O-CG 3.28Å; L101-M105 WeakPolarHBondContact O-CG 3.45Å; L101-M105 PolarHBondContact O-N 3.16Å; L101-F119 HydrophobicContact CD2-CE2 4.1Å
102	Y	88.6	Confident	90.9	Very high	98 Å²	98	41.6 Å²	41.6	38%	0.384	22%	0.217	S	C	.	.	H	α-helix	trans	-53.9	-51.4	178.8	172.8	-72	0	0	0	111.8	F98 V100 S104 M105 M155	F98-Y102 HydrophobicContact CE1-CD2 4.3Å; F98-Y102 HydrophobicContact CZ-CD2 4.19Å; F98-Y102 VanDerWaalsContact O-CB 3.27Å; F98-Y102 WeakPolarHBondContact O-CB 3.41Å; F98-Y102 PolarHBondContact O-N 3.06Å; V100-Y102 PolarHBondContact O-N 3.09Å; Y102-S104 PolarHBondContact O-N 3.07Å; Y102-M105 PolarHBondContact O-N 3.49Å; Y102-M155 HydrophobicContact CD1-CE 4.47Å; Y102-M155 HydrophobicContact CD2-CE 3.47Å; Y102-M155 VanDerWaalsContact CD2-CE 3.47Å; Y102-M155 HydrophobicContact CD2-CG 4.12Å; Y102-M155 HydrophobicContact CD2-SD 3.11Å; Y102-M155 WeakPolarHBondContact CD2-SD 3.16Å; Y102-M155 HydrophobicContact CE1-CE 4.11Å; Y102-M155 HydrophobicContact CE2-CE 3.15Å; Y102-M155 HydrophobicContact CE2-CG 3.28Å; Y102-M155 HydrophobicContact CE2-SD 2.88Å; Y102-M155 WeakPolarHBondContact CE2-SD 3.41Å; Y102-M155 HydrophobicContact CG-CE 4.13Å; Y102-M155 HydrophobicContact CG-SD 4.23Å
103	Q	87.7	Confident	90.9	Very high	102 Å²	102	46 Å²	46	48%	0.477	24%	0.239	S	C	.	.	H	α-helix	trans	-66.9	-26.8	-175.7	-73.5	176	53.6	0	0	111.5	G99 V100 L101	G99-Q103 VanDerWaalsContact O-CG 3.32Å; G99-Q103 WeakPolarHBondContact O-CG 3.35Å; G99-Q103 PolarHBondContact O-N 3.25Å; G99-Q103 VanDerWaalsContact O-N 3.13Å; G99-Q103 PolarHBondContact O-NE2 3.09Å; V100-Q103 PolarHBondContact O-N 3.43Å; L101-Q103 PolarHBondContact O-N 3.48Å
104	S	85.5	Confident	90.8	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-81.8	-36.6	-178.5	-51.3	0	0	0	0	112.2	L18 R19 T22 F26 V100 L101 Y102	L18-S104 CarbonylContact C-O 3.49Å; L18-S104 WeakPolarHBondContact CA-O 3.39Å; R19-S104 PolarHBondContact N-O 3.13Å; T22-S104 VanDerWaalsContact OG1-CA 3.3Å; T22-S104 WeakPolarHBondContact OG1-CA 3.44Å; F26-S104 WeakPolarHBondContact CB-OG 3.11Å; F26-S104 WeakPolarHBondContact CD2-OG 3.43Å; V100-S104 WeakPolarHBondContact O-CB 3.17Å; V100-S104 PolarHBondContact O-N 3.11Å; V100-S104 VanDerWaalsContact O-N 3.12Å; V100-S104 PolarHBondContact O-OG 2.64Å; L101-S104 PolarHBondContact O-N 2.98Å; L101-S104 VanDerWaalsContact O-N 3.15Å; Y102-S104 PolarHBondContact O-N 3.07Å
105	M	88.6	Confident	90.9	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.049	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-63.8	136.6	-177.2	-73.1	173.2	68.2	0	0	113.5	L70 L101 Y102 F117 W154 L158	L70-M105 HydrophobicContact CD1-CE 3.87Å; L70-M105 HydrophobicContact CD1-SD 4.38Å; L70-M105 HydrophobicContact CD2-CE 3.91Å; L70-M105 HydrophobicContact CD2-CG 4.12Å; L70-M105 HydrophobicContact CD2-SD 3.72Å; L101-M105 HydrophobicContact CD1-CG 4.14Å; L101-M105 HydrophobicContact CD1-SD 4.11Å; L101-M105 HydrophobicContact CD2-SD 4.37Å; L101-M105 HydrophobicContact CG-CG 4.34Å; L101-M105 HydrophobicContact CG-SD 3.84Å; L101-M105 VanDerWaalsContact O-CG 3.28Å; L101-M105 WeakPolarHBondContact O-CG 3.45Å; L101-M105 PolarHBondContact O-N 3.16Å; Y102-M105 PolarHBondContact O-N 3.49Å; M105-F117 HydrophobicContact CE-CD2 4.21Å; M105-F117 HydrophobicContact CE-CE1 4.27Å; M105-F117 HydrophobicContact CE-CE2 3.97Å; M105-F117 HydrophobicContact CE-CG 4.46Å; M105-F117 HydrophobicContact CE-CZ 4.01Å; M105-W154 HydrophobicContact CE-CZ2 4.48Å; M105-L158 HydrophobicContact CE-CD1 4.18Å; M105-L158 HydrophobicContact SD-CD1 4.4Å
106	K	90.3	Very high	91.1	Very high	51 Å²	51	40.5 Å²	40.5	22%	0.222	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-71.4	149.6	164.3	-73.5	-179.6	-165.8	161.9	0	112	V15 T16 L17 L18 R19 L111	V15-K106 PolarHBondContact O-NZ 3.38Å; T16-K106 WeakPolarHBondContact O-CD 3.42Å; T16-K106 WeakPolarHBondContact O-CE 3.42Å; T16-K106 PolarHBondContact O-NZ 3.11Å; L17-K106 WeakPolarHBondContact O-CB 3.46Å; L17-K106 WeakPolarHBondContact O-CG 3.1Å; L17-K106 PolarHBondContact O-N 2.71Å; L18-K106 WeakPolarHBondContact O-CE 3.32Å; R19-K106 HydrophobicContact CG-CG 4.17Å; K106-L111 HydrophobicContact CB-CD2 4.05Å; K106-L111 HydrophobicContact CB-CG 4.43Å; K106-L111 HydrophobicContact CD-CD2 4.17Å
107	E	93	Very high	91.4	Very high	76 Å²	76	37.9 Å²	37.9	36%	0.355	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-62.8	139.6	172.5	-69.5	90.1	155.8	0	0	111.5	R19 S109 S110 D151	R19-E107 IonicContact CZ-OE1 2.94Å; R19-E107 IonicContact CZ-OE2 3.96Å; R19-E107 IonicContact NE-OE2 2.95Å; R19-E107 IonicContact NH2-OE1 3.03Å; R19-E107 PolarHBondContact NH2-OE1 3.47Å; R19-E107 IonicContact NH2-OE2 3.26Å; R19-E107 PolarHBondContact NH2-OE2 3.19Å; E107-S109 PolarHBondContact O-N 3.25Å; E107-S109 VanDerWaalsContact O-N 3.14Å; E107-S110 WeakPolarHBondContact O-CB 3.37Å; E107-S110 PolarHBondContact O-N 2.82Å; E107-S110 PolarHBondContact O-OG 3.12Å; E107-D151 HydrophobicContact CB-CB 4.34Å; E107-D151 HydrophobicContact CG-CB 4.34Å
108	P	93.9	Very high	91.8	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.019	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-50.1	-38.1	176.3	-30.5	36.1	0	0	0	114.7	S110 L111 M150 D151 W154 V178 I180	P108-S110 PolarHBondContact O-N 3.46Å; P108-L111 PolarHBondContact O-N 3.27Å; P108-M150 HydrophobicContact CB-CE 3.83Å; P108-M150 HydrophobicContact CB-CG 4.25Å; P108-M150 HydrophobicContact CB-SD 4.41Å; P108-D151 VanDerWaalsContact CD-OD1 3.31Å; P108-D151 WeakPolarHBondContact CD-OD1 3.42Å; P108-W154 HydrophobicContact CG-CB 3.85Å; P108-W154 HydrophobicContact CG-CG 3.65Å; P108-V178 HydrophobicContact CB-CG1 4.42Å; P108-V178 HydrophobicContact CB-CG2 3.93Å; P108-V178 HydrophobicContact CG-CG1 4.16Å; P108-V178 HydrophobicContact CG-CG2 4.25Å; P108-I180 HydrophobicContact CB-CD1 4.22Å; P108-I180 HydrophobicContact CB-CG1 4.31Å; P108-I180 WeakPolarHBondContact O-CD1 3.29Å
109	S	93.2	Very high	92.1	Very high	43 Å²	43	37.2 Å²	37.2	30%	0.301	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-65.3	-23.6	179	66.3	0	0	0	0	114.4	E107 D151	E107-S109 PolarHBondContact O-N 3.25Å; E107-S109 VanDerWaalsContact O-N 3.14Å; S109-D151 VanDerWaalsContact CB-OD1 3.3Å; S109-D151 WeakPolarHBondContact CB-OD1 3Å; S109-D151 WeakPolarHBondContact CB-OD2 3.42Å; S109-D151 PolarHBondContact N-OD1 3.39Å; S109-D151 VanDerWaalsContact OG-CG 3.25Å; S109-D151 PolarHBondContact OG-OD1 3.15Å; S109-D151 PolarHBondContact OG-OD2 3.33Å
110	S	92.5	Very high	92.4	Very high	69 Å²	69	36.1 Å²	36.1	48%	0.483	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-87.2	-11.4	-178.7	74.4	0	0	0	0	113.7	E107 P108	E107-S110 WeakPolarHBondContact O-CB 3.37Å; E107-S110 PolarHBondContact O-N 2.82Å; E107-S110 PolarHBondContact O-OG 3.12Å; P108-S110 PolarHBondContact O-N 3.46Å
111	L	91.1	Very high	92.9	Very high	16 Å²	16	35 Å²	35	8%	0.084	17%	0.174	C	C	.	.	S	Bend	trans	-87.1	159.2	-175.5	-66	172.1	0	0	0	111.6	K106 P108 T115 F117 I180	K106-L111 HydrophobicContact CB-CD2 4.05Å; K106-L111 HydrophobicContact CB-CG 4.43Å; K106-L111 HydrophobicContact CD-CD2 4.17Å; P108-L111 PolarHBondContact O-N 3.27Å; L111-T115 HydrophobicContact CB-CG2 4.1Å; L111-T115 HydrophobicContact CD1-CG2 3.96Å; L111-F117 HydrophobicContact CD1-CD2 3.98Å; L111-F117 HydrophobicContact CD1-CE2 3.2Å; L111-F117 HydrophobicContact CD1-CZ 3.54Å; L111-I180 HydrophobicContact CB-CD1 3.68Å; L111-I180 HydrophobicContact CD1-CD1 3.98Å; L111-I180 HydrophobicContact CG-CD1 4.43Å
112	K	92.2	Very high	93.2	Very high	139 Å²	139	38.6 Å²	38.6	60%	0.604	19%	0.191	S	C	*	.	P	Polyproline II helix	trans	-68.3	147.7	-177.6	-63	-152.9	-161.2	165.1	0	111.5	T76 G114 T115	T76-K112 HydrophobicContact CG2-CB 4.44Å; T76-K112 HydrophobicContact CG2-CD 3.64Å; T76-K112 HydrophobicContact CG2-CG 4.36Å; K112-G114 PolarHBondContact O-N 3.09Å; K112-T115 WeakPolarHBondContact O-CB 3.16Å; K112-T115 PolarHBondContact O-N 3.08Å; K112-T115 VanDerWaalsContact O-N 3.09Å; K112-T115 PolarHBondContact O-OG1 3.27Å
113	I	93.2	Very high	93.5	Very high	92 Å²	92	36.5 Å²	36.5	47%	0.472	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	133.4	172.8	-66	173	0	0	0	109.5	R182	I113-R182 HydrophobicContact CD1-CB 4.13Å; I113-R182 HydrophobicContact CG2-CB 4.37Å
114	G	92.9	Very high	94	Very high	7 Å²	7	31.9 Å²	31.9	7%	0.072	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.1	-8.5	-175.4	0	0	0	0	0	113.6	G75 R85 K112 I180	G75-G114 WeakPolarHBondContact CA-O 3.33Å; R85-G114 PolarHBondContact NH2-O 2.72Å; K112-G114 PolarHBondContact O-N 3.09Å; G114-I180 PolarHBondContact N-O 3.41Å
115	T	94.2	Very high	94.5	Very high	2 Å²	2	35 Å²	35	1%	0.012	19%	0.194	C	C	.	.			trans	-75.2	143	172.5	-73.7	0	0	0	0	111.5	F72 L73 G75 L111 K112 I180 R181	F72-T115 HydrophobicContact CD2-CG2 3.8Å; F72-T115 HydrophobicContact CE2-CG2 3.29Å; F72-T115 HydrophobicContact CZ-CG2 4.27Å; L73-T115 WeakPolarHBondContact O-CA 3.21Å; G75-T115 PolarHBondContact N-OG1 3.33Å; L111-T115 HydrophobicContact CB-CG2 4.1Å; L111-T115 HydrophobicContact CD1-CG2 3.96Å; K112-T115 WeakPolarHBondContact O-CB 3.16Å; K112-T115 PolarHBondContact O-N 3.08Å; K112-T115 VanDerWaalsContact O-N 3.09Å; K112-T115 PolarHBondContact O-OG1 3.27Å; T115-I180 HydrophobicContact CG2-CD1 3.97Å; T115-I180 WeakPolarHBondContact O-CB 3.42Å; T115-I180 PolarHBondContact O-N 3.08Å; T115-R181 PolarHBondContact O-NH1 2.93Å
116	D	95.9	Very high	94.8	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.011	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146	170.1	-58.3	-36.7	0	0	0	110.7	L73 Y118 V178 N179 R181	L73-D116 HydrophobicContact CB-CB 3.78Å; L73-D116 HydrophobicContact CD2-CB 4.23Å; L73-D116 WeakPolarHBondContact CD2-OD2 3.24Å; L73-D116 PolarHBondContact N-O 2.81Å; L73-D116 PolarHBondContact O-N 3.26Å; D116-Y118 HydrophobicContact CB-CD2 4.28Å; D116-Y118 HydrophobicContact CB-CE2 3.51Å; D116-Y118 PolarHBondContact OD2-OH 3.34Å; D116-V178 VanDerWaalsContact CA-O 3.3Å; D116-V178 WeakPolarHBondContact CA-O 3.2Å; D116-N179 WeakPolarHBondContact OD1-CA 3.42Å; D116-N179 WeakPolarHBondContact OD1-CB 3.28Å; D116-N179 PolarHBondContact OD1-ND2 3.21Å; D116-N179 PolarHBondContact OD2-ND2 2.76Å; D116-R181 VanDerWaalsContact CG-NH2 3.27Å; D116-R181 IonicContact OD1-CZ 3.9Å; D116-R181 IonicContact OD1-NH1 3.82Å; D116-R181 PolarHBondContact OD1-NH1 3.28Å; D116-R181 IonicContact OD1-NH2 3.35Å; D116-R181 PolarHBondContact OD1-NH2 2.97Å; D116-R181 IonicContact OD2-CZ 2.85Å; D116-R181 IonicContact OD2-NH1 2.68Å; D116-R181 IonicContact OD2-NH2 3.51Å; D116-R181 PolarHBondContact OD2-NH2 3.26Å
117	F	96.4	Very high	95	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.8	159.6	-72.5	-59.8	0	0	0	110.2	L17 L70 Y71 F72 M105 L111 W154 V177 V178	L17-F117 HydrophobicContact CD1-CE1 4.29Å; L17-F117 HydrophobicContact CD2-CD1 4.37Å; L17-F117 HydrophobicContact CD2-CE1 3.26Å; L17-F117 HydrophobicContact CD2-CZ 3.5Å; L17-F117 HydrophobicContact CG-CE1 4.32Å; L70-F117 HydrophobicContact CD1-CB 4.3Å; L70-F117 HydrophobicContact CD1-CD1 3.97Å; L70-F117 HydrophobicContact CD1-CG 4.37Å; L70-F117 HydrophobicContact CD2-CD1 4.48Å; L70-F117 HydrophobicContact CD2-CE1 4.31Å; L70-F117 HydrophobicContact CG-CD1 4.42Å; Y71-F117 WeakPolarHBondContact O-CA 3.29Å; F72-F117 HydrophobicContact CB-CD1 4.37Å; F72-F117 HydrophobicContact CB-CE1 4.46Å; F72-F117 HydrophobicContact CD2-CD1 4.16Å; F72-F117 HydrophobicContact CD2-CE1 4.01Å; M105-F117 HydrophobicContact CE-CD2 4.21Å; M105-F117 HydrophobicContact CE-CE1 4.27Å; M105-F117 HydrophobicContact CE-CE2 3.97Å; M105-F117 HydrophobicContact CE-CG 4.46Å; M105-F117 HydrophobicContact CE-CZ 4.01Å; L111-F117 HydrophobicContact CD1-CD2 3.98Å; L111-F117 HydrophobicContact CD1-CE2 3.2Å; L111-F117 HydrophobicContact CD1-CZ 3.54Å; F117-W154 HydrophobicContact CB-CH2 4.08Å; F117-W154 HydrophobicContact CB-CZ2 3.63Å; F117-W154 HydrophobicContact CD2-CZ2 4.37Å; F117-W154 HydrophobicContact CG-CZ2 4.33Å; F117-V177 VanDerWaalsContact O-CA 3.3Å; F117-V177 WeakPolarHBondContact O-CA 3.48Å; F117-V177 WeakPolarHBondContact O-CG1 3.4Å; F117-V178 HydrophobicContact CB-CG1 3.68Å; F117-V178 HydrophobicContact CD2-CG1 3.87Å; F117-V178 HydrophobicContact CG-CG1 4.26Å; F117-V178 PolarHBondContact N-O 3.32Å; F117-V178 VanDerWaalsContact N-O 3.1Å; F117-V178 PolarHBondContact O-N 3.41Å
118	Y	97.4	Very high	94.9	Very high	13 Å²	13	38 Å²	38	5%	0.051	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.3	172.5	-56	-97.3	0	0	0	108.8	L70 Y71 L73 W82 L86 D116 F120 P126 F176 V177	L70-Y118 CarbonylContact C-O 3.55Å; L70-Y118 WeakPolarHBondContact CA-O 3.32Å; Y71-Y118 PolarHBondContact N-O 3.43Å; Y71-Y118 PolarHBondContact O-N 3.46Å; L73-Y118 HydrophobicContact CB-CE2 4.11Å; W82-Y118 HydrophobicContact CZ2-CE2 4.45Å; L86-Y118 HydrophobicContact CD1-CD2 3.72Å; L86-Y118 HydrophobicContact CD1-CE2 3.71Å; D116-Y118 HydrophobicContact CB-CD2 4.28Å; D116-Y118 HydrophobicContact CB-CE2 3.51Å; D116-Y118 PolarHBondContact OD2-OH 3.34Å; Y118-F120 AromaticContact CD1-CE2 3.83Å; Y118-F120 HydrophobicContact CD1-CE2 3.83Å; Y118-F120 HydrophobicContact CD1-CZ 4.42Å; Y118-F120 HydrophobicContact CG-CE2 4.35Å; Y118-P126 HydrophobicContact CD1-CB 3.37Å; Y118-P126 HydrophobicContact CD1-CG 4.26Å; Y118-P126 HydrophobicContact CD2-CB 4.41Å; Y118-P126 HydrophobicContact CD2-CG 4.49Å; Y118-P126 HydrophobicContact CE1-CB 4.04Å; Y118-P126 HydrophobicContact CG-CB 3.6Å; Y118-P126 HydrophobicContact CG-CG 4.06Å; Y118-F176 CarbonylContact C-O 3.57Å; Y118-F176 WeakPolarHBondContact CA-O 3.49Å; Y118-V177 HydrophobicContact CD1-CB 4.28Å; Y118-V177 HydrophobicContact CD1-CG1 3.83Å; Y118-V177 HydrophobicContact CD1-CG2 3.52Å; Y118-V177 HydrophobicContact CE1-CG1 3.7Å; Y118-V177 HydrophobicContact CE1-CG2 3.94Å; Y118-V177 HydrophobicContact CG-CG2 4.48Å
119	F	97.8	Very high	94.8	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	95.1	174.6	-166.2	-114.8	0	0	0	109	W68 C69 L70 V92 F98 L101 W154 L158 A161 V162 G175 F176	W68-F119 HydrophobicContact CB-CD1 4.11Å; W68-F119 HydrophobicContact CB-CD2 4.27Å; W68-F119 HydrophobicContact CB-CE1 3.42Å; W68-F119 VanDerWaalsContact CB-CE1 3.42Å; W68-F119 HydrophobicContact CB-CE2 3.61Å; W68-F119 HydrophobicContact CB-CZ 3.15Å; W68-F119 HydrophobicContact CD2-CD1 4.04Å; W68-F119 AromaticContact CD2-CE1 3.69Å; W68-F119 HydrophobicContact CD2-CE1 3.69Å; W68-F119 HydrophobicContact CD2-CZ 4.37Å; W68-F119 AromaticContact CE3-CD1 3.75Å; W68-F119 HydrophobicContact CE3-CD1 3.75Å; W68-F119 AromaticContact CE3-CE1 3.91Å; W68-F119 HydrophobicContact CE3-CE1 3.91Å; W68-F119 HydrophobicContact CE3-CG 4.5Å; W68-F119 HydrophobicContact CG-CD1 4.22Å; W68-F119 AromaticContact CG-CE1 3.48Å; W68-F119 HydrophobicContact CG-CE1 3.48Å; W68-F119 VanDerWaalsContact CG-CE1 3.48Å; W68-F119 AromaticContact CG-CZ 3.71Å; W68-F119 HydrophobicContact CG-CZ 3.71Å; C69-F119 CarbonylContact O-C 3.49Å; C69-F119 WeakPolarHBondContact O-CA 3.3Å; L70-F119 HydrophobicContact CB-CD2 4.24Å; L70-F119 HydrophobicContact CD1-CD2 4.26Å; V92-F119 HydrophobicContact CG2-CE2 4.11Å; V92-F119 HydrophobicContact CG2-CZ 3.87Å; F98-F119 HydrophobicContact CD2-CZ 4.33Å; F98-F119 HydrophobicContact CE2-CZ 4.44Å; L101-F119 HydrophobicContact CD2-CE2 4.1Å; F119-W154 HydrophobicContact CB-CH2 4.11Å; F119-L158 HydrophobicContact CB-CD2 3.59Å; F119-L158 HydrophobicContact CD1-CD2 3.48Å; F119-L158 VanDerWaalsContact CD1-CD2 3.48Å; F119-L158 HydrophobicContact CD2-CD2 4.07Å; F119-L158 HydrophobicContact CE1-CD2 4.07Å; F119-L158 HydrophobicContact CG-CD2 3.45Å; F119-L158 VanDerWaalsContact CG-CD2 3.45Å; F119-A161 HydrophobicContact CD1-CB 4.1Å; F119-A161 HydrophobicContact CE1-CB 3.97Å; F119-V162 HydrophobicContact CE1-CG1 3.94Å; F119-V162 HydrophobicContact CZ-CG1 3.95Å; F119-G175 CarbonylContact O-C 3.48Å; F119-G175 WeakPolarHBondContact O-CA 3.45Å; F119-F176 HydrophobicContact CB-CB 4.43Å; F119-F176 HydrophobicContact CD1-CD2 4.42Å; F119-F176 PolarHBondContact N-O 3.48Å; F119-F176 PolarHBondContact O-N 2.91Å
120	F	98.4	Very high	94.8	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	152	-168.6	-84.8	-116.2	0	0	0	110.8	W68 C69 Y71 Y118 I124 P126 C174 V177 W190	W68-F120 CarbonylContact C-O 3.58Å; W68-F120 WeakPolarHBondContact CA-O 3.18Å; C69-F120 PolarHBondContact N-O 3.13Å; C69-F120 PolarHBondContact O-N 3.25Å; Y71-F120 HydrophobicContact CE2-CB 4.2Å; Y118-F120 AromaticContact CD1-CE2 3.83Å; Y118-F120 HydrophobicContact CD1-CE2 3.83Å; Y118-F120 HydrophobicContact CD1-CZ 4.42Å; Y118-F120 HydrophobicContact CG-CE2 4.35Å; F120-I124 HydrophobicContact CD1-CB 4.41Å; F120-I124 HydrophobicContact CD1-CG2 3.9Å; F120-P126 HydrophobicContact CD1-CB 4.28Å; F120-P126 HydrophobicContact CD2-CB 3.91Å; F120-P126 HydrophobicContact CE1-CB 4.18Å; F120-P126 HydrophobicContact CE2-CB 3.84Å; F120-P126 HydrophobicContact CG-CB 4.16Å; F120-P126 HydrophobicContact CZ-CB 3.96Å; F120-C174 HydrophobicContact CD1-CB 4.31Å; F120-C174 HydrophobicContact CE1-CB 4.14Å; F120-V177 HydrophobicContact CE2-CG2 3.69Å; F120-V177 HydrophobicContact CZ-CG2 4.04Å; F120-W190 HydrophobicContact CE1-CB 4.29Å; F120-W190 HydrophobicContact CE1-CD2 4.23Å; F120-W190 AromaticContact CE1-CE3 3.96Å; F120-W190 HydrophobicContact CE1-CE3 3.96Å; F120-W190 HydrophobicContact CE1-CG 4.41Å; F120-W190 HydrophobicContact CZ-CB 4.09Å; F120-W190 AromaticContact CZ-CD2 3.74Å; F120-W190 HydrophobicContact CZ-CD2 3.74Å; F120-W190 AromaticContact CZ-CE3 3.87Å; F120-W190 HydrophobicContact CZ-CE3 3.87Å; F120-W190 AromaticContact CZ-CG 3.85Å; F120-W190 HydrophobicContact CZ-CG 3.85Å
121	K	98.1	Very high	95	Very high	7 Å²	7	42.1 Å²	42.1	3%	0.03	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	145	172.6	-66.9	175.4	178.7	168.1	0	110.8	Y66 T67 W68 G123 I124 S170 I173 C174	Y66-K121 HydrophobicContact CD1-CD 3.87Å; Y66-K121 HydrophobicContact CE1-CD 4.29Å; Y66-K121 HydrophobicContact CG-CD 4.01Å; Y66-K121 HydrophobicContact CG-CG 4.35Å; T67-K121 WeakPolarHBondContact O-CA 3.26Å; W68-K121 HydrophobicContact CD2-CG 4.34Å; W68-K121 HydrophobicContact CE3-CG 3.98Å; W68-K121 HydrophobicContact CH2-CD 4.34Å; W68-K121 HydrophobicContact CH2-CG 3.73Å; W68-K121 HydrophobicContact CZ2-CG 4.14Å; W68-K121 HydrophobicContact CZ3-CG 3.66Å; K121-G123 PolarHBondContact O-N 2.81Å; K121-I124 HydrophobicContact CB-CD1 4Å; K121-I124 HydrophobicContact CB-CG1 4.39Å; K121-I124 HydrophobicContact CD-CD1 4.49Å; K121-I124 PolarHBondContact O-N 2.99Å; K121-S170 PolarHBondContact NZ-O 3.1Å; K121-I173 WeakPolarHBondContact CE-O 3.14Å; K121-I173 PolarHBondContact NZ-O 3.08Å; K121-C174 PolarHBondContact N-O 2.81Å
122	Q	96.2	Very high	95.3	Very high	78 Å²	78	44.2 Å²	44.2	36%	0.364	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	136.2	173.1	179.2	63.9	51	0	0	110.2	T67 C69 I124	T67-Q122 HydrophobicContact CG2-CB 3.9Å; T67-Q122 HydrophobicContact CG2-CG 4.39Å; T67-Q122 PolarHBondContact O-N 2.9Å; C69-Q122 PolarHBondContact SG-OE1 3.06Å; Q122-I124 VanDerWaalsContact C-N 3.31Å
123	G	95.4	Very high	95.5	Very high	54 Å²	54	37.6 Å²	37.6	56%	0.557	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	0.8	-175.2	0	0	0	0	0	115.2	K121 H130	K121-G123 PolarHBondContact O-N 2.81Å; G123-H130 PolarHBondContact O-CE1 2.89Å; G123-H130 PolarHBondContact O-NE2 2.89Å
124	I	97.4	Very high	95.6	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.026	19%	0.19	C	C	.	.			trans	-114.4	114	172.2	-50.6	179.8	0	0	0	109.2	F120 K121 Q122 Q132 C174	F120-I124 HydrophobicContact CD1-CB 4.41Å; F120-I124 HydrophobicContact CD1-CG2 3.9Å; K121-I124 HydrophobicContact CB-CD1 4Å; K121-I124 HydrophobicContact CB-CG1 4.39Å; K121-I124 HydrophobicContact CD-CD1 4.49Å; K121-I124 PolarHBondContact O-N 2.99Å; Q122-I124 VanDerWaalsContact C-N 3.31Å; I124-Q132 HydrophobicContact CD1-CB 4.18Å; I124-Q132 HydrophobicContact CD1-CG 4.45Å; I124-Q132 HydrophobicContact CG1-CB 4.22Å; I124-Q132 HydrophobicContact CG1-CG 4.23Å; I124-Q132 HydrophobicContact CG2-CB 4.09Å; I124-C174 HydrophobicContact CD1-CB 4.26Å; I124-C174 HydrophobicContact CG2-CB 4.31Å
125	L	95.7	Very high	95.7	Very high	67 Å²	67	43 Å²	43	35%	0.351	21%	0.207	S	C	.	.			trans	-75.3	143.6	173	-60.8	176	0	0	0	110.3	Y71 R127 H130 N133	Y71-L125 HydrophobicContact CE1-CD2 4.46Å; L125-R127 HydrophobicContact CB-CG 4.28Å; L125-R127 PolarHBondContact O-N 3.36Å; L125-H130 PolarHBondContact N-CD2 3.26Å; L125-H130 PolarHBondContact N-NE2 3.04Å; L125-N133 PolarHBondContact O-ND2 3.45Å
126	P	95.8	Very high	95.8	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	21%	0.207	C	C	.	.	S	Bend	trans	-77.1	48.2	178	34.3	-37.8	0	0	0	112.4	Y71 W82 L86 Y118 F120	Y71-P126 HydrophobicContact CD1-CG 4.27Å; Y71-P126 HydrophobicContact CD2-CG 4.01Å; Y71-P126 HydrophobicContact CE2-CG 4.4Å; Y71-P126 HydrophobicContact CG-CG 3.96Å; W82-P126 WeakPolarHBondContact CH2-O 3.47Å; L86-P126 HydrophobicContact CD1-CG 4.34Å; L86-P126 HydrophobicContact CD2-CG 3.73Å; Y118-P126 HydrophobicContact CD1-CB 3.37Å; Y118-P126 HydrophobicContact CD1-CG 4.26Å; Y118-P126 HydrophobicContact CD2-CB 4.41Å; Y118-P126 HydrophobicContact CD2-CG 4.49Å; Y118-P126 HydrophobicContact CE1-CB 4.04Å; Y118-P126 HydrophobicContact CG-CB 3.6Å; Y118-P126 HydrophobicContact CG-CG 4.06Å; F120-P126 HydrophobicContact CD1-CB 4.28Å; F120-P126 HydrophobicContact CD2-CB 3.91Å; F120-P126 HydrophobicContact CE1-CB 4.18Å; F120-P126 HydrophobicContact CE2-CB 3.84Å; F120-P126 HydrophobicContact CG-CB 4.16Å; F120-P126 HydrophobicContact CZ-CB 3.96Å
127	R	93.8	Very high	95.9	Very high	76 Å²	76	42.8 Å²	42.8	29%	0.287	21%	0.206	S	C	.	.			trans	-119.8	143	179.2	-53.7	-169.5	-66	127.7	6.3	109.7	W82 L125 D129 H130 N133	W82-R127 HydrophobicContact CH2-CG 3.85Å; W82-R127 HydrophobicContact CZ3-CG 3.71Å; L125-R127 HydrophobicContact CB-CG 4.28Å; L125-R127 PolarHBondContact O-N 3.36Å; R127-D129 VanDerWaalsContact C-N 3.28Å; R127-D129 WeakPolarHBondContact CB-OD1 3.46Å; R127-D129 IonicContact CZ-OD1 3.49Å; R127-D129 IonicContact CZ-OD2 3.74Å; R127-D129 IonicContact NE-OD1 3.48Å; R127-D129 IonicContact NH1-OD1 3.63Å; R127-D129 PolarHBondContact NH1-OD1 2.81Å; R127-D129 IonicContact NH1-OD2 2.64Å; R127-D129 PolarHBondContact NH1-OD2 2.88Å; R127-D129 IonicContact NH2-OD2 3.4Å; R127-D129 PolarHBondContact O-N 2.8Å; R127-H130 VanDerWaalsContact O-CB 3.32Å; R127-H130 WeakPolarHBondContact O-CB 3.45Å; R127-H130 PolarHBondContact O-N 3.45Å; R127-N133 WeakPolarHBondContact O-CB 3.35Å; R127-N133 PolarHBondContact O-ND2 3.44Å
128	W	91.7	Very high	96	Very high	123 Å²	123	44.7 Å²	44.7	47%	0.466	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-30.8	-176	61.5	-94.3	0	0	0	111.9	H130 R134 H222 E226	W128-H130 VanDerWaalsContact C-N 3.29Å; W128-H130 PolarHBondContact O-N 3.19Å; W128-R134 WeakPolarHBondContact O-CA 3.39Å; W128-R134 PolarHBondContact O-N 3.21Å; W128-H222 HydrophobicContact CB-CB 4.17Å; W128-E226 WeakPolarHBondContact CH2-OE1 3.5Å; W128-E226 WeakPolarHBondContact CZ2-OE1 3.46Å; W128-E226 VanDerWaalsContact CZ3-CD 3.45Å; W128-E226 VanDerWaalsContact CZ3-OE1 3.22Å; W128-E226 WeakPolarHBondContact CZ3-OE1 3.5Å; W128-E226 WeakPolarHBondContact CZ3-OE2 3.29Å
129	D	91.8	Very high	96	Very high	63 Å²	63	44 Å²	44	34%	0.337	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.5	-179.8	66.6	-33.9	0	0	0	113.4	R127 E131	R127-D129 VanDerWaalsContact C-N 3.28Å; R127-D129 WeakPolarHBondContact CB-OD1 3.46Å; R127-D129 IonicContact CZ-OD1 3.49Å; R127-D129 IonicContact CZ-OD2 3.74Å; R127-D129 IonicContact NE-OD1 3.48Å; R127-D129 IonicContact NH1-OD1 3.63Å; R127-D129 PolarHBondContact NH1-OD1 2.81Å; R127-D129 IonicContact NH1-OD2 2.64Å; R127-D129 PolarHBondContact NH1-OD2 2.88Å; R127-D129 IonicContact NH2-OD2 3.4Å; R127-D129 PolarHBondContact O-N 2.8Å; D129-E131 PolarHBondContact O-N 2.89Å
130	H	94.2	Very high	96	Very high	24 Å²	24	44.6 Å²	44.6	11%	0.111	21%	0.214	C	C	.	.	S	Bend	trans	-58	138.5	178.1	-167.8	-89.1	0	0	0	110.5	G123 L125 R127 W128 Q132 N133 R134	G123-H130 PolarHBondContact O-CE1 2.89Å; G123-H130 PolarHBondContact O-NE2 2.89Å; L125-H130 PolarHBondContact N-CD2 3.26Å; L125-H130 PolarHBondContact N-NE2 3.04Å; R127-H130 VanDerWaalsContact O-CB 3.32Å; R127-H130 WeakPolarHBondContact O-CB 3.45Å; R127-H130 PolarHBondContact O-N 3.45Å; W128-H130 VanDerWaalsContact C-N 3.29Å; W128-H130 PolarHBondContact O-N 3.19Å; H130-Q132 PolarHBondContact ND1-N 2.84Å; H130-Q132 PolarHBondContact O-N 3.19Å; H130-N133 HydrophobicContact CB-CB 4.35Å; H130-N133 PolarHBondContact O-N 3.22Å; H130-R134 PolarHBondContact O-N 2.8Å
131	E	96.4	Very high	96	Very high	114 Å²	114	44.6 Å²	44.6	53%	0.533	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-33.4	-175.3	47.6	151.6	-134.1	0	0	114.3	D129	D129-E131 PolarHBondContact O-N 2.89Å
132	Q	96.9	Very high	95.9	Very high	60 Å²	60	47.3 Å²	47.3	28%	0.28	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-11	178.9	-58.8	-56.9	-33.1	0	0	114.4	I124 H130 C174 R192	I124-Q132 HydrophobicContact CD1-CB 4.18Å; I124-Q132 HydrophobicContact CD1-CG 4.45Å; I124-Q132 HydrophobicContact CG1-CB 4.22Å; I124-Q132 HydrophobicContact CG1-CG 4.23Å; I124-Q132 HydrophobicContact CG2-CB 4.09Å; H130-Q132 PolarHBondContact ND1-N 2.84Å; H130-Q132 PolarHBondContact O-N 3.19Å; Q132-C174 PolarHBondContact O-SG 2.93Å; Q132-R192 VanDerWaalsContact CG-NH1 3.26Å; Q132-R192 VanDerWaalsContact O-CA 3.29Å; Q132-R192 WeakPolarHBondContact O-CA 3.19Å; Q132-R192 WeakPolarHBondContact O-CG 3.12Å
133	N	96.9	Very high	95.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-31.2	-179.3	-61.4	-29.3	0	0	0	112.4	L125 R127 H130 N135 G136 C174 W190 H222	L125-N133 PolarHBondContact O-ND2 3.45Å; R127-N133 WeakPolarHBondContact O-CB 3.35Å; R127-N133 PolarHBondContact O-ND2 3.44Å; H130-N133 HydrophobicContact CB-CB 4.35Å; H130-N133 PolarHBondContact O-N 3.22Å; N133-N135 VanDerWaalsContact C-N 3.33Å; N133-N135 PolarHBondContact O-N 2.91Å; N133-G136 VanDerWaalsContact O-CA 3.24Å; N133-G136 WeakPolarHBondContact O-CA 3.4Å; N133-G136 PolarHBondContact O-N 3.47Å; N133-C174 VanDerWaalsContact OD1-CB 3.28Å; N133-C174 WeakPolarHBondContact OD1-CB 3.3Å; N133-C174 PolarHBondContact OD1-SG 3.36Å; N133-W190 HydrophobicContact CB-CE3 4.17Å; N133-W190 HydrophobicContact CB-CZ3 4.29Å; N133-H222 PolarHBondContact O-CD2 2.86Å
134	R	94.5	Very high	95.6	Very high	130 Å²	130	44.2 Å²	44.2	49%	0.491	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-41.8	-170.1	63.1	-178.5	178.1	-179.2	0.1	115.1	W128 H130 G136	W128-R134 WeakPolarHBondContact O-CA 3.39Å; W128-R134 PolarHBondContact O-N 3.21Å; H130-R134 PolarHBondContact O-N 2.8Å; R134-G136 PolarHBondContact O-N 2.84Å
135	N	95.4	Very high	95.2	Very high	82 Å²	82	51.9 Å²	51.9	44%	0.439	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	3.1	179.3	-61	-22.7	0	0	0	112.9	N133 R192 N193 G194	N133-N135 VanDerWaalsContact C-N 3.33Å; N133-N135 PolarHBondContact O-N 2.91Å; N135-R192 CarbonylContact C-O 3.51Å; N135-N193 WeakPolarHBondContact O-CA 3.07Å; N135-G194 PolarHBondContact O-N 2.82Å
136	G	96.7	Very high	95	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.251	C	S	.	.			trans	-103.4	-159.1	-170.1	0	0	0	0	0	113.2	N133 R134 T191 R192 M221 H222	N133-G136 VanDerWaalsContact O-CA 3.24Å; N133-G136 WeakPolarHBondContact O-CA 3.4Å; N133-G136 PolarHBondContact O-N 3.47Å; R134-G136 PolarHBondContact O-N 2.84Å; G136-T191 WeakPolarHBondContact CA-O 3.38Å; G136-R192 PolarHBondContact N-O 2.8Å; G136-M221 WeakPolarHBondContact O-CE 2.8Å; G136-H222 VanDerWaalsContact C-CD2 3.44Å; G136-H222 PolarHBondContact O-N 2.85Å
137	G	97.2	Very high	94.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	-171.5	-178.6	0	0	0	0	0	109.8	W190 T191 Y219 E220 H222	G137-W190 WeakPolarHBondContact O-CA 3.48Å; G137-T191 PolarHBondContact N-O 2.94Å; G137-T191 PolarHBondContact O-N 3.04Å; G137-Y219 WeakPolarHBondContact CA-OH 3.37Å; G137-Y219 PolarHBondContact N-OH 2.68Å; G137-E220 CarbonylContact C-O 3.5Å; G137-E220 WeakPolarHBondContact CA-O 3.23Å; G137-H222 VanDerWaalsContact CA-CD2 3.44Å; G137-H222 WeakPolarHBondContact CA-CD2 3.17Å; G137-H222 WeakPolarHBondContact CA-NE2 3.4Å; G137-H222 PolarHBondContact N-CD2 2.75Å; G137-H222 VanDerWaalsContact N-CD2 3.3Å; G137-H222 PolarHBondContact O-NE2 2.86Å
138	R	97.9	Very high	94.7	Very high	40 Å²	40	67.4 Å²	67.4	15%	0.151	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.3	-175.5	60.1	-177.6	-176.9	-153.5	-6.8	111.3	I140 C188 V189 W190 Y219 E220 C225	R138-I140 HydrophobicContact CG-CD1 4.16Å; R138-I140 HydrophobicContact CG-CG1 3.9Å; R138-C188 HydrophobicContact CB-CB 4.21Å; R138-V189 CarbonylContact C-O 3.51Å; R138-V189 VanDerWaalsContact CA-O 3.29Å; R138-V189 WeakPolarHBondContact CA-O 3.48Å; R138-W190 HydrophobicContact CB-CG 4.25Å; R138-Y219 WeakPolarHBondContact O-CA 3.36Å; R138-E220 IonicContact CZ-OE2 3.11Å; R138-E220 PolarHBondContact N-O 3.03Å; R138-E220 IonicContact NE-OE2 2.85Å; R138-E220 IonicContact NH2-OE2 2.84Å; R138-E220 PolarHBondContact NH2-OE2 2.94Å; R138-E220 PolarHBondContact O-N 3.34Å; R138-C225 PolarHBondContact NH2-SG 2.82Å
139	W	98.4	Very high	94.9	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	133.1	157.6	-77.3	108.1	0	0	0	108.5	C188 V189 T200 L201 G204 I207 F217 T218 Y219 V239	W139-C188 CarbonylContact O-C 3.49Å; W139-C188 WeakPolarHBondContact O-CA 3.5Å; W139-C188 WeakPolarHBondContact O-CB 3.39Å; W139-V189 HydrophobicContact CB-CB 4.35Å; W139-V189 PolarHBondContact N-O 2.99Å; W139-V189 PolarHBondContact O-N 3.23Å; W139-T200 HydrophobicContact CZ2-CG2 3.9Å; W139-T200 VanDerWaalsContact CZ2-O 3.26Å; W139-T200 WeakPolarHBondContact CZ2-O 3.47Å; W139-T200 PolarHBondContact NE1-O 2.89Å; W139-T200 VanDerWaalsContact NE1-O 3.17Å; W139-L201 HydrophobicContact CH2-CD2 4.37Å; W139-G204 VanDerWaalsContact CE2-CA 3.41Å; W139-I207 HydrophobicContact CB-CD1 4.1Å; W139-I207 HydrophobicContact CG-CD1 3.96Å; W139-F217 HydrophobicContact CE3-CB 3.82Å; W139-F217 HydrophobicContact CZ3-CB 4.18Å; W139-T218 CarbonylContact C-O 3.55Å; W139-T218 WeakPolarHBondContact CA-O 3.28Å; W139-Y219 AromaticContact CD1-CD2 3.73Å; W139-Y219 AromaticContact CD2-CD2 3.7Å; W139-Y219 HydrophobicContact CD2-CD2 3.7Å; W139-Y219 HydrophobicContact CD2-CG 4.37Å; W139-Y219 AromaticContact CE2-CD2 3.62Å; W139-Y219 HydrophobicContact CE3-CD2 4.32Å; W139-Y219 AromaticContact CG-CD2 3.78Å; W139-Y219 HydrophobicContact CG-CD2 3.78Å; W139-Y219 HydrophobicContact CG-CE2 4.47Å; W139-Y219 HydrophobicContact CZ2-CD2 4.18Å; W139-Y219 HydrophobicContact CZ2-CG 4.42Å; W139-Y219 AromaticContact NE1-CD2 3.64Å; W139-V239 HydrophobicContact CE3-CG2 4.16Å; W139-V239 HydrophobicContact CH2-CB 4.25Å; W139-V239 HydrophobicContact CH2-CG1 3.67Å; W139-V239 HydrophobicContact CH2-CG2 3.78Å; W139-V239 HydrophobicContact CZ2-CG1 4.25Å; W139-V239 HydrophobicContact CZ2-CG2 4.41Å; W139-V239 HydrophobicContact CZ3-CB 4.42Å; W139-V239 HydrophobicContact CZ3-CG1 4.31Å; W139-V239 HydrophobicContact CZ3-CG2 3.63Å
140	I	97.8	Very high	95.2	Very high	13 Å²	13	61.4 Å²	61.4	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.5	-177.6	-60	175.7	0	0	0	108.7	R138 K186 F217 T218 E220	R138-I140 HydrophobicContact CG-CD1 4.16Å; R138-I140 HydrophobicContact CG-CG1 3.9Å; I140-K186 HydrophobicContact CG2-CB 4.1Å; I140-K186 HydrophobicContact CG2-CD 3.93Å; I140-F217 WeakPolarHBondContact O-CA 3.39Å; I140-T218 PolarHBondContact N-O 3.46Å; I140-T218 PolarHBondContact O-N 2.92Å; I140-E220 HydrophobicContact CD1-CB 4.26Å; I140-E220 HydrophobicContact CD1-CG 3.7Å; I140-E220 WeakPolarHBondContact CD1-OE2 3.33Å
141	I	97.8	Very high	95.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	109.2	174.9	-40.2	174	0	0	0	107.5	M143 K186 L187 I207 L211 L215 F217	I141-M143 HydrophobicContact CB-CE 3.77Å; I141-M143 HydrophobicContact CG2-CE 3.19Å; I141-M143 PolarHBondContact O-N 3.06Å; I141-K186 WeakPolarHBondContact O-CA 3.32Å; I141-L187 HydrophobicContact CB-CB 4.22Å; I141-L187 HydrophobicContact CD1-CB 4.35Å; I141-L187 PolarHBondContact N-O 3.39Å; I141-L187 PolarHBondContact O-N 2.97Å; I141-I207 HydrophobicContact CD1-CG2 4.3Å; I141-L211 HydrophobicContact CD1-CD1 3.4Å; I141-L211 VanDerWaalsContact CD1-CD1 3.4Å; I141-L215 HydrophobicContact CG2-CD1 3.96Å; I141-F217 HydrophobicContact CB-CD1 4.31Å; I141-F217 HydrophobicContact CB-CE1 4.25Å; I141-F217 HydrophobicContact CD1-CE1 4Å; I141-F217 HydrophobicContact CD1-CE2 3.98Å; I141-F217 HydrophobicContact CD1-CZ 3.7Å; I141-F217 HydrophobicContact CG1-CD1 3.9Å; I141-F217 HydrophobicContact CG1-CD2 4.28Å; I141-F217 HydrophobicContact CG1-CE1 3.84Å; I141-F217 HydrophobicContact CG1-CE2 4.21Å; I141-F217 HydrophobicContact CG1-CG 4.14Å; I141-F217 HydrophobicContact CG1-CZ 4Å; I141-F217 HydrophobicContact CG2-CD1 3.82Å; I141-F217 HydrophobicContact CG2-CE1 3.49Å; I141-F217 VanDerWaalsContact CG2-CE1 3.49Å; I141-F217 HydrophobicContact CG2-CZ 4.24Å
142	P	96.3	Very high	95.3	Very high	64 Å²	64	60 Å²	60	42%	0.416	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	129	-175.5	27.7	-33.6	0	0	0	111.5
143	M	96.4	Very high	95.3	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	27%	0.27	C	S	.	.			trans	-114.3	16.8	-177.2	-65.6	-61.5	127.4	0	0	113.2	I141 N145 R146 M150 L153 S185 L187 L215	I141-M143 HydrophobicContact CB-CE 3.77Å; I141-M143 HydrophobicContact CG2-CE 3.19Å; I141-M143 PolarHBondContact O-N 3.06Å; M143-N145 PolarHBondContact O-N 3.04Å; M143-R146 PolarHBondContact O-N 3.17Å; M143-M150 HydrophobicContact CB-CB 4.12Å; M143-M150 HydrophobicContact CB-CG 4.23Å; M143-M150 HydrophobicContact CB-SD 4.03Å; M143-M150 HydrophobicContact CG-CB 3.98Å; M143-M150 HydrophobicContact CG-CG 4.01Å; M143-M150 HydrophobicContact CG-SD 4.36Å; M143-M150 HydrophobicContact SD-CB 4.05Å; M143-L153 HydrophobicContact CE-CD1 3.72Å; M143-L153 HydrophobicContact SD-CD1 4.22Å; M143-S185 WeakPolarHBondContact CA-O 3.07Å; M143-S185 PolarHBondContact N-O 3.26Å; M143-L187 HydrophobicContact CE-CD1 4.03Å; M143-L187 HydrophobicContact CG-CD1 4.2Å; M143-L187 HydrophobicContact CG-CG 3.95Å; M143-L187 HydrophobicContact SD-CD1 4.11Å; M143-L215 HydrophobicContact CE-CD1 4.21Å
144	D	89.7	Confident	95.3	Very high	64 Å²	64	57.5 Å²	57.5	34%	0.342	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	124.6	178.6	-78.8	-14.3	0	0	0	111.5	R146 R184 S185	D144-R146 WeakPolarHBondContact O-CG 3.11Å; D144-R146 PolarHBondContact O-N 3.24Å; D144-R184 WeakPolarHBondContact OD1-CA 3.08Å; D144-R184 PolarHBondContact OD1-N 3.42Å; D144-R184 WeakPolarHBondContact OD2-CA 3.44Å; D144-R184 PolarHBondContact OD2-N 3.09Å; D144-R184 VanDerWaalsContact OD2-N 3.08Å; D144-S185 PolarHBondContact OD1-N 2.88Å
145	N	87.2	Confident	95.4	Very high	167 Å²	167	53.1 Å²	53.1	89%	0.893	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	23.1	-175.7	-54.1	-35.3	0	0	0	114.7	M143	M143-N145 PolarHBondContact O-N 3.04Å
146	R	92.3	Very high	95.5	Very high	119 Å²	119	52.1 Å²	52.1	45%	0.449	25%	0.246	S	C	.	.			trans	-125.9	41.3	-176.3	-64.1	174.9	-169.6	-135.1	5.7	112.7	M143 D144 R148 L149 M150	M143-R146 PolarHBondContact O-N 3.17Å; D144-R146 WeakPolarHBondContact O-CG 3.11Å; D144-R146 PolarHBondContact O-N 3.24Å; R146-R148 PolarHBondContact O-N 2.95Å; R146-L149 HydrophobicContact CB-CB 4.18Å; R146-L149 HydrophobicContact CB-CD2 4.46Å; R146-L149 WeakPolarHBondContact O-CB 2.88Å; R146-L149 PolarHBondContact O-N 2.71Å; R146-M150 PolarHBondContact O-N 3.5Å
147	Q	90.6	Very high	95.5	Very high	125 Å²	125	52.1 Å²	52.1	58%	0.584	25%	0.246	S	C	*	.	H	α-helix	trans	-55.2	-46.7	-172.8	-68	179.5	9.3	0	0	113.7	L149 M150 D151	Q147-L149 VanDerWaalsContact C-N 3.29Å; Q147-L149 PolarHBondContact O-N 3.32Å; Q147-M150 VanDerWaalsContact O-CB 3.3Å; Q147-M150 WeakPolarHBondContact O-CB 3.45Å; Q147-M150 PolarHBondContact O-N 2.95Å; Q147-M150 VanDerWaalsContact O-N 3.1Å; Q147-D151 PolarHBondContact O-N 3.07Å; Q147-D151 VanDerWaalsContact O-N 3.12Å
148	R	93	Very high	95.5	Very high	225 Å²	225	52.2 Å²	52.2	85%	0.849	25%	0.247	S	C	*	.	H	α-helix	trans	-61	-38.5	177.4	-66.4	-176.1	-178.5	178.4	-0	112.6	R146 T152	R146-R148 PolarHBondContact O-N 2.95Å; R148-T152 PolarHBondContact O-N 3.47Å; R148-T152 PolarHBondContact O-OG1 2.69Å
149	L	96.1	Very high	95.5	Very high	57 Å²	57	54.2 Å²	54.2	30%	0.298	26%	0.259	S	S	.	.	H	α-helix	trans	-70.4	-36.5	176.3	-178.4	64.3	0	0	0	111	R146 Q147 D151 T152 L153 L215	R146-L149 HydrophobicContact CB-CB 4.18Å; R146-L149 HydrophobicContact CB-CD2 4.46Å; R146-L149 WeakPolarHBondContact O-CB 2.88Å; R146-L149 PolarHBondContact O-N 2.71Å; Q147-L149 VanDerWaalsContact C-N 3.29Å; Q147-L149 PolarHBondContact O-N 3.32Å; L149-D151 VanDerWaalsContact C-N 3.32Å; L149-D151 PolarHBondContact O-N 3.07Å; L149-T152 PolarHBondContact O-N 3.27Å; L149-L153 HydrophobicContact CD1-CD1 3.95Å; L149-L153 HydrophobicContact CD1-CD2 4.2Å; L149-L153 HydrophobicContact CD1-CG 3.77Å; L149-L153 HydrophobicContact CD2-CD1 4.15Å; L149-L153 HydrophobicContact CG-CD1 3.72Å; L149-L153 HydrophobicContact CG-CG 3.93Å; L149-L153 WeakPolarHBondContact O-CB 3.36Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.43Å; L149-L153 PolarHBondContact O-N 2.88Å; L149-L215 HydrophobicContact CD2-CD1 4.2Å
150	M	96.8	Very high	95.5	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.015	26%	0.259	C	S	.	.	H	α-helix	trans	-58.6	-43.6	176.6	-179.3	172.9	70.1	0	0	111.6	P108 M143 R146 Q147 L153 W154 V178 I180 L187	P108-M150 HydrophobicContact CB-CE 3.83Å; P108-M150 HydrophobicContact CB-CG 4.25Å; P108-M150 HydrophobicContact CB-SD 4.41Å; M143-M150 HydrophobicContact CB-CB 4.12Å; M143-M150 HydrophobicContact CB-CG 4.23Å; M143-M150 HydrophobicContact CB-SD 4.03Å; M143-M150 HydrophobicContact CG-CB 3.98Å; M143-M150 HydrophobicContact CG-CG 4.01Å; M143-M150 HydrophobicContact CG-SD 4.36Å; M143-M150 HydrophobicContact SD-CB 4.05Å; R146-M150 PolarHBondContact O-N 3.5Å; Q147-M150 VanDerWaalsContact O-CB 3.3Å; Q147-M150 WeakPolarHBondContact O-CB 3.45Å; Q147-M150 PolarHBondContact O-N 2.95Å; Q147-M150 VanDerWaalsContact O-N 3.1Å; M150-L153 PolarHBondContact O-N 3.36Å; M150-W154 WeakPolarHBondContact O-CB 3.35Å; M150-W154 PolarHBondContact O-N 2.8Å; M150-V178 HydrophobicContact CG-CG2 4.01Å; M150-V178 HydrophobicContact SD-CG2 3.87Å; M150-I180 HydrophobicContact CE-CG1 4.38Å; M150-L187 HydrophobicContact CG-CD2 4.46Å
151	D	95.9	Very high	95.5	Very high	28 Å²	28	53.8 Å²	53.8	15%	0.15	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-48.2	178	-58.4	-28.4	0	0	0	111.1	E107 P108 S109 Q147 L149 M155	E107-D151 HydrophobicContact CB-CB 4.34Å; E107-D151 HydrophobicContact CG-CB 4.34Å; P108-D151 VanDerWaalsContact CD-OD1 3.31Å; P108-D151 WeakPolarHBondContact CD-OD1 3.42Å; S109-D151 VanDerWaalsContact CB-OD1 3.3Å; S109-D151 WeakPolarHBondContact CB-OD1 3Å; S109-D151 WeakPolarHBondContact CB-OD2 3.42Å; S109-D151 PolarHBondContact N-OD1 3.39Å; S109-D151 VanDerWaalsContact OG-CG 3.25Å; S109-D151 PolarHBondContact OG-OD1 3.15Å; S109-D151 PolarHBondContact OG-OD2 3.33Å; Q147-D151 PolarHBondContact O-N 3.07Å; Q147-D151 VanDerWaalsContact O-N 3.12Å; L149-D151 VanDerWaalsContact C-N 3.32Å; L149-D151 PolarHBondContact O-N 3.07Å; D151-M155 PolarHBondContact O-N 3.43Å; D151-M155 VanDerWaalsContact O-N 3.08Å
152	T	96.4	Very high	95.4	Very high	82 Å²	82	54.3 Å²	54.3	50%	0.503	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-47.7	177.1	-58	0	0	0	0	112.1	R148 L149 M155 R156	R148-T152 PolarHBondContact O-N 3.47Å; R148-T152 PolarHBondContact O-OG1 2.69Å; L149-T152 PolarHBondContact O-N 3.27Å; T152-M155 WeakPolarHBondContact O-CB 3.47Å; T152-M155 PolarHBondContact O-N 2.74Å; T152-R156 WeakPolarHBondContact O-CG 3.22Å; T152-R156 PolarHBondContact O-N 2.8Å
153	L	97.7	Very high	95.5	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-73.7	-35.8	-176.5	-67.6	-173.5	0	0	0	112.5	M143 L149 M150 M155 R156 L157 L187 L211 V213 L215	M143-L153 HydrophobicContact CE-CD1 3.72Å; M143-L153 HydrophobicContact SD-CD1 4.22Å; L149-L153 HydrophobicContact CD1-CD1 3.95Å; L149-L153 HydrophobicContact CD1-CD2 4.2Å; L149-L153 HydrophobicContact CD1-CG 3.77Å; L149-L153 HydrophobicContact CD2-CD1 4.15Å; L149-L153 HydrophobicContact CG-CD1 3.72Å; L149-L153 HydrophobicContact CG-CG 3.93Å; L149-L153 WeakPolarHBondContact O-CB 3.36Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.43Å; L149-L153 PolarHBondContact O-N 2.88Å; M150-L153 PolarHBondContact O-N 3.36Å; L153-M155 PolarHBondContact O-N 3.32Å; L153-R156 PolarHBondContact O-N 3.48Å; L153-L157 WeakPolarHBondContact O-CG 2.9Å; L153-L157 PolarHBondContact O-N 2.74Å; L153-L187 HydrophobicContact CB-CD1 3.4Å; L153-L187 HydrophobicContact CD1-CD1 4.35Å; L153-L211 HydrophobicContact CD2-CB 4.15Å; L153-L211 HydrophobicContact CD2-CD2 4.25Å; L153-V213 HydrophobicContact CD1-CG1 4.1Å; L153-V213 HydrophobicContact CD2-CG1 3.65Å; L153-V213 HydrophobicContact CG-CG1 4.47Å; L153-L215 HydrophobicContact CD1-CD1 4.44Å
154	W	97.5	Very high	95.5	Very high	3 Å²	3	55.3 Å²	55.3	1%	0.011	27%	0.272	C	S	.	.	H	α-helix	trans	-55.7	-44.4	170	176.1	-122.1	0	0	0	109.8	M105 P108 F117 F119 M150 L157 L158 F176 V178 L187	M105-W154 HydrophobicContact CE-CZ2 4.48Å; P108-W154 HydrophobicContact CG-CB 3.85Å; P108-W154 HydrophobicContact CG-CG 3.65Å; F117-W154 HydrophobicContact CB-CH2 4.08Å; F117-W154 HydrophobicContact CB-CZ2 3.63Å; F117-W154 HydrophobicContact CD2-CZ2 4.37Å; F117-W154 HydrophobicContact CG-CZ2 4.33Å; F119-W154 HydrophobicContact CB-CH2 4.11Å; M150-W154 WeakPolarHBondContact O-CB 3.35Å; M150-W154 PolarHBondContact O-N 2.8Å; W154-L157 WeakPolarHBondContact O-CB 3.43Å; W154-L157 PolarHBondContact O-N 2.8Å; W154-L158 HydrophobicContact CD2-CG 4.32Å; W154-L158 HydrophobicContact CH2-CD2 3.85Å; W154-L158 HydrophobicContact CZ2-CD1 4.13Å; W154-L158 HydrophobicContact CZ2-CD2 3.68Å; W154-L158 HydrophobicContact CZ2-CG 4.11Å; W154-L158 HydrophobicContact CZ3-CD2 4.37Å; W154-L158 WeakPolarHBondContact O-CG 3.3Å; W154-L158 PolarHBondContact O-N 3.31Å; W154-F176 HydrophobicContact CH2-CB 4.39Å; W154-F176 HydrophobicContact CZ3-CB 3.94Å; W154-V178 HydrophobicContact CD2-CB 4.06Å; W154-V178 HydrophobicContact CD2-CG1 3.75Å; W154-V178 HydrophobicContact CE3-CB 3.85Å; W154-V178 HydrophobicContact CE3-CG1 3.91Å; W154-V178 HydrophobicContact CG-CG1 4.28Å; W154-V178 HydrophobicContact CH2-CG1 4.18Å; W154-V178 HydrophobicContact CZ2-CG1 4.03Å; W154-V178 HydrophobicContact CZ3-CB 4.19Å; W154-V178 HydrophobicContact CZ3-CG1 4.13Å; W154-L187 HydrophobicContact CB-CD2 4Å; W154-L187 HydrophobicContact CD2-CD2 4.49Å; W154-L187 HydrophobicContact CE3-CD2 3.87Å
155	M	95.6	Very high	95.9	Very high	38 Å²	38	58.1 Å²	58.1	19%	0.187	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-43.7	179.7	-163.1	55.8	82.4	0	0	113.7	Y102 D151 T152 L153 L157 L158 M159	Y102-M155 HydrophobicContact CD1-CE 4.47Å; Y102-M155 HydrophobicContact CD2-CE 3.47Å; Y102-M155 VanDerWaalsContact CD2-CE 3.47Å; Y102-M155 HydrophobicContact CD2-CG 4.12Å; Y102-M155 HydrophobicContact CD2-SD 3.11Å; Y102-M155 WeakPolarHBondContact CD2-SD 3.16Å; Y102-M155 HydrophobicContact CE1-CE 4.11Å; Y102-M155 HydrophobicContact CE2-CE 3.15Å; Y102-M155 HydrophobicContact CE2-CG 3.28Å; Y102-M155 HydrophobicContact CE2-SD 2.88Å; Y102-M155 WeakPolarHBondContact CE2-SD 3.41Å; Y102-M155 HydrophobicContact CG-CE 4.13Å; Y102-M155 HydrophobicContact CG-SD 4.23Å; D151-M155 PolarHBondContact O-N 3.43Å; D151-M155 VanDerWaalsContact O-N 3.08Å; T152-M155 WeakPolarHBondContact O-CB 3.47Å; T152-M155 PolarHBondContact O-N 2.74Å; L153-M155 PolarHBondContact O-N 3.32Å; M155-L157 VanDerWaalsContact C-N 3.26Å; M155-L157 PolarHBondContact O-N 3.31Å; M155-L158 PolarHBondContact O-N 3.39Å; M155-L158 HydrophobicContact SD-CB 4.49Å; M155-L158 HydrophobicContact SD-CD1 4.16Å; M155-M159 WeakPolarHBondContact O-CG 3.3Å; M155-M159 PolarHBondContact O-N 3.3Å
156	R	97.1	Very high	96.3	Very high	61 Å²	61	50.9 Å²	50.9	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-34.5	174.9	-69.8	-174.8	73.8	123	5.2	112.3	T152 L153 M159 S160 A210 L211 E212	T152-R156 WeakPolarHBondContact O-CG 3.22Å; T152-R156 PolarHBondContact O-N 2.8Å; L153-R156 PolarHBondContact O-N 3.48Å; R156-M159 PolarHBondContact O-N 2.84Å; R156-S160 WeakPolarHBondContact O-CB 3.18Å; R156-S160 PolarHBondContact O-N 3.1Å; R156-S160 PolarHBondContact O-OG 3.35Å; R156-A210 PolarHBondContact NE-O 3.32Å; R156-A210 PolarHBondContact NH2-O 2.89Å; R156-L211 HydrophobicContact CB-CD2 3.61Å; R156-E212 IonicContact CZ-OE1 3.78Å; R156-E212 IonicContact CZ-OE2 2.69Å; R156-E212 IonicContact NH1-OE1 2.8Å; R156-E212 IonicContact NH1-OE2 3.8Å; R156-E212 PolarHBondContact NH1-OE2 3.28Å; R156-E212 IonicContact NH2-OE1 3.75Å; R156-E212 PolarHBondContact NH2-OE1 3.27Å; R156-E212 IonicContact NH2-OE2 3.89Å; R156-E212 PolarHBondContact NH2-OE2 3.25Å; R156-E212 VanDerWaalsContact NH2-OE2 3.11Å
157	L	98.2	Very high	96.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.9	-41.7	173.4	-74.3	177.2	0	0	0	112.4	L153 W154 M155 S160 A161 F176 L187 V189 I207 L211	L153-L157 WeakPolarHBondContact O-CG 2.9Å; L153-L157 PolarHBondContact O-N 2.74Å; W154-L157 WeakPolarHBondContact O-CB 3.43Å; W154-L157 PolarHBondContact O-N 2.8Å; M155-L157 VanDerWaalsContact C-N 3.26Å; M155-L157 PolarHBondContact O-N 3.31Å; L157-S160 WeakPolarHBondContact CA-OG 2.85Å; L157-S160 PolarHBondContact O-N 3.26Å; L157-S160 PolarHBondContact O-OG 3.09Å; L157-A161 WeakPolarHBondContact O-CB 3.41Å; L157-A161 PolarHBondContact O-N 3.05Å; L157-F176 HydrophobicContact CB-CD1 3.9Å; L157-F176 HydrophobicContact CB-CE1 4.49Å; L157-F176 HydrophobicContact CB-CG 4.49Å; L157-F176 HydrophobicContact CD1-CD1 4.38Å; L157-F176 HydrophobicContact CD2-CD1 3.83Å; L157-F176 HydrophobicContact CD2-CE1 3.97Å; L157-F176 HydrophobicContact CG-CD1 4.25Å; L157-L187 HydrophobicContact CD1-CB 3.98Å; L157-L187 HydrophobicContact CD1-CD1 4.18Å; L157-L187 HydrophobicContact CD1-CD2 4.27Å; L157-L187 HydrophobicContact CD1-CG 4.38Å; L157-V189 HydrophobicContact CD2-CG2 3.95Å; L157-I207 HydrophobicContact CD2-CG2 4.16Å; L157-L211 HydrophobicContact CD2-CD1 4.01Å; L157-L211 HydrophobicContact CD2-CD2 3.86Å; L157-L211 HydrophobicContact CD2-CG 4.23Å; L157-L211 HydrophobicContact CG-CD1 4.38Å; L157-L211 HydrophobicContact CG-CD2 3.96Å
158	L	97.7	Very high	96.8	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-43.9	175.6	-66.5	-176.1	0	0	0	111.4	F98 M105 F119 W154 M155 A161 V162	F98-L158 HydrophobicContact CE2-CB 3.97Å; F98-L158 HydrophobicContact CZ-CB 3.96Å; M105-L158 HydrophobicContact CE-CD1 4.18Å; M105-L158 HydrophobicContact SD-CD1 4.4Å; F119-L158 HydrophobicContact CB-CD2 3.59Å; F119-L158 HydrophobicContact CD1-CD2 3.48Å; F119-L158 VanDerWaalsContact CD1-CD2 3.48Å; F119-L158 HydrophobicContact CD2-CD2 4.07Å; F119-L158 HydrophobicContact CE1-CD2 4.07Å; F119-L158 HydrophobicContact CG-CD2 3.45Å; F119-L158 VanDerWaalsContact CG-CD2 3.45Å; W154-L158 HydrophobicContact CD2-CG 4.32Å; W154-L158 HydrophobicContact CH2-CD2 3.85Å; W154-L158 HydrophobicContact CZ2-CD1 4.13Å; W154-L158 HydrophobicContact CZ2-CD2 3.68Å; W154-L158 HydrophobicContact CZ2-CG 4.11Å; W154-L158 HydrophobicContact CZ3-CD2 4.37Å; W154-L158 WeakPolarHBondContact O-CG 3.3Å; W154-L158 PolarHBondContact O-N 3.31Å; M155-L158 PolarHBondContact O-N 3.39Å; M155-L158 HydrophobicContact SD-CB 4.49Å; M155-L158 HydrophobicContact SD-CD1 4.16Å; L158-A161 WeakPolarHBondContact O-CB 3.32Å; L158-A161 PolarHBondContact O-N 3.05Å; L158-V162 PolarHBondContact O-N 3.45Å; L158-V162 VanDerWaalsContact O-N 3.11Å
159	M	97.3	Very high	97	Very high	83 Å²	83	37.5 Å²	37.5	41%	0.409	20%	0.204	S	C	.	.	H	α-helix	trans	-63.3	-42.3	176.3	-70.9	-176.9	68.3	0	0	112.5	M155 R156 A161 V162 G163 W165	M155-M159 WeakPolarHBondContact O-CG 3.3Å; M155-M159 PolarHBondContact O-N 3.3Å; R156-M159 PolarHBondContact O-N 2.84Å; M159-A161 VanDerWaalsContact C-N 3.26Å; M159-A161 PolarHBondContact O-N 2.84Å; M159-V162 PolarHBondContact O-N 3.42Å; M159-G163 WeakPolarHBondContact O-CA 3.17Å; M159-G163 PolarHBondContact O-N 2.98Å; M159-W165 HydrophobicContact CB-CH2 4.14Å; M159-W165 HydrophobicContact CB-CZ2 4.15Å
160	S	97.7	Very high	97	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-31.5	178.1	70.5	0	0	0	0	112.5	R156 L157 N164 W165 Y166	R156-S160 WeakPolarHBondContact O-CB 3.18Å; R156-S160 PolarHBondContact O-N 3.1Å; R156-S160 PolarHBondContact O-OG 3.35Å; L157-S160 WeakPolarHBondContact CA-OG 2.85Å; L157-S160 PolarHBondContact O-N 3.26Å; L157-S160 PolarHBondContact O-OG 3.09Å; S160-N164 PolarHBondContact O-N 3.4Å; S160-W165 PolarHBondContact O-N 3.05Å; S160-W165 VanDerWaalsContact O-N 3.15Å; S160-Y166 WeakPolarHBondContact CB-OH 3.13Å; S160-Y166 WeakPolarHBondContact OG-CE2 3.49Å; S160-Y166 PolarHBondContact OG-OH 2.83Å
161	A	97.8	Very high	97	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-56.2	174.1	0	0	0	0	0	111.8	W68 F119 L157 L158 M159 N164 F176	W68-A161 HydrophobicContact CD2-CB 4.29Å; W68-A161 HydrophobicContact CE3-CB 4.43Å; W68-A161 HydrophobicContact CH2-CB 4Å; W68-A161 HydrophobicContact CZ2-CB 3.79Å; W68-A161 HydrophobicContact CZ3-CB 4.3Å; W68-A161 PolarHBondContact NE1-O 3.44Å; F119-A161 HydrophobicContact CD1-CB 4.1Å; F119-A161 HydrophobicContact CE1-CB 3.97Å; L157-A161 WeakPolarHBondContact O-CB 3.41Å; L157-A161 PolarHBondContact O-N 3.05Å; L158-A161 WeakPolarHBondContact O-CB 3.32Å; L158-A161 PolarHBondContact O-N 3.05Å; M159-A161 VanDerWaalsContact C-N 3.26Å; M159-A161 PolarHBondContact O-N 2.84Å; A161-N164 PolarHBondContact O-N 2.88Å; A161-F176 HydrophobicContact CB-CD2 3.75Å; A161-F176 HydrophobicContact CB-CE2 3.24Å; A161-F176 HydrophobicContact CB-CZ 3.83Å
162	V	97	Very high	97.1	Very high	11 Å²	11	40 Å²	40	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-72.8	-31.9	-177.2	-57.9	0	0	0	0	112.3	L64 L95 F98 F119 L158 M159 N164	L64-V162 HydrophobicContact CD1-CB 4.02Å; L64-V162 HydrophobicContact CD1-CG1 3.88Å; L64-V162 HydrophobicContact CD2-CB 3.93Å; L95-V162 HydrophobicContact CD2-CB 4.45Å; L95-V162 HydrophobicContact CD2-CG2 4.13Å; F98-V162 HydrophobicContact CB-CG1 4.42Å; F98-V162 HydrophobicContact CD1-CG1 4.49Å; F98-V162 HydrophobicContact CD1-CG2 3.83Å; F98-V162 HydrophobicContact CD2-CG1 3.6Å; F98-V162 HydrophobicContact CD2-CG2 4.34Å; F98-V162 HydrophobicContact CE1-CG2 3.82Å; F98-V162 HydrophobicContact CE2-CG1 3.93Å; F98-V162 HydrophobicContact CE2-CG2 4.34Å; F98-V162 HydrophobicContact CG-CB 4.42Å; F98-V162 HydrophobicContact CG-CG1 3.9Å; F98-V162 HydrophobicContact CG-CG2 4.09Å; F98-V162 HydrophobicContact CZ-CG2 4.08Å; F119-V162 HydrophobicContact CE1-CG1 3.94Å; F119-V162 HydrophobicContact CZ-CG1 3.95Å; L158-V162 PolarHBondContact O-N 3.45Å; L158-V162 VanDerWaalsContact O-N 3.11Å; M159-V162 PolarHBondContact O-N 3.42Å; V162-N164 VanDerWaalsContact C-N 3.26Å; V162-N164 PolarHBondContact O-N 2.67Å
163	G	96.9	Very high	97.2	Very high	40 Å²	40	36.2 Å²	36.2	41%	0.412	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.3	176.5	0	0	0	0	0	114.6	M159 W165	M159-G163 WeakPolarHBondContact O-CA 3.17Å; M159-G163 PolarHBondContact O-N 2.98Å; G163-W165 VanDerWaalsContact C-N 3.28Å; G163-W165 VanDerWaalsContact O-CD1 3.31Å; G163-W165 PolarHBondContact O-N 2.97Å
164	N	96.7	Very high	97.3	Very high	47 Å²	47	36 Å²	36	25%	0.251	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	38.5	-179.6	-167.2	41.1	0	0	0	114	Q65 S160 A161 V162 Y166 G167 S170	Q65-N164 HydrophobicContact CB-CB 4.3Å; S160-N164 PolarHBondContact O-N 3.4Å; A161-N164 PolarHBondContact O-N 2.88Å; V162-N164 VanDerWaalsContact C-N 3.26Å; V162-N164 PolarHBondContact O-N 2.67Å; N164-Y166 PolarHBondContact O-N 2.9Å; N164-Y166 VanDerWaalsContact O-N 3.09Å; N164-G167 PolarHBondContact O-N 2.78Å; N164-G167 VanDerWaalsContact O-N 3.12Å; N164-S170 WeakPolarHBondContact OD1-CB 3.5Å; N164-S170 PolarHBondContact OD1-OG 2.86Å
165	W	97.6	Very high	97.3	Very high	123 Å²	123	35.9 Å²	35.9	47%	0.466	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.3	-172.9	-63.6	-4.3	0	0	0	114.3	M159 S160 G163 G167 A210	M159-W165 HydrophobicContact CB-CH2 4.14Å; M159-W165 HydrophobicContact CB-CZ2 4.15Å; S160-W165 PolarHBondContact O-N 3.05Å; S160-W165 VanDerWaalsContact O-N 3.15Å; G163-W165 VanDerWaalsContact C-N 3.28Å; G163-W165 VanDerWaalsContact O-CD1 3.31Å; G163-W165 PolarHBondContact O-N 2.97Å; W165-G167 VanDerWaalsContact C-N 3.35Å; W165-A210 HydrophobicContact CE3-CB 3.91Å; W165-A210 HydrophobicContact CZ3-CB 4.44Å
166	Y	97	Very high	97.5	Very high	15 Å²	15	34.1 Å²	34.1	6%	0.059	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-3	179.5	-45.7	-75.1	0	0	0	113.4	S160 N164 D168 L169 S170 I173 F176 A206 I207 A210	S160-Y166 WeakPolarHBondContact CB-OH 3.13Å; S160-Y166 WeakPolarHBondContact OG-CE2 3.49Å; S160-Y166 PolarHBondContact OG-OH 2.83Å; N164-Y166 PolarHBondContact O-N 2.9Å; N164-Y166 VanDerWaalsContact O-N 3.09Å; Y166-D168 PolarHBondContact O-N 2.97Å; Y166-L169 WeakPolarHBondContact O-CB 3.42Å; Y166-L169 PolarHBondContact O-N 3.12Å; Y166-S170 WeakPolarHBondContact CB-OG 3.3Å; Y166-I173 HydrophobicContact CD1-CD1 4.17Å; Y166-I173 HydrophobicContact CD2-CD1 3.41Å; Y166-I173 VanDerWaalsContact CD2-CD1 3.41Å; Y166-I173 HydrophobicContact CE1-CD1 4.5Å; Y166-I173 HydrophobicContact CE2-CD1 3.81Å; Y166-I173 HydrophobicContact CG-CD1 3.6Å; Y166-F176 HydrophobicContact CE2-CE1 4.13Å; Y166-F176 AromaticContact CE2-CZ 3.76Å; Y166-F176 HydrophobicContact CE2-CZ 3.76Å; Y166-A206 HydrophobicContact CD1-CB 3.94Å; Y166-I207 HydrophobicContact CE1-CB 4.47Å; Y166-I207 HydrophobicContact CE1-CG1 3.84Å; Y166-A210 HydrophobicContact CE1-CB 4.13Å
167	G	96	Very high	97.5	Very high	35 Å²	35	31.2 Å²	31.2	36%	0.361	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	53.7	-126.8	178.4	0	0	0	0	0	112.4	N164 W165 L169 S170	N164-G167 PolarHBondContact O-N 2.78Å; N164-G167 VanDerWaalsContact O-N 3.12Å; W165-G167 VanDerWaalsContact C-N 3.35Å; G167-L169 PolarHBondContact O-N 3.14Å; G167-L169 VanDerWaalsContact O-N 3.16Å; G167-S170 PolarHBondContact N-OG 3.23Å; G167-S170 WeakPolarHBondContact O-CB 3.44Å; G167-S170 PolarHBondContact O-N 3.27Å; G167-S170 PolarHBondContact O-OG 2.71Å; G167-S170 VanDerWaalsContact O-OG 3.13Å
168	D	96.2	Very high	97.5	Very high	137 Å²	137	31.2 Å²	31.2	73%	0.733	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-60.6	-25.1	179.8	-68	-24.9	0	0	0	114.2	Y166 S170 K171	Y166-D168 PolarHBondContact O-N 2.97Å; D168-S170 PolarHBondContact O-N 3.14Å; D168-K171 WeakPolarHBondContact O-CD 3.48Å; D168-K171 WeakPolarHBondContact O-CE 3.41Å; D168-K171 WeakPolarHBondContact O-CG 3.19Å
169	L	97.4	Very high	97.4	Very high	17 Å²	17	31.8 Å²	31.8	9%	0.089	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-74.6	-19.2	177.7	-60.4	172.6	0	0	0	111.8	Y166 G167 K171 D172 K199 R202 I203 A206	Y166-L169 WeakPolarHBondContact O-CB 3.42Å; Y166-L169 PolarHBondContact O-N 3.12Å; G167-L169 PolarHBondContact O-N 3.14Å; G167-L169 VanDerWaalsContact O-N 3.16Å; L169-K171 PolarHBondContact O-N 3.17Å; L169-K171 VanDerWaalsContact O-N 3.16Å; L169-D172 PolarHBondContact O-N 3.37Å; L169-D172 VanDerWaalsContact O-N 3.09Å; L169-K199 HydrophobicContact CD2-CG 3.89Å; L169-R202 HydrophobicContact CD1-CB 4.08Å; L169-R202 HydrophobicContact CD2-CB 4.39Å; L169-I203 HydrophobicContact CB-CG1 4.04Å; L169-I203 HydrophobicContact CD1-CG1 4.31Å; L169-I203 HydrophobicContact CD2-CG1 4.25Å; L169-I203 HydrophobicContact CG-CG1 4.44Å; L169-A206 HydrophobicContact CD1-CB 4.28Å
170	S	97.4	Very high	97.3	Very high	5 Å²	5	28.3 Å²	28.3	4%	0.035	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-56.4	-34.3	-179.6	-66.8	0	0	0	0	111.6	K121 N164 Y166 G167 D168 D172 I173	K121-S170 PolarHBondContact NZ-O 3.1Å; N164-S170 WeakPolarHBondContact OD1-CB 3.5Å; N164-S170 PolarHBondContact OD1-OG 2.86Å; Y166-S170 WeakPolarHBondContact CB-OG 3.3Å; G167-S170 PolarHBondContact N-OG 3.23Å; G167-S170 WeakPolarHBondContact O-CB 3.44Å; G167-S170 PolarHBondContact O-N 3.27Å; G167-S170 PolarHBondContact O-OG 2.71Å; G167-S170 VanDerWaalsContact O-OG 3.13Å; D168-S170 PolarHBondContact O-N 3.14Å; S170-D172 PolarHBondContact O-N 3.27Å; S170-I173 PolarHBondContact O-N 3.02Å; S170-I173 VanDerWaalsContact O-N 3.09Å
171	K	96.8	Very high	97.2	Very high	117 Å²	117	32.2 Å²	32.2	51%	0.509	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-60	-32.3	-179.3	72.9	-166.5	173.5	-178.5	0	113.1	Y66 D168 L169 R192	Y66-K171 WeakPolarHBondContact OH-CA 3.28Å; D168-K171 WeakPolarHBondContact O-CD 3.48Å; D168-K171 WeakPolarHBondContact O-CE 3.41Å; D168-K171 WeakPolarHBondContact O-CG 3.19Å; L169-K171 PolarHBondContact O-N 3.17Å; L169-K171 VanDerWaalsContact O-N 3.16Å; K171-R192 PolarHBondContact O-NE 3.35Å
172	D	97.6	Very high	96.9	Very high	19 Å²	19	42.1 Å²	42.1	10%	0.102	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-84.7	-9.8	-179.6	-61.9	-95.9	0	0	0	112.7	L169 S170 T191 R192 K199 I203	L169-D172 PolarHBondContact O-N 3.37Å; L169-D172 VanDerWaalsContact O-N 3.09Å; S170-D172 PolarHBondContact O-N 3.27Å; D172-T191 CarbonylContact O-C 3.49Å; D172-T191 WeakPolarHBondContact O-CA 3.49Å; D172-T191 WeakPolarHBondContact O-CB 3.36Å; D172-R192 PolarHBondContact O-N 3.38Å; D172-K199 HydrophobicContact CB-CD 4.03Å; D172-K199 VanDerWaalsContact OD1-CD 3.23Å; D172-K199 WeakPolarHBondContact OD1-CD 3.47Å; D172-K199 IonicContact OD1-NZ 2.76Å; D172-K199 PolarHBondContact OD1-NZ 3.37Å; D172-K199 WeakPolarHBondContact OD2-CD 3.5Å; D172-K199 IonicContact OD2-NZ 3.83Å; D172-I203 HydrophobicContact CB-CD1 3.96Å
173	I	98.5	Very high	96.6	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.6	172	-62.1	173	0	0	0	109.7	K121 Y166 S170 F176 V189 I203	K121-I173 WeakPolarHBondContact CE-O 3.14Å; K121-I173 PolarHBondContact NZ-O 3.08Å; Y166-I173 HydrophobicContact CD1-CD1 4.17Å; Y166-I173 HydrophobicContact CD2-CD1 3.41Å; Y166-I173 VanDerWaalsContact CD2-CD1 3.41Å; Y166-I173 HydrophobicContact CE1-CD1 4.5Å; Y166-I173 HydrophobicContact CE2-CD1 3.81Å; Y166-I173 HydrophobicContact CG-CD1 3.6Å; S170-I173 PolarHBondContact O-N 3.02Å; S170-I173 VanDerWaalsContact O-N 3.09Å; I173-F176 HydrophobicContact CG2-CE2 3.95Å; I173-F176 HydrophobicContact CG2-CZ 3.8Å; I173-V189 HydrophobicContact CD1-CG1 4.43Å; I173-V189 HydrophobicContact CG1-CG1 4.4Å; I173-V189 HydrophobicContact CG2-CG1 3.83Å; I173-I203 HydrophobicContact CD1-CG2 4.37Å; I173-I203 HydrophobicContact CG1-CG2 4.29Å
174	C	98.5	Very high	96.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-47.6	177.3	-61.9	0	0	0	0	111.8	F120 K121 I124 Q132 N133 W190 R192	F120-C174 HydrophobicContact CD1-CB 4.31Å; F120-C174 HydrophobicContact CE1-CB 4.14Å; K121-C174 PolarHBondContact N-O 2.81Å; I124-C174 HydrophobicContact CD1-CB 4.26Å; I124-C174 HydrophobicContact CG2-CB 4.31Å; Q132-C174 PolarHBondContact O-SG 2.93Å; N133-C174 VanDerWaalsContact OD1-CB 3.28Å; N133-C174 WeakPolarHBondContact OD1-CB 3.3Å; N133-C174 PolarHBondContact OD1-SG 3.36Å; C174-W190 HydrophobicContact CB-CB 4.17Å; C174-W190 PolarHBondContact N-O 3.41Å; C174-R192 WeakPolarHBondContact SG-CG 3.16Å
175	G	98.5	Very high	96.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	173.3	-172.8	0	0	0	0	0	114.4	F119 W190	F119-G175 CarbonylContact O-C 3.48Å; F119-G175 WeakPolarHBondContact O-CA 3.45Å; G175-W190 PolarHBondContact O-N 3.31Å
176	F	98.7	Very high	96.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.4	-176.6	-56.9	-92.9	0	0	0	109.1	W68 Y118 F119 W154 L157 A161 Y166 I173 C188 V189	W68-F176 HydrophobicContact CH2-CD2 4.27Å; W68-F176 AromaticContact CH2-CE2 3.56Å; W68-F176 HydrophobicContact CH2-CE2 3.56Å; W68-F176 HydrophobicContact CZ2-CE2 4.41Å; W68-F176 AromaticContact CZ3-CD2 3.89Å; W68-F176 HydrophobicContact CZ3-CD2 3.89Å; W68-F176 AromaticContact CZ3-CE2 3.66Å; W68-F176 HydrophobicContact CZ3-CE2 3.66Å; Y118-F176 CarbonylContact C-O 3.57Å; Y118-F176 WeakPolarHBondContact CA-O 3.49Å; F119-F176 HydrophobicContact CB-CB 4.43Å; F119-F176 HydrophobicContact CD1-CD2 4.42Å; F119-F176 PolarHBondContact N-O 3.48Å; F119-F176 PolarHBondContact O-N 2.91Å; W154-F176 HydrophobicContact CH2-CB 4.39Å; W154-F176 HydrophobicContact CZ3-CB 3.94Å; L157-F176 HydrophobicContact CB-CD1 3.9Å; L157-F176 HydrophobicContact CB-CE1 4.49Å; L157-F176 HydrophobicContact CB-CG 4.49Å; L157-F176 HydrophobicContact CD1-CD1 4.38Å; L157-F176 HydrophobicContact CD2-CD1 3.83Å; L157-F176 HydrophobicContact CD2-CE1 3.97Å; L157-F176 HydrophobicContact CG-CD1 4.25Å; A161-F176 HydrophobicContact CB-CD2 3.75Å; A161-F176 HydrophobicContact CB-CE2 3.24Å; A161-F176 HydrophobicContact CB-CZ 3.83Å; Y166-F176 HydrophobicContact CE2-CE1 4.13Å; Y166-F176 AromaticContact CE2-CZ 3.76Å; Y166-F176 HydrophobicContact CE2-CZ 3.76Å; I173-F176 HydrophobicContact CG2-CE2 3.95Å; I173-F176 HydrophobicContact CG2-CZ 3.8Å; F176-C188 CarbonylContact C-O 3.58Å; F176-C188 WeakPolarHBondContact CA-O 3.5Å; F176-V189 HydrophobicContact CD1-CB 4.38Å; F176-V189 HydrophobicContact CD1-CG1 4.05Å; F176-V189 HydrophobicContact CD1-CG2 3.75Å; F176-V189 HydrophobicContact CE1-CB 4.43Å; F176-V189 HydrophobicContact CE1-CG1 3.74Å; F176-V189 HydrophobicContact CE1-CG2 3.9Å; F176-V189 HydrophobicContact CZ-CG1 4.33Å
177	V	98.4	Very high	96.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.6	-177	-172.7	0	0	0	0	109.9	F117 Y118 F120 L187 C188	F117-V177 VanDerWaalsContact O-CA 3.3Å; F117-V177 WeakPolarHBondContact O-CA 3.48Å; F117-V177 WeakPolarHBondContact O-CG1 3.4Å; Y118-V177 HydrophobicContact CD1-CB 4.28Å; Y118-V177 HydrophobicContact CD1-CG1 3.83Å; Y118-V177 HydrophobicContact CD1-CG2 3.52Å; Y118-V177 HydrophobicContact CE1-CG1 3.7Å; Y118-V177 HydrophobicContact CE1-CG2 3.94Å; Y118-V177 HydrophobicContact CG-CG2 4.48Å; F120-V177 HydrophobicContact CE2-CG2 3.69Å; F120-V177 HydrophobicContact CZ-CG2 4.04Å; V177-L187 CarbonylContact O-C 3.53Å; V177-L187 WeakPolarHBondContact O-CA 3.18Å; V177-C188 HydrophobicContact CB-CB 4.09Å; V177-C188 PolarHBondContact N-O 3.22Å; V177-C188 PolarHBondContact O-N 2.96Å
178	V	97.7	Very high	96.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.7	159.5	56.8	0	0	0	0	109	P108 D116 F117 M150 W154 I180 L187	P108-V178 HydrophobicContact CB-CG1 4.42Å; P108-V178 HydrophobicContact CB-CG2 3.93Å; P108-V178 HydrophobicContact CG-CG1 4.16Å; P108-V178 HydrophobicContact CG-CG2 4.25Å; D116-V178 VanDerWaalsContact CA-O 3.3Å; D116-V178 WeakPolarHBondContact CA-O 3.2Å; F117-V178 HydrophobicContact CB-CG1 3.68Å; F117-V178 HydrophobicContact CD2-CG1 3.87Å; F117-V178 HydrophobicContact CG-CG1 4.26Å; F117-V178 PolarHBondContact N-O 3.32Å; F117-V178 VanDerWaalsContact N-O 3.1Å; F117-V178 PolarHBondContact O-N 3.41Å; M150-V178 HydrophobicContact CG-CG2 4.01Å; M150-V178 HydrophobicContact SD-CG2 3.87Å; W154-V178 HydrophobicContact CD2-CB 4.06Å; W154-V178 HydrophobicContact CD2-CG1 3.75Å; W154-V178 HydrophobicContact CE3-CB 3.85Å; W154-V178 HydrophobicContact CE3-CG1 3.91Å; W154-V178 HydrophobicContact CG-CG1 4.28Å; W154-V178 HydrophobicContact CH2-CG1 4.18Å; W154-V178 HydrophobicContact CZ2-CG1 4.03Å; W154-V178 HydrophobicContact CZ3-CB 4.19Å; W154-V178 HydrophobicContact CZ3-CG1 4.13Å; V178-I180 HydrophobicContact CG2-CG1 4.33Å; V178-L187 HydrophobicContact CB-CD2 3.54Å; V178-L187 HydrophobicContact CG2-CD2 3.61Å
179	N	96.4	Very high	96.6	Very high	14 Å²	14	43 Å²	43	8%	0.075	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.8	175.2	-57.6	125.1	0	0	0	110.3	D116 S185 K186	D116-N179 WeakPolarHBondContact OD1-CA 3.42Å; D116-N179 WeakPolarHBondContact OD1-CB 3.28Å; D116-N179 PolarHBondContact OD1-ND2 3.21Å; D116-N179 PolarHBondContact OD2-ND2 2.76Å; N179-S185 VanDerWaalsContact O-CA 3.3Å; N179-S185 WeakPolarHBondContact O-CA 3.42Å; N179-K186 HydrophobicContact CB-CG 3.93Å; N179-K186 PolarHBondContact N-O 3.41Å; N179-K186 PolarHBondContact O-N 3.22Å; N179-K186 VanDerWaalsContact O-N 3.13Å; N179-K186 WeakPolarHBondContact OD1-CE 3.31Å
180	I	95.1	Very high	96.6	Very high	10 Å²	10	43 Å²	43	5%	0.051	17%	0.173	C	C	.	.			trans	-99.2	110.5	-178.5	-56.2	151.6	0	0	0	108.4	P108 L111 G114 T115 M150 V178	P108-I180 HydrophobicContact CB-CD1 4.22Å; P108-I180 HydrophobicContact CB-CG1 4.31Å; P108-I180 WeakPolarHBondContact O-CD1 3.29Å; L111-I180 HydrophobicContact CB-CD1 3.68Å; L111-I180 HydrophobicContact CD1-CD1 3.98Å; L111-I180 HydrophobicContact CG-CD1 4.43Å; G114-I180 PolarHBondContact N-O 3.41Å; T115-I180 HydrophobicContact CG2-CD1 3.97Å; T115-I180 WeakPolarHBondContact O-CB 3.42Å; T115-I180 PolarHBondContact O-N 3.08Å; M150-I180 HydrophobicContact CE-CG1 4.38Å; V178-I180 HydrophobicContact CG2-CG1 4.33Å
181	R	94.3	Very high	96.7	Very high	82 Å²	82	42.8 Å²	42.8	31%	0.309	17%	0.171	S	C	.	.			trans	-134.4	156	-176.6	-60.7	-64.5	178.8	-75.2	-4.1	110.4	T115 D116 R183 S185	T115-R181 PolarHBondContact O-NH1 2.93Å; D116-R181 VanDerWaalsContact CG-NH2 3.27Å; D116-R181 IonicContact OD1-CZ 3.9Å; D116-R181 IonicContact OD1-NH1 3.82Å; D116-R181 PolarHBondContact OD1-NH1 3.28Å; D116-R181 IonicContact OD1-NH2 3.35Å; D116-R181 PolarHBondContact OD1-NH2 2.97Å; D116-R181 IonicContact OD2-CZ 2.85Å; D116-R181 IonicContact OD2-NH1 2.68Å; D116-R181 IonicContact OD2-NH2 3.51Å; D116-R181 PolarHBondContact OD2-NH2 3.26Å; R181-R183 WeakPolarHBondContact CB-O 3.38Å; R181-R183 PolarHBondContact O-N 3.17Å; R181-S185 PolarHBondContact N-OG 3.46Å; R181-S185 PolarHBondContact O-OG 3.4Å
182	R	91.8	Very high	96.7	Very high	211 Å²	211	40.3 Å²	40.3	80%	0.796	16%	0.159	S	C	*	.	S	Bend	trans	-60.5	-37	172.9	-173.5	178.6	170	79	1.4	111.6	I113	I113-R182 HydrophobicContact CD1-CB 4.13Å; I113-R182 HydrophobicContact CG2-CB 4.37Å
183	R	91.4	Very high	96.6	Very high	205 Å²	205	42.5 Å²	42.5	77%	0.774	17%	0.17	S	C	*	.	S	Bend	trans	-137.4	149.3	173.4	-58.2	-176.4	76.4	164.1	4.1	107.6	R181	R181-R183 WeakPolarHBondContact CB-O 3.38Å; R181-R183 PolarHBondContact O-N 3.17Å
184	R	91.5	Very high	96.4	Very high	165 Å²	165	42.5 Å²	42.5	62%	0.623	17%	0.17	S	C	*	.			trans	62.3	39.2	-175.9	-48.3	-177.3	-176.2	-155.1	-0.1	113.2	D144 M231	D144-R184 WeakPolarHBondContact OD1-CA 3.08Å; D144-R184 PolarHBondContact OD1-N 3.42Å; D144-R184 WeakPolarHBondContact OD2-CA 3.44Å; D144-R184 PolarHBondContact OD2-N 3.09Å; D144-R184 VanDerWaalsContact OD2-N 3.08Å; R184-M231 PolarHBondContact NH1-SD 3.02Å; R184-M231 VanDerWaalsContact NH1-SD 3.41Å
185	S	95.8	Very high	96.2	Very high	13 Å²	13	46.4 Å²	46.4	9%	0.091	20%	0.198	C	C	.	.			trans	-61.6	140.2	163.7	-77.7	0	0	0	0	108.6	M143 D144 N179 R181	M143-S185 WeakPolarHBondContact CA-O 3.07Å; M143-S185 PolarHBondContact N-O 3.26Å; D144-S185 PolarHBondContact OD1-N 2.88Å; N179-S185 VanDerWaalsContact O-CA 3.3Å; N179-S185 WeakPolarHBondContact O-CA 3.42Å; R181-S185 PolarHBondContact N-OG 3.46Å; R181-S185 PolarHBondContact O-OG 3.4Å
186	K	97.1	Very high	96.1	Very high	42 Å²	42	49 Å²	49	18%	0.183	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	151.4	-173.4	57.7	-177.3	-179	-179.9	0	112.5	I140 I141 N179	I140-K186 HydrophobicContact CG2-CB 4.1Å; I140-K186 HydrophobicContact CG2-CD 3.93Å; I141-K186 WeakPolarHBondContact O-CA 3.32Å; N179-K186 HydrophobicContact CB-CG 3.93Å; N179-K186 PolarHBondContact N-O 3.41Å; N179-K186 PolarHBondContact O-N 3.22Å; N179-K186 VanDerWaalsContact O-N 3.13Å; N179-K186 WeakPolarHBondContact OD1-CE 3.31Å
187	L	98.4	Very high	96	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	143.8	161.8	-63.3	168.5	0	0	0	108.5	I141 M143 M150 L153 W154 L157 V177 V178	I141-L187 HydrophobicContact CB-CB 4.22Å; I141-L187 HydrophobicContact CD1-CB 4.35Å; I141-L187 PolarHBondContact N-O 3.39Å; I141-L187 PolarHBondContact O-N 2.97Å; M143-L187 HydrophobicContact CE-CD1 4.03Å; M143-L187 HydrophobicContact CG-CD1 4.2Å; M143-L187 HydrophobicContact CG-CG 3.95Å; M143-L187 HydrophobicContact SD-CD1 4.11Å; M150-L187 HydrophobicContact CG-CD2 4.46Å; L153-L187 HydrophobicContact CB-CD1 3.4Å; L153-L187 HydrophobicContact CD1-CD1 4.35Å; W154-L187 HydrophobicContact CB-CD2 4Å; W154-L187 HydrophobicContact CD2-CD2 4.49Å; W154-L187 HydrophobicContact CE3-CD2 3.87Å; L157-L187 HydrophobicContact CD1-CB 3.98Å; L157-L187 HydrophobicContact CD1-CD1 4.18Å; L157-L187 HydrophobicContact CD1-CD2 4.27Å; L157-L187 HydrophobicContact CD1-CG 4.38Å; V177-L187 CarbonylContact O-C 3.53Å; V177-L187 WeakPolarHBondContact O-CA 3.18Å; V178-L187 HydrophobicContact CB-CD2 3.54Å; V178-L187 HydrophobicContact CG2-CD2 3.61Å
188	C	98.4	Very high	95.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.4	175.6	-48.4	0	0	0	0	112.8	R138 W139 F176 V177	R138-C188 HydrophobicContact CB-CB 4.21Å; W139-C188 CarbonylContact O-C 3.49Å; W139-C188 WeakPolarHBondContact O-CA 3.5Å; W139-C188 WeakPolarHBondContact O-CB 3.39Å; F176-C188 CarbonylContact C-O 3.58Å; F176-C188 WeakPolarHBondContact CA-O 3.5Å; V177-C188 HydrophobicContact CB-CB 4.09Å; V177-C188 PolarHBondContact N-O 3.22Å; V177-C188 PolarHBondContact O-N 2.96Å
189	V	98.6	Very high	95.9	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.8	168.4	-172.6	0	0	0	0	108.5	R138 W139 L157 I173 F176 I207	R138-V189 CarbonylContact C-O 3.51Å; R138-V189 VanDerWaalsContact CA-O 3.29Å; R138-V189 WeakPolarHBondContact CA-O 3.48Å; W139-V189 HydrophobicContact CB-CB 4.35Å; W139-V189 PolarHBondContact N-O 2.99Å; W139-V189 PolarHBondContact O-N 3.23Å; L157-V189 HydrophobicContact CD2-CG2 3.95Å; I173-V189 HydrophobicContact CD1-CG1 4.43Å; I173-V189 HydrophobicContact CG1-CG1 4.4Å; I173-V189 HydrophobicContact CG2-CG1 3.83Å; F176-V189 HydrophobicContact CD1-CB 4.38Å; F176-V189 HydrophobicContact CD1-CG1 4.05Å; F176-V189 HydrophobicContact CD1-CG2 3.75Å; F176-V189 HydrophobicContact CE1-CB 4.43Å; F176-V189 HydrophobicContact CE1-CG1 3.74Å; F176-V189 HydrophobicContact CE1-CG2 3.9Å; F176-V189 HydrophobicContact CZ-CG1 4.33Å; V189-I207 HydrophobicContact CB-CD1 3.7Å; V189-I207 HydrophobicContact CG1-CD1 3.9Å; V189-I207 HydrophobicContact CG2-CD1 3.7Å; V189-I207 HydrophobicContact CG2-CG1 4.24Å; V189-I207 HydrophobicContact CG2-CG2 4.24Å
190	W	98.5	Very high	95.9	Very high	18 Å²	18	65.6 Å²	65.6	7%	0.068	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	137.2	-176.8	-71.7	37.8	0	0	0	110.1	F120 N133 G137 R138 C174 G175 H222	F120-W190 HydrophobicContact CE1-CB 4.29Å; F120-W190 HydrophobicContact CE1-CD2 4.23Å; F120-W190 AromaticContact CE1-CE3 3.96Å; F120-W190 HydrophobicContact CE1-CE3 3.96Å; F120-W190 HydrophobicContact CE1-CG 4.41Å; F120-W190 HydrophobicContact CZ-CB 4.09Å; F120-W190 AromaticContact CZ-CD2 3.74Å; F120-W190 HydrophobicContact CZ-CD2 3.74Å; F120-W190 AromaticContact CZ-CE3 3.87Å; F120-W190 HydrophobicContact CZ-CE3 3.87Å; F120-W190 AromaticContact CZ-CG 3.85Å; F120-W190 HydrophobicContact CZ-CG 3.85Å; N133-W190 HydrophobicContact CB-CE3 4.17Å; N133-W190 HydrophobicContact CB-CZ3 4.29Å; G137-W190 WeakPolarHBondContact O-CA 3.48Å; R138-W190 HydrophobicContact CB-CG 4.25Å; C174-W190 HydrophobicContact CB-CB 4.17Å; C174-W190 PolarHBondContact N-O 3.41Å; G175-W190 PolarHBondContact O-N 3.31Å; W190-H222 AromaticContact CD2-CE1 3.34Å; W190-H222 AromaticContact CD2-NE2 3.47Å; W190-H222 AromaticContact CE2-CE1 3.5Å; W190-H222 AromaticContact CE3-CE1 3.34Å; W190-H222 AromaticContact CE3-NE2 3.26Å; W190-H222 VanDerWaalsContact CE3-NE2 3.26Å; W190-H222 AromaticContact CG-NE2 3.97Å; W190-H222 AromaticContact CH2-CE1 3.67Å; W190-H222 AromaticContact CZ2-CE1 3.68Å; W190-H222 AromaticContact CZ3-CE1 3.5Å; W190-H222 AromaticContact CZ3-NE2 3.74Å
191	T	98.4	Very high	96.1	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153.2	-178.7	69.6	0	0	0	0	111.2	G136 G137 D172 N193 I203 Y219	G136-T191 WeakPolarHBondContact CA-O 3.38Å; G137-T191 PolarHBondContact N-O 2.94Å; G137-T191 PolarHBondContact O-N 3.04Å; D172-T191 CarbonylContact O-C 3.49Å; D172-T191 WeakPolarHBondContact O-CA 3.49Å; D172-T191 WeakPolarHBondContact O-CB 3.36Å; T191-N193 PolarHBondContact O-N 2.93Å; T191-I203 HydrophobicContact CG2-CD1 4.06Å; T191-I203 HydrophobicContact CG2-CG2 4.05Å; T191-Y219 HydrophobicContact CG2-CE2 4.46Å; T191-Y219 PolarHBondContact OG1-OH 3.35Å
192	R	97.2	Very high	96.3	Very high	65 Å²	65	69.6 Å²	69.6	25%	0.245	30%	0.297	C	S	.	.	S	Bend	trans	-69.6	-31.5	-173.4	-64.3	-177.1	-165.1	-89.6	0.4	114.9	Q132 N135 G136 K171 D172 C174	Q132-R192 VanDerWaalsContact CG-NH1 3.26Å; Q132-R192 VanDerWaalsContact O-CA 3.29Å; Q132-R192 WeakPolarHBondContact O-CA 3.19Å; Q132-R192 WeakPolarHBondContact O-CG 3.12Å; N135-R192 CarbonylContact C-O 3.51Å; G136-R192 PolarHBondContact N-O 2.8Å; K171-R192 PolarHBondContact O-NE 3.35Å; D172-R192 PolarHBondContact O-N 3.38Å; C174-R192 WeakPolarHBondContact SG-CG 3.16Å
193	N	95.8	Very high	96.6	Very high	65 Å²	65	59.7 Å²	59.7	35%	0.348	26%	0.26	S	S	.	.			trans	-140.8	118	-174.2	-175.7	-11.4	0	0	0	109.4	N135 T191 S195 D196 T200	N135-N193 WeakPolarHBondContact O-CA 3.07Å; T191-N193 PolarHBondContact O-N 2.93Å; N193-S195 WeakPolarHBondContact OD1-CA 3.37Å; N193-S195 WeakPolarHBondContact OD1-CB 3.21Å; N193-S195 PolarHBondContact OD1-N 2.84Å; N193-D196 PolarHBondContact OD1-N 3.37Å; N193-T200 PolarHBondContact O-OG1 3.26Å
194	G	94.8	Very high	96.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-99.8	0.5	176.8	0	0	0	0	0	114.3	N135 Y219 M221 K236 Y237	N135-G194 PolarHBondContact O-N 2.82Å; G194-Y219 WeakPolarHBondContact CA-OH 3.44Å; G194-M221 VanDerWaalsContact CA-SD 3.57Å; G194-K236 PolarHBondContact O-NZ 2.96Å; G194-Y237 WeakPolarHBondContact O-CE2 3.49Å; G194-Y237 PolarHBondContact O-OH 3.11Å; G194-Y237 VanDerWaalsContact O-OH 3.08Å
195	S	93.7	Very high	97.2	Very high	82 Å²	82	46 Å²	46	57%	0.573	21%	0.212	S	C	*	.	S	Bend	trans	-90.6	-18.8	178.4	-62.3	0	0	0	0	113.2	N193 E197	N193-S195 WeakPolarHBondContact OD1-CA 3.37Å; N193-S195 WeakPolarHBondContact OD1-CB 3.21Å; N193-S195 PolarHBondContact OD1-N 2.84Å; S195-E197 PolarHBondContact O-N 3.14Å; S195-E197 VanDerWaalsContact O-N 3.12Å
196	D	95.4	Very high	97.3	Very high	56 Å²	56	45.9 Å²	45.9	30%	0.299	21%	0.211	S	C	.	.			trans	-81.4	80.2	171.5	-177	-11.3	0	0	0	110.4	N193 R198 K199 T200	N193-D196 PolarHBondContact OD1-N 3.37Å; D196-R198 VanDerWaalsContact C-N 3.32Å; D196-R198 PolarHBondContact O-N 2.85Å; D196-K199 HydrophobicContact CB-CB 4.18Å; D196-K199 PolarHBondContact O-N 3.23Å; D196-K199 VanDerWaalsContact O-N 3.1Å; D196-K199 WeakPolarHBondContact OD1-CB 3.29Å; D196-K199 PolarHBondContact OD1-N 3.28Å; D196-K199 VanDerWaalsContact OD1-N 3.14Å; D196-K199 VanDerWaalsContact OD2-CB 3.3Å; D196-K199 WeakPolarHBondContact OD2-CB 3.48Å; D196-K199 WeakPolarHBondContact OD2-CE 3.29Å; D196-K199 IonicContact OD2-NZ 3.22Å; D196-K199 PolarHBondContact OD2-NZ 2.84Å; D196-T200 WeakPolarHBondContact O-CB 3.47Å; D196-T200 PolarHBondContact O-N 3.39Å; D196-T200 PolarHBondContact O-OG1 3.21Å
197	E	96.6	Very high	97.3	Very high	112 Å²	112	43.9 Å²	43.9	52%	0.523	20%	0.202	S	C	.	.	H	α-helix	trans	-48.3	-51	-176.6	175.6	177.1	-168.4	0	0	112.6	S195 K199 T200 L201 Y237	S195-E197 PolarHBondContact O-N 3.14Å; S195-E197 VanDerWaalsContact O-N 3.12Å; E197-K199 VanDerWaalsContact C-N 3.28Å; E197-K199 PolarHBondContact O-N 2.89Å; E197-T200 PolarHBondContact O-N 3.39Å; E197-L201 HydrophobicContact CG-CD1 3.75Å; E197-L201 HydrophobicContact CG-CG 4.26Å; E197-L201 WeakPolarHBondContact O-CB 3.38Å; E197-L201 WeakPolarHBondContact O-CG 3.49Å; E197-L201 PolarHBondContact O-N 3.28Å; E197-Y237 HydrophobicContact CB-CE1 3.89Å; E197-Y237 HydrophobicContact CG-CD1 4.21Å; E197-Y237 HydrophobicContact CG-CE1 3.59Å
198	R	97	Very high	97.3	Very high	196 Å²	196	45.4 Å²	45.4	74%	0.74	21%	0.209	S	C	*	.	H	α-helix	trans	-57.3	-44.1	-177.5	-177.2	179.8	-180	-175.3	0.7	110.9	D196 R202	D196-R198 VanDerWaalsContact C-N 3.32Å; D196-R198 PolarHBondContact O-N 2.85Å; R198-R202 WeakPolarHBondContact O-CB 3.35Å; R198-R202 WeakPolarHBondContact O-CG 3.33Å; R198-R202 PolarHBondContact O-N 2.9Å
199	K	96.8	Very high	97.2	Very high	53 Å²	53	53.4 Å²	53.4	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-74.4	-41.5	180	-163.6	-170.8	-63.8	150.2	0	111.9	L169 D172 D196 E197 L201 R202 I203	L169-K199 HydrophobicContact CD2-CG 3.89Å; D172-K199 HydrophobicContact CB-CD 4.03Å; D172-K199 VanDerWaalsContact OD1-CD 3.23Å; D172-K199 WeakPolarHBondContact OD1-CD 3.47Å; D172-K199 IonicContact OD1-NZ 2.76Å; D172-K199 PolarHBondContact OD1-NZ 3.37Å; D172-K199 WeakPolarHBondContact OD2-CD 3.5Å; D172-K199 IonicContact OD2-NZ 3.83Å; D196-K199 HydrophobicContact CB-CB 4.18Å; D196-K199 PolarHBondContact O-N 3.23Å; D196-K199 VanDerWaalsContact O-N 3.1Å; D196-K199 WeakPolarHBondContact OD1-CB 3.29Å; D196-K199 PolarHBondContact OD1-N 3.28Å; D196-K199 VanDerWaalsContact OD1-N 3.14Å; D196-K199 VanDerWaalsContact OD2-CB 3.3Å; D196-K199 WeakPolarHBondContact OD2-CB 3.48Å; D196-K199 WeakPolarHBondContact OD2-CE 3.29Å; D196-K199 IonicContact OD2-NZ 3.22Å; D196-K199 PolarHBondContact OD2-NZ 2.84Å; E197-K199 VanDerWaalsContact C-N 3.28Å; E197-K199 PolarHBondContact O-N 2.89Å; K199-L201 PolarHBondContact O-N 2.64Å; K199-R202 PolarHBondContact O-N 3.13Å; K199-I203 HydrophobicContact CG-CD1 4.29Å; K199-I203 WeakPolarHBondContact O-CG1 3.42Å; K199-I203 PolarHBondContact O-N 3.31Å
200	T	97.9	Very high	97.1	Very high	1 Å²	1	54 Å²	54	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-47.1	178.2	-58.5	0	0	0	0	111.2	W139 N193 D196 E197 I203 G204 Y219 Y237	W139-T200 HydrophobicContact CZ2-CG2 3.9Å; W139-T200 VanDerWaalsContact CZ2-O 3.26Å; W139-T200 WeakPolarHBondContact CZ2-O 3.47Å; W139-T200 PolarHBondContact NE1-O 2.89Å; W139-T200 VanDerWaalsContact NE1-O 3.17Å; N193-T200 PolarHBondContact O-OG1 3.26Å; D196-T200 WeakPolarHBondContact O-CB 3.47Å; D196-T200 PolarHBondContact O-N 3.39Å; D196-T200 PolarHBondContact O-OG1 3.21Å; E197-T200 PolarHBondContact O-N 3.39Å; T200-I203 WeakPolarHBondContact O-CB 3.39Å; T200-I203 PolarHBondContact O-N 3.49Å; T200-G204 PolarHBondContact O-N 2.84Å; T200-Y219 HydrophobicContact CG2-CD1 3.96Å; T200-Y219 HydrophobicContact CG2-CD2 3.6Å; T200-Y219 HydrophobicContact CG2-CE1 3.93Å; T200-Y219 HydrophobicContact CG2-CE2 3.57Å; T200-Y219 HydrophobicContact CG2-CG 3.78Å; T200-Y237 HydrophobicContact CG2-CD2 3.56Å; T200-Y237 HydrophobicContact CG2-CE2 3.73Å
201	L	98.2	Very high	97.1	Very high	44 Å²	44	53.3 Å²	53.3	23%	0.23	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-42	175.6	-69.7	175.4	0	0	0	112.4	W139 E197 K199 I203 G204 H205 Y237 V239	W139-L201 HydrophobicContact CH2-CD2 4.37Å; E197-L201 HydrophobicContact CG-CD1 3.75Å; E197-L201 HydrophobicContact CG-CG 4.26Å; E197-L201 WeakPolarHBondContact O-CB 3.38Å; E197-L201 WeakPolarHBondContact O-CG 3.49Å; E197-L201 PolarHBondContact O-N 3.28Å; K199-L201 PolarHBondContact O-N 2.64Å; L201-I203 VanDerWaalsContact C-N 3.31Å; L201-I203 PolarHBondContact O-N 2.93Å; L201-G204 PolarHBondContact O-N 2.96Å; L201-G204 VanDerWaalsContact O-N 3.17Å; L201-H205 PolarHBondContact O-CD2 2.85Å; L201-H205 VanDerWaalsContact O-CD2 3.23Å; L201-H205 PolarHBondContact O-N 3.31Å; L201-Y237 HydrophobicContact CD2-CG 4.31Å; L201-V239 HydrophobicContact CD2-CG1 3.71Å
202	R	98.1	Very high	97	Very high	133 Å²	133	60.1 Å²	60.1	50%	0.502	27%	0.273	S	S	.	.	H	α-helix	trans	-59.7	-41.2	174.9	-77.4	176.9	70.9	-162.2	1.5	112.2	L169 R198 K199 A206	L169-R202 HydrophobicContact CD1-CB 4.08Å; L169-R202 HydrophobicContact CD2-CB 4.39Å; R198-R202 WeakPolarHBondContact O-CB 3.35Å; R198-R202 WeakPolarHBondContact O-CG 3.33Å; R198-R202 PolarHBondContact O-N 2.9Å; K199-R202 PolarHBondContact O-N 3.13Å; R202-A206 VanDerWaalsContact O-CB 3.29Å; R202-A206 WeakPolarHBondContact O-CB 3.33Å; R202-A206 PolarHBondContact O-N 2.84Å
203	I	98.3	Very high	96.8	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-47.8	174.2	-68.7	165.4	0	0	0	109.8	L169 D172 I173 T191 K199 T200 L201 H205 A206 I207	L169-I203 HydrophobicContact CB-CG1 4.04Å; L169-I203 HydrophobicContact CD1-CG1 4.31Å; L169-I203 HydrophobicContact CD2-CG1 4.25Å; L169-I203 HydrophobicContact CG-CG1 4.44Å; D172-I203 HydrophobicContact CB-CD1 3.96Å; I173-I203 HydrophobicContact CD1-CG2 4.37Å; I173-I203 HydrophobicContact CG1-CG2 4.29Å; T191-I203 HydrophobicContact CG2-CD1 4.06Å; T191-I203 HydrophobicContact CG2-CG2 4.05Å; K199-I203 HydrophobicContact CG-CD1 4.29Å; K199-I203 WeakPolarHBondContact O-CG1 3.42Å; K199-I203 PolarHBondContact O-N 3.31Å; T200-I203 WeakPolarHBondContact O-CB 3.39Å; T200-I203 PolarHBondContact O-N 3.49Å; L201-I203 VanDerWaalsContact C-N 3.31Å; L201-I203 PolarHBondContact O-N 2.93Å; I203-H205 PolarHBondContact O-N 3.08Å; I203-A206 WeakPolarHBondContact O-CB 3.15Å; I203-A206 PolarHBondContact O-N 3.07Å; I203-A206 VanDerWaalsContact O-N 3.09Å; I203-I207 HydrophobicContact CG2-CD1 3.71Å; I203-I207 HydrophobicContact CG2-CG1 4.28Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.3Å; I203-I207 PolarHBondContact O-N 2.75Å
204	G	98.1	Very high	96.7	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-54.7	-51.4	178.3	0	0	0	0	0	112.9	W139 T200 L201 A206 I207 K208	W139-G204 VanDerWaalsContact CE2-CA 3.41Å; T200-G204 PolarHBondContact O-N 2.84Å; L201-G204 PolarHBondContact O-N 2.96Å; L201-G204 VanDerWaalsContact O-N 3.17Å; G204-A206 VanDerWaalsContact C-N 3.32Å; G204-A206 PolarHBondContact O-N 2.82Å; G204-I207 PolarHBondContact O-N 3.23Å; G204-K208 PolarHBondContact O-N 2.86Å
205	H	97.8	Very high	96.7	Very high	84 Å²	84	64.1 Å²	64.1	39%	0.389	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-33.9	176.1	-69.4	-57.8	0	0	0	113.2	L201 I203 K208 R209	L201-H205 PolarHBondContact O-CD2 2.85Å; L201-H205 VanDerWaalsContact O-CD2 3.23Å; L201-H205 PolarHBondContact O-N 3.31Å; I203-H205 PolarHBondContact O-N 3.08Å; H205-K208 PolarHBondContact O-N 2.83Å; H205-R209 WeakPolarHBondContact O-CG 3.17Å; H205-R209 PolarHBondContact O-N 3.34Å
206	A	97.9	Very high	96.8	Very high	9 Å²	9	63.8 Å²	63.8	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-38.6	174.9	0	0	0	0	0	111.8	Y166 L169 R202 I203 G204 R209 A210	Y166-A206 HydrophobicContact CD1-CB 3.94Å; L169-A206 HydrophobicContact CD1-CB 4.28Å; R202-A206 VanDerWaalsContact O-CB 3.29Å; R202-A206 WeakPolarHBondContact O-CB 3.33Å; R202-A206 PolarHBondContact O-N 2.84Å; I203-A206 WeakPolarHBondContact O-CB 3.15Å; I203-A206 PolarHBondContact O-N 3.07Å; I203-A206 VanDerWaalsContact O-N 3.09Å; G204-A206 VanDerWaalsContact C-N 3.32Å; G204-A206 PolarHBondContact O-N 2.82Å; A206-R209 PolarHBondContact O-N 3.05Å; A206-A210 WeakPolarHBondContact O-CB 3.33Å; A206-A210 PolarHBondContact O-N 2.55Å
207	I	98.2	Very high	96.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-45.6	172.9	-60.4	158.4	0	0	0	110.1	W139 I141 L157 Y166 V189 I203 G204 R209 A210 L211 F217	W139-I207 HydrophobicContact CB-CD1 4.1Å; W139-I207 HydrophobicContact CG-CD1 3.96Å; I141-I207 HydrophobicContact CD1-CG2 4.3Å; L157-I207 HydrophobicContact CD2-CG2 4.16Å; Y166-I207 HydrophobicContact CE1-CB 4.47Å; Y166-I207 HydrophobicContact CE1-CG1 3.84Å; V189-I207 HydrophobicContact CB-CD1 3.7Å; V189-I207 HydrophobicContact CG1-CD1 3.9Å; V189-I207 HydrophobicContact CG2-CD1 3.7Å; V189-I207 HydrophobicContact CG2-CG1 4.24Å; V189-I207 HydrophobicContact CG2-CG2 4.24Å; I203-I207 HydrophobicContact CG2-CD1 3.71Å; I203-I207 HydrophobicContact CG2-CG1 4.28Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.3Å; I203-I207 PolarHBondContact O-N 2.75Å; G204-I207 PolarHBondContact O-N 3.23Å; I207-R209 VanDerWaalsContact C-N 3.34Å; I207-R209 PolarHBondContact O-N 3.44Å; I207-A210 PolarHBondContact O-N 3.12Å; I207-L211 HydrophobicContact CG2-CD1 3.8Å; I207-L211 HydrophobicContact CG2-CG 4.17Å; I207-L211 WeakPolarHBondContact O-CB 3.36Å; I207-L211 WeakPolarHBondContact O-CG 3.35Å; I207-L211 PolarHBondContact O-N 3.1Å; I207-F217 HydrophobicContact CB-CE2 4.08Å; I207-F217 HydrophobicContact CG2-CD2 4.45Å; I207-F217 HydrophobicContact CG2-CE2 3.68Å; I207-F217 HydrophobicContact CG2-CZ 4.46Å
208	K	97.2	Very high	96.9	Very high	33 Å²	33	57.4 Å²	57.4	14%	0.143	27%	0.269	C	S	.	.	H	α-helix	trans	-55.4	-47.6	175.8	-79.4	-165.4	163.8	-163.5	0	112.6	G204 H205 L211 E212 L215 F217 V239	G204-K208 PolarHBondContact O-N 2.86Å; H205-K208 PolarHBondContact O-N 2.83Å; K208-L211 PolarHBondContact O-N 2.95Å; K208-E212 PolarHBondContact O-N 3.02Å; K208-L215 WeakPolarHBondContact CE-O 3.26Å; K208-L215 PolarHBondContact NZ-O 3.41Å; K208-F217 HydrophobicContact CB-CE2 4.18Å; K208-F217 HydrophobicContact CB-CZ 4.48Å; K208-F217 HydrophobicContact CG-CD2 3.66Å; K208-F217 HydrophobicContact CG-CE1 4.24Å; K208-F217 HydrophobicContact CG-CE2 3.3Å; K208-F217 HydrophobicContact CG-CG 4.28Å; K208-F217 HydrophobicContact CG-CZ 3.63Å; K208-V239 HydrophobicContact CD-CG2 4.26Å; K208-V239 WeakPolarHBondContact CE-O 2.89Å; K208-V239 WeakPolarHBondContact CE-OXT 3.01Å; K208-V239 HydrophobicContact CG-CG2 4.5Å; K208-V239 PolarHBondContact NZ-O 3.26Å; K208-V239 PolarHBondContact NZ-OXT 3.41Å
209	R	96.7	Very high	97	Very high	168 Å²	168	48 Å²	48	63%	0.634	23%	0.233	S	C	*	.	H	α-helix	trans	-62.7	-43.9	177.1	-72.4	-168.3	-59.1	-84.6	-1.3	112.4	H205 A206 I207 L211 E212	H205-R209 WeakPolarHBondContact O-CG 3.17Å; H205-R209 PolarHBondContact O-N 3.34Å; A206-R209 PolarHBondContact O-N 3.05Å; I207-R209 VanDerWaalsContact C-N 3.34Å; I207-R209 PolarHBondContact O-N 3.44Å; R209-L211 VanDerWaalsContact C-N 3.27Å; R209-L211 PolarHBondContact O-N 3.23Å; R209-E212 PolarHBondContact O-N 3.28Å
210	A	97.2	Very high	96.9	Very high	12 Å²	12	46.1 Å²	46.1	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-36.1	178.5	0	0	0	0	0	112.7	R156 W165 Y166 A206 I207	R156-A210 PolarHBondContact NE-O 3.32Å; R156-A210 PolarHBondContact NH2-O 2.89Å; W165-A210 HydrophobicContact CE3-CB 3.91Å; W165-A210 HydrophobicContact CZ3-CB 4.44Å; Y166-A210 HydrophobicContact CE1-CB 4.13Å; A206-A210 WeakPolarHBondContact O-CB 3.33Å; A206-A210 PolarHBondContact O-N 2.55Å; I207-A210 PolarHBondContact O-N 3.12Å
211	L	97.3	Very high	96.8	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-86.9	-16.8	-178.3	-66.1	-172.4	0	0	0	114	I141 L153 R156 L157 I207 K208 R209 V213 F217	I141-L211 HydrophobicContact CD1-CD1 3.4Å; I141-L211 VanDerWaalsContact CD1-CD1 3.4Å; L153-L211 HydrophobicContact CD2-CB 4.15Å; L153-L211 HydrophobicContact CD2-CD2 4.25Å; R156-L211 HydrophobicContact CB-CD2 3.61Å; L157-L211 HydrophobicContact CD2-CD1 4.01Å; L157-L211 HydrophobicContact CD2-CD2 3.86Å; L157-L211 HydrophobicContact CD2-CG 4.23Å; L157-L211 HydrophobicContact CG-CD1 4.38Å; L157-L211 HydrophobicContact CG-CD2 3.96Å; I207-L211 HydrophobicContact CG2-CD1 3.8Å; I207-L211 HydrophobicContact CG2-CG 4.17Å; I207-L211 WeakPolarHBondContact O-CB 3.36Å; I207-L211 WeakPolarHBondContact O-CG 3.35Å; I207-L211 PolarHBondContact O-N 3.1Å; K208-L211 PolarHBondContact O-N 2.95Å; R209-L211 VanDerWaalsContact C-N 3.27Å; R209-L211 PolarHBondContact O-N 3.23Å; L211-V213 VanDerWaalsContact C-N 3.28Å; L211-V213 HydrophobicContact CB-CG1 4.41Å; L211-V213 HydrophobicContact CB-CG2 3.86Å; L211-V213 WeakPolarHBondContact O-CG1 3.3Å; L211-V213 PolarHBondContact O-N 3.4Å; L211-F217 HydrophobicContact CD1-CZ 4.13Å
212	E	96.1	Very high	96.6	Very high	144 Å²	144	44.7 Å²	44.7	67%	0.673	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	44.5	-177.6	-65.8	163.1	-162.1	0	0	112.2	R156 K208 R209	R156-E212 IonicContact CZ-OE1 3.78Å; R156-E212 IonicContact CZ-OE2 2.69Å; R156-E212 IonicContact NH1-OE1 2.8Å; R156-E212 IonicContact NH1-OE2 3.8Å; R156-E212 PolarHBondContact NH1-OE2 3.28Å; R156-E212 IonicContact NH2-OE1 3.75Å; R156-E212 PolarHBondContact NH2-OE1 3.27Å; R156-E212 IonicContact NH2-OE2 3.89Å; R156-E212 PolarHBondContact NH2-OE2 3.25Å; R156-E212 VanDerWaalsContact NH2-OE2 3.11Å; K208-E212 PolarHBondContact O-N 3.02Å; R209-E212 PolarHBondContact O-N 3.28Å
213	V	94.3	Very high	96	Very high	30 Å²	30	43.3 Å²	43.3	18%	0.182	22%	0.217	C	C	.	.			trans	-123.7	145	-179.2	-64.2	0	0	0	0	112.7	L153 L211 L215 F217	L153-V213 HydrophobicContact CD1-CG1 4.1Å; L153-V213 HydrophobicContact CD2-CG1 3.65Å; L153-V213 HydrophobicContact CG-CG1 4.47Å; L211-V213 VanDerWaalsContact C-N 3.28Å; L211-V213 HydrophobicContact CB-CG1 4.41Å; L211-V213 HydrophobicContact CB-CG2 3.86Å; L211-V213 WeakPolarHBondContact O-CG1 3.3Å; L211-V213 PolarHBondContact O-N 3.4Å; V213-L215 HydrophobicContact CB-CD1 4.32Å; V213-L215 HydrophobicContact CB-CG 4.13Å; V213-L215 HydrophobicContact CG2-CD1 4.3Å; V213-L215 HydrophobicContact CG2-CG 4.27Å; V213-F217 HydrophobicContact CG2-CE1 3.9Å; V213-F217 HydrophobicContact CG2-CZ 3.72Å
214	D	93.2	Very high	95.3	Very high	160 Å²	160	44.6 Å²	44.6	86%	0.856	22%	0.223	S	C	*	.			trans	-102.1	71.5	170	-169.6	22.5	0	0	0	110.4
215	L	95	Very high	93.9	Very high	25 Å²	25	46 Å²	46	13%	0.131	23%	0.233	C	C	.	.			trans	-123.4	145.8	175.9	-56.5	176.2	0	0	0	109.4	I141 M143 L149 L153 K208 V213 F217	I141-L215 HydrophobicContact CG2-CD1 3.96Å; M143-L215 HydrophobicContact CE-CD1 4.21Å; L149-L215 HydrophobicContact CD2-CD1 4.2Å; L153-L215 HydrophobicContact CD1-CD1 4.44Å; K208-L215 WeakPolarHBondContact CE-O 3.26Å; K208-L215 PolarHBondContact NZ-O 3.41Å; V213-L215 HydrophobicContact CB-CD1 4.32Å; V213-L215 HydrophobicContact CB-CG 4.13Å; V213-L215 HydrophobicContact CG2-CD1 4.3Å; V213-L215 HydrophobicContact CG2-CG 4.27Å; L215-F217 HydrophobicContact CB-CD1 4.28Å; L215-F217 HydrophobicContact CB-CE1 3.95Å; L215-F217 WeakPolarHBondContact O-CD1 3.3Å; L215-F217 PolarHBondContact O-N 3.4Å
216	S	95.6	Very high	92.4	Very high	74 Å²	74	46.7 Å²	46.7	52%	0.517	24%	0.236	S	C	.	.			trans	-69.3	125.5	171.1	-179	0	0	0	0	110.1
217	F	97.4	Very high	90.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.			trans	-107	138.3	173.1	-60.8	-1.4	0	0	0	108.7	W139 I140 I141 I207 K208 L211 V213 L215 T238 V239	W139-F217 HydrophobicContact CE3-CB 3.82Å; W139-F217 HydrophobicContact CZ3-CB 4.18Å; I140-F217 WeakPolarHBondContact O-CA 3.39Å; I141-F217 HydrophobicContact CB-CD1 4.31Å; I141-F217 HydrophobicContact CB-CE1 4.25Å; I141-F217 HydrophobicContact CD1-CE1 4Å; I141-F217 HydrophobicContact CD1-CE2 3.98Å; I141-F217 HydrophobicContact CD1-CZ 3.7Å; I141-F217 HydrophobicContact CG1-CD1 3.9Å; I141-F217 HydrophobicContact CG1-CD2 4.28Å; I141-F217 HydrophobicContact CG1-CE1 3.84Å; I141-F217 HydrophobicContact CG1-CE2 4.21Å; I141-F217 HydrophobicContact CG1-CG 4.14Å; I141-F217 HydrophobicContact CG1-CZ 4Å; I141-F217 HydrophobicContact CG2-CD1 3.82Å; I141-F217 HydrophobicContact CG2-CE1 3.49Å; I141-F217 VanDerWaalsContact CG2-CE1 3.49Å; I141-F217 HydrophobicContact CG2-CZ 4.24Å; I207-F217 HydrophobicContact CB-CE2 4.08Å; I207-F217 HydrophobicContact CG2-CD2 4.45Å; I207-F217 HydrophobicContact CG2-CE2 3.68Å; I207-F217 HydrophobicContact CG2-CZ 4.46Å; K208-F217 HydrophobicContact CB-CE2 4.18Å; K208-F217 HydrophobicContact CB-CZ 4.48Å; K208-F217 HydrophobicContact CG-CD2 3.66Å; K208-F217 HydrophobicContact CG-CE1 4.24Å; K208-F217 HydrophobicContact CG-CE2 3.3Å; K208-F217 HydrophobicContact CG-CG 4.28Å; K208-F217 HydrophobicContact CG-CZ 3.63Å; L211-F217 HydrophobicContact CD1-CZ 4.13Å; V213-F217 HydrophobicContact CG2-CE1 3.9Å; V213-F217 HydrophobicContact CG2-CZ 3.72Å; L215-F217 HydrophobicContact CB-CD1 4.28Å; L215-F217 HydrophobicContact CB-CE1 3.95Å; L215-F217 WeakPolarHBondContact O-CD1 3.3Å; L215-F217 PolarHBondContact O-N 3.4Å; F217-T238 VanDerWaalsContact O-CA 3.29Å; F217-T238 WeakPolarHBondContact O-CA 3.19Å; F217-T238 WeakPolarHBondContact O-CG2 3.03Å; F217-V239 HydrophobicContact CB-CG2 3.81Å; F217-V239 HydrophobicContact CD2-CG2 4.16Å; F217-V239 HydrophobicContact CG-CG2 4.33Å; F217-V239 PolarHBondContact N-O 2.96Å; F217-V239 PolarHBondContact O-N 2.95Å
218	T	97.3	Very high	89.5	Confident	34 Å²	34	59.1 Å²	59.1	21%	0.209	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	147.8	174.8	56.9	0	0	0	0	110.7	W139 I140 V235 Y237	W139-T218 CarbonylContact C-O 3.55Å; W139-T218 WeakPolarHBondContact CA-O 3.28Å; I140-T218 PolarHBondContact N-O 3.46Å; I140-T218 PolarHBondContact O-N 2.92Å; T218-V235 HydrophobicContact CG2-CG1 3.9Å; T218-V235 HydrophobicContact CG2-CG2 4.11Å; T218-Y237 CarbonylContact C-O 3.49Å; T218-Y237 WeakPolarHBondContact CA-O 3.46Å
219	Y	97.6	Very high	88.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.2	174.8	-168.4	-92	0	0	0	110.2	G137 R138 W139 T191 G194 T200 M221 K236 Y237	G137-Y219 WeakPolarHBondContact CA-OH 3.37Å; G137-Y219 PolarHBondContact N-OH 2.68Å; R138-Y219 WeakPolarHBondContact O-CA 3.36Å; W139-Y219 AromaticContact CD1-CD2 3.73Å; W139-Y219 AromaticContact CD2-CD2 3.7Å; W139-Y219 HydrophobicContact CD2-CD2 3.7Å; W139-Y219 HydrophobicContact CD2-CG 4.37Å; W139-Y219 AromaticContact CE2-CD2 3.62Å; W139-Y219 HydrophobicContact CE3-CD2 4.32Å; W139-Y219 AromaticContact CG-CD2 3.78Å; W139-Y219 HydrophobicContact CG-CD2 3.78Å; W139-Y219 HydrophobicContact CG-CE2 4.47Å; W139-Y219 HydrophobicContact CZ2-CD2 4.18Å; W139-Y219 HydrophobicContact CZ2-CG 4.42Å; W139-Y219 AromaticContact NE1-CD2 3.64Å; T191-Y219 HydrophobicContact CG2-CE2 4.46Å; T191-Y219 PolarHBondContact OG1-OH 3.35Å; G194-Y219 WeakPolarHBondContact CA-OH 3.44Å; T200-Y219 HydrophobicContact CG2-CD1 3.96Å; T200-Y219 HydrophobicContact CG2-CD2 3.6Å; T200-Y219 HydrophobicContact CG2-CE1 3.93Å; T200-Y219 HydrophobicContact CG2-CE2 3.57Å; T200-Y219 HydrophobicContact CG2-CG 3.78Å; Y219-M221 HydrophobicContact CE1-SD 3.9Å; Y219-K236 HydrophobicContact CD1-CB 4.45Å; Y219-K236 PolarHBondContact O-N 3.39Å; Y219-Y237 AromaticContact CD1-CD2 3.65Å; Y219-Y237 HydrophobicContact CD1-CD2 3.65Å; Y219-Y237 HydrophobicContact CD1-CE2 4.05Å; Y219-Y237 HydrophobicContact CE1-CD2 4.4Å; Y219-Y237 HydrophobicContact CE1-CE2 4.4Å; Y219-Y237 AromaticContact CG-CD2 3.95Å; Y219-Y237 HydrophobicContact CG-CD2 3.95Å; Y219-Y237 PolarHBondContact N-O 3.37Å
220	E	95.9	Very high	87.1	Confident	13 Å²	13	55.8 Å²	55.8	6%	0.061	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134	175.5	-63.2	177.8	174.6	0	0	109.4	G137 R138 I140 K234	G137-E220 CarbonylContact C-O 3.5Å; G137-E220 WeakPolarHBondContact CA-O 3.23Å; R138-E220 IonicContact CZ-OE2 3.11Å; R138-E220 PolarHBondContact N-O 3.03Å; R138-E220 IonicContact NE-OE2 2.85Å; R138-E220 IonicContact NH2-OE2 2.84Å; R138-E220 PolarHBondContact NH2-OE2 2.94Å; R138-E220 PolarHBondContact O-N 3.34Å; I140-E220 HydrophobicContact CD1-CB 4.26Å; I140-E220 HydrophobicContact CD1-CG 3.7Å; I140-E220 WeakPolarHBondContact CD1-OE2 3.33Å; E220-K234 HydrophobicContact CG-CB 4.21Å
221	M	95.2	Very high	85.9	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.044	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	149.4	169.7	-60.5	-68	-64.1	0	0	110.1	G136 G194 Y219 D224 C225 K236	G136-M221 WeakPolarHBondContact O-CE 2.8Å; G194-M221 VanDerWaalsContact CA-SD 3.57Å; Y219-M221 HydrophobicContact CE1-SD 3.9Å; M221-D224 HydrophobicContact CB-CB 4.21Å; M221-D224 WeakPolarHBondContact CB-OD2 3.48Å; M221-C225 PolarHBondContact O-SG 3.23Å; M221-C225 VanDerWaalsContact O-SG 3.39Å; M221-K236 HydrophobicContact CG-CD 3.68Å; M221-K236 HydrophobicContact SD-CD 3.71Å; M221-K236 PolarHBondContact SD-NZ 3.27Å
222	H	93.1	Very high	84.6	Confident	6 Å²	6	66.1 Å²	66.1	3%	0.028	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-42.6	174.4	-73.5	-52.3	0	0	0	111.9	W128 N133 G136 G137 W190 D224 C225	W128-H222 HydrophobicContact CB-CB 4.17Å; N133-H222 PolarHBondContact O-CD2 2.86Å; G136-H222 VanDerWaalsContact C-CD2 3.44Å; G136-H222 PolarHBondContact O-N 2.85Å; G137-H222 VanDerWaalsContact CA-CD2 3.44Å; G137-H222 WeakPolarHBondContact CA-CD2 3.17Å; G137-H222 WeakPolarHBondContact CA-NE2 3.4Å; G137-H222 PolarHBondContact N-CD2 2.75Å; G137-H222 VanDerWaalsContact N-CD2 3.3Å; G137-H222 PolarHBondContact O-NE2 2.86Å; W190-H222 AromaticContact CD2-CE1 3.34Å; W190-H222 AromaticContact CD2-NE2 3.47Å; W190-H222 AromaticContact CE2-CE1 3.5Å; W190-H222 AromaticContact CE3-CE1 3.34Å; W190-H222 AromaticContact CE3-NE2 3.26Å; W190-H222 VanDerWaalsContact CE3-NE2 3.26Å; W190-H222 AromaticContact CG-NE2 3.97Å; W190-H222 AromaticContact CH2-CE1 3.67Å; W190-H222 AromaticContact CZ2-CE1 3.68Å; W190-H222 AromaticContact CZ3-CE1 3.5Å; W190-H222 AromaticContact CZ3-NE2 3.74Å; H222-D224 VanDerWaalsContact C-N 3.34Å; H222-D224 PolarHBondContact O-N 3.35Å; H222-C225 WeakPolarHBondContact O-CB 3.06Å; H222-C225 PolarHBondContact O-N 2.8Å; H222-C225 VanDerWaalsContact O-N 3.14Å
223	E	87.1	Confident	83.7	Confident	103 Å²	103	64.8 Å²	64.8	48%	0.481	34%	0.341	S	S	.	.	H	α-helix	trans	-58.9	-41	178	-61.4	175.6	173	0	0	112.6	C225 E226	E223-C225 PolarHBondContact O-N 3.08Å; E223-E226 WeakPolarHBondContact O-CB 3.09Å; E223-E226 PolarHBondContact O-N 2.65Å
224	D	82.3	Confident	83.3	Confident	29 Å²	29	65 Å²	65	16%	0.155	34%	0.34	C	S	.	.	H	α-helix	trans	-68.3	-23.4	179.9	-71.1	-40	0	0	0	113.1	M221 H222 E226 K229	M221-D224 HydrophobicContact CB-CB 4.21Å; M221-D224 WeakPolarHBondContact CB-OD2 3.48Å; H222-D224 VanDerWaalsContact C-N 3.34Å; H222-D224 PolarHBondContact O-N 3.35Å; D224-E226 VanDerWaalsContact C-N 3.3Å; D224-K229 HydrophobicContact CB-CD 4.49Å; D224-K229 IonicContact OD1-NZ 3.92Å; D224-K229 PolarHBondContact OD1-NZ 2.79Å
225	C	70.4	Confident	83.2	Confident	31 Å²	31	59.8 Å²	59.8	21%	0.209	31%	0.314	C	S	.	.	H	α-helix	trans	-67.9	-33.9	176.6	-70.7	0	0	0	0	111.7	R138 M221 H222 E223 K234	R138-C225 PolarHBondContact NH2-SG 2.82Å; M221-C225 PolarHBondContact O-SG 3.23Å; M221-C225 VanDerWaalsContact O-SG 3.39Å; H222-C225 WeakPolarHBondContact O-CB 3.06Å; H222-C225 PolarHBondContact O-N 2.8Å; H222-C225 VanDerWaalsContact O-N 3.14Å; E223-C225 PolarHBondContact O-N 3.08Å; C225-K234 PolarHBondContact O-NZ 2.84Å
226	E	64.7	Low	83.2	Confident	97 Å²	97	62.4 Å²	62.4	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-72.1	-36.8	-178.5	-52.7	-153.1	110.9	0	0	112.6	W128 E223 D224 N228	W128-E226 WeakPolarHBondContact CH2-OE1 3.5Å; W128-E226 WeakPolarHBondContact CZ2-OE1 3.46Å; W128-E226 VanDerWaalsContact CZ3-CD 3.45Å; W128-E226 VanDerWaalsContact CZ3-OE1 3.22Å; W128-E226 WeakPolarHBondContact CZ3-OE1 3.5Å; W128-E226 WeakPolarHBondContact CZ3-OE2 3.29Å; E223-E226 WeakPolarHBondContact O-CB 3.09Å; E223-E226 PolarHBondContact O-N 2.65Å; D224-E226 VanDerWaalsContact C-N 3.3Å; E226-N228 PolarHBondContact O-N 3.47Å
227	M	67.1	Low	83.2	Confident	127 Å²	127	60.1 Å²	60.1	63%	0.626	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	9.1	-172.6	-64.2	-174	74.6	0	0	114.5	K229	M227-K229 HydrophobicContact CB-CD 4.43Å; M227-K229 HydrophobicContact CB-CG 4Å; M227-K229 PolarHBondContact O-N 3.03Å
228	N	68.8	Low	83.2	Confident	144 Å²	144	63.9 Å²	63.9	77%	0.77	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	29.9	-177.3	-75.8	-38.7	0	0	0	114.3	E226	E226-N228 PolarHBondContact O-N 3.47Å
229	K	71.6	Confident	83.2	Confident	64 Å²	64	63.9 Å²	63.9	28%	0.278	33%	0.327	S	S	.	.			trans	-58.5	150.5	178.1	-70	179.4	-179.7	175.1	0	111.2	D224 M227 Q233 K234	D224-K229 HydrophobicContact CB-CD 4.49Å; D224-K229 IonicContact OD1-NZ 3.92Å; D224-K229 PolarHBondContact OD1-NZ 2.79Å; M227-K229 HydrophobicContact CB-CD 4.43Å; M227-K229 HydrophobicContact CB-CG 4Å; M227-K229 PolarHBondContact O-N 3.03Å; K229-Q233 HydrophobicContact CB-CB 4.36Å; K229-K234 HydrophobicContact CB-CG 3.99Å; K229-K234 WeakPolarHBondContact O-CE 3.46Å
230	P	72.9	Confident	82.4	Confident	67 Å²	67	67.1 Å²	67.1	44%	0.435	34%	0.343	S	S	.	.			trans	-50.9	145.6	165.4	-27.6	37.3	0	0	0	111.5	D232 Q233 K234	P230-D232 VanDerWaalsContact C-N 3.27Å; P230-D232 WeakPolarHBondContact CB-OD1 3.45Å; P230-D232 PolarHBondContact O-N 3.24Å; P230-Q233 HydrophobicContact CB-CG 4.34Å; P230-Q233 PolarHBondContact O-N 3.04Å; P230-K234 PolarHBondContact O-N 3.26Å
231	M	70.4	Confident	81.7	Confident	109 Å²	109	69.9 Å²	69.9	54%	0.537	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-35	-170.3	-172.1	169	179.4	0	0	113.1	R184 Q233 K234	R184-M231 PolarHBondContact NH1-SD 3.02Å; R184-M231 VanDerWaalsContact NH1-SD 3.41Å; M231-Q233 PolarHBondContact O-N 3.41Å; M231-K234 PolarHBondContact O-N 2.62Å
232	D	71	Confident	81	Confident	123 Å²	123	73.3 Å²	73.3	66%	0.658	38%	0.376	S	S	*	.	H	α-helix	trans	-61.6	-30.1	173.8	57	-50	0	0	0	112.9	P230	P230-D232 VanDerWaalsContact C-N 3.27Å; P230-D232 WeakPolarHBondContact CB-OD1 3.45Å; P230-D232 PolarHBondContact O-N 3.24Å
233	Q	76.4	Confident	80.3	Confident	115 Å²	115	77.2 Å²	77.2	54%	0.537	40%	0.396	S	S	.	.	H	α-helix	trans	-89.5	-7.5	179.7	-61.6	-179.4	9.2	0	0	113.6	K229 P230 M231	K229-Q233 HydrophobicContact CB-CB 4.36Å; P230-Q233 HydrophobicContact CB-CG 4.34Å; P230-Q233 PolarHBondContact O-N 3.04Å; M231-Q233 PolarHBondContact O-N 3.41Å
234	K	85.7	Confident	79.8	Confident	35 Å²	35	75.6 Å²	75.6	15%	0.152	39%	0.391	C	S	.	.	H	α-helix	trans	-86.1	-23	177.3	-63.7	-166.5	-170.1	-162.5	0	113	E220 C225 K229 P230 M231 K236	E220-K234 HydrophobicContact CG-CB 4.21Å; C225-K234 PolarHBondContact O-NZ 2.84Å; K229-K234 HydrophobicContact CB-CG 3.99Å; K229-K234 WeakPolarHBondContact O-CE 3.46Å; P230-K234 PolarHBondContact O-N 3.26Å; M231-K234 PolarHBondContact O-N 2.62Å; K234-K236 PolarHBondContact O-N 2.77Å
235	V	92.5	Very high	79.7	Confident	50 Å²	50	78.7 Å²	78.7	30%	0.303	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	113.4	-177.7	179.2	0	0	0	0	109.1	T218 Y237	T218-V235 HydrophobicContact CG2-CG1 3.9Å; T218-V235 HydrophobicContact CG2-CG2 4.11Å; V235-Y237 WeakPolarHBondContact CG1-O 3.46Å
236	K	94.5	Very high	80.3	Confident	80 Å²	80	82.1 Å²	82.1	35%	0.348	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-40.9	178.3	-167.6	174.9	-173.7	-178	0	112.4	G194 Y219 M221 K234	G194-K236 PolarHBondContact O-NZ 2.96Å; Y219-K236 HydrophobicContact CD1-CB 4.45Å; Y219-K236 PolarHBondContact O-N 3.39Å; M221-K236 HydrophobicContact CG-CD 3.68Å; M221-K236 HydrophobicContact SD-CD 3.71Å; M221-K236 PolarHBondContact SD-NZ 3.27Å; K234-K236 PolarHBondContact O-N 2.77Å
237	Y	96.5	Very high	81.5	Confident	27 Å²	27	81 Å²	81	11%	0.106	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.1	178.9	-47.1	-66.2	0	0	0	111	G194 E197 T200 L201 T218 Y219 V235	G194-Y237 WeakPolarHBondContact O-CE2 3.49Å; G194-Y237 PolarHBondContact O-OH 3.11Å; G194-Y237 VanDerWaalsContact O-OH 3.08Å; E197-Y237 HydrophobicContact CB-CE1 3.89Å; E197-Y237 HydrophobicContact CG-CD1 4.21Å; E197-Y237 HydrophobicContact CG-CE1 3.59Å; T200-Y237 HydrophobicContact CG2-CD2 3.56Å; T200-Y237 HydrophobicContact CG2-CE2 3.73Å; L201-Y237 HydrophobicContact CD2-CG 4.31Å; T218-Y237 CarbonylContact C-O 3.49Å; T218-Y237 WeakPolarHBondContact CA-O 3.46Å; Y219-Y237 AromaticContact CD1-CD2 3.65Å; Y219-Y237 HydrophobicContact CD1-CD2 3.65Å; Y219-Y237 HydrophobicContact CD1-CE2 4.05Å; Y219-Y237 HydrophobicContact CE1-CD2 4.4Å; Y219-Y237 HydrophobicContact CE1-CE2 4.4Å; Y219-Y237 AromaticContact CG-CD2 3.95Å; Y219-Y237 HydrophobicContact CG-CD2 3.95Å; Y219-Y237 PolarHBondContact N-O 3.37Å; V235-Y237 WeakPolarHBondContact CG1-O 3.46Å
238	T	96.6	Very high	82.7	Confident	79 Å²	79	77.2 Å²	77.2	49%	0.485	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.7	174.4	-57.8	0	0	0	0	108.6	F217	F217-T238 VanDerWaalsContact O-CA 3.29Å; F217-T238 WeakPolarHBondContact O-CA 3.19Å; F217-T238 WeakPolarHBondContact O-CG2 3.03Å
239	V	96	Very high	84	Confident	33 Å²	33	71.1 Å²	71.1	20%	0.2	37%	0.367	C	S	.	.			trans	-129.8	0	171.6	-66	0	0	0	0	112.2	W139 L201 K208 F217	W139-V239 HydrophobicContact CE3-CG2 4.16Å; W139-V239 HydrophobicContact CH2-CB 4.25Å; W139-V239 HydrophobicContact CH2-CG1 3.67Å; W139-V239 HydrophobicContact CH2-CG2 3.78Å; W139-V239 HydrophobicContact CZ2-CG1 4.25Å; W139-V239 HydrophobicContact CZ2-CG2 4.41Å; W139-V239 HydrophobicContact CZ3-CB 4.42Å; W139-V239 HydrophobicContact CZ3-CG1 4.31Å; W139-V239 HydrophobicContact CZ3-CG2 3.63Å; L201-V239 HydrophobicContact CD2-CG1 3.71Å; K208-V239 HydrophobicContact CD-CG2 4.26Å; K208-V239 WeakPolarHBondContact CE-O 2.89Å; K208-V239 WeakPolarHBondContact CE-OXT 3.01Å; K208-V239 HydrophobicContact CG-CG2 4.5Å; K208-V239 PolarHBondContact NZ-O 3.26Å; K208-V239 PolarHBondContact NZ-OXT 3.41Å; F217-V239 HydrophobicContact CB-CG2 3.81Å; F217-V239 HydrophobicContact CD2-CG2 4.16Å; F217-V239 HydrophobicContact CG-CG2 4.33Å; F217-V239 PolarHBondContact N-O 2.96Å; F217-V239 PolarHBondContact O-N 2.95Å

Retrieved 239 of 239 residues in 345.1 ms (Link to these results)

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