A0A5K4F1Z7_SCHMA Loading...

Sm domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1Z7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 204 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	35.5	Very low	57.6	Low	251 Å²	251	121.9 Å²	121.9	100%	1.236	68%	0.676	S	S	*	*				0	106.4	0	-89.4	173.8	168.8	0	0	108.5
2	K	39.7	Very low	58.3	Low	208 Å²	208	118.3 Å²	118.3	90%	0.904	65%	0.651	S	S	*	*			trans	-86.7	115.1	166.3	-86.6	-179.5	174.2	177.9	0	106.5	V4	K2-V4 PolarHBondContact O-N 2.74Å
3	A	51.1	Low	58.9	Low	93 Å²	93	115.5 Å²	115.5	77%	0.769	64%	0.638	S	S	*	*			trans	-69.5	107.5	168.4	0	0	0	0	0	107.2	L5	A3-L5 VanDerWaalsContact C-N 3.32Å; A3-L5 PolarHBondContact O-N 2.58Å; A3-L5 VanDerWaalsContact O-N 3.11Å
4	V	50.3	Low	59.3	Low	135 Å²	135	120.1 Å²	120.1	82%	0.818	64%	0.641	S	S	*	*			trans	-73.7	96.5	166.7	-178.7	0	0	0	0	104.8	K2 D6	K2-V4 PolarHBondContact O-N 2.74Å; V4-D6 PolarHBondContact O-N 2.98Å
5	L	53.9	Low	59.8	Low	130 Å²	130	121.1 Å²	121.1	68%	0.681	63%	0.633	S	S	*	*			trans	-62.6	120.6	164.4	-85.2	153.7	0	0	0	106.2	A3 D7	A3-L5 VanDerWaalsContact C-N 3.32Å; A3-L5 PolarHBondContact O-N 2.58Å; A3-L5 VanDerWaalsContact O-N 3.11Å; L5-D7 PolarHBondContact O-N 3.07Å
6	D	64.5	Low	60	Low	103 Å²	103	114.8 Å²	114.8	55%	0.551	60%	0.602	S	S	*	*			trans	-52.9	127	174.1	177.7	32.2	0	0	0	110	V4 H8 S9 A10	V4-D6 PolarHBondContact O-N 2.98Å; D6-H8 PolarHBondContact O-N 3.38Å; D6-H8 VanDerWaalsContact O-N 3.1Å; D6-S9 WeakPolarHBondContact O-CB 3.28Å; D6-S9 PolarHBondContact O-N 2.85Å; D6-A10 PolarHBondContact O-N 3.46Å
7	D	69.7	Low	60.6	Low	131 Å²	131	115.5 Å²	115.5	70%	0.701	60%	0.595	S	S	*	*	H	α-helix	trans	-55.3	-34.2	-171	-77.2	-25.5	0	0	0	111.5	L5 A10 C11	L5-D7 PolarHBondContact O-N 3.07Å; D7-A10 PolarHBondContact O-N 3.04Å; D7-C11 WeakPolarHBondContact O-CB 3.44Å; D7-C11 PolarHBondContact O-N 3.41Å; D7-C11 PolarHBondContact O-SG 2.9Å; D7-C11 VanDerWaalsContact O-SG 3.34Å
8	H	71.1	Confident	61.1	Low	124 Å²	124	113.2 Å²	113.2	57%	0.574	58%	0.584	S	S	*	*	H	α-helix	trans	-61.5	-47.8	176.7	-174.7	-77.2	0	0	0	112.2	D6 A10 C11 E12	D6-H8 PolarHBondContact O-N 3.38Å; D6-H8 VanDerWaalsContact O-N 3.1Å; H8-A10 VanDerWaalsContact C-N 3.31Å; H8-A10 PolarHBondContact O-N 2.99Å; H8-C11 PolarHBondContact O-N 3.25Å; H8-E12 WeakPolarHBondContact O-CG 3.49Å; H8-E12 PolarHBondContact O-N 2.9Å
9	S	66.7	Low	61.6	Low	60 Å²	60	113.6 Å²	113.6	42%	0.42	58%	0.577	S	S	.	*	H	α-helix	trans	-64.3	-38.4	179.4	-65.9	0	0	0	0	111.7	D6 E12 V13	D6-S9 WeakPolarHBondContact O-CB 3.28Å; D6-S9 PolarHBondContact O-N 2.85Å; S9-E12 PolarHBondContact O-N 2.67Å; S9-V13 WeakPolarHBondContact O-CG2 3.29Å; S9-V13 PolarHBondContact O-N 3.01Å; S9-V13 VanDerWaalsContact O-N 3.12Å
10	A	64.5	Low	62	Low	46 Å²	46	108.2 Å²	108.2	38%	0.38	55%	0.549	S	S	.	.	H	α-helix	trans	-65	-42.8	175.4	0	0	0	0	0	111.8	D6 D7 H8 V13 W14	D6-A10 PolarHBondContact O-N 3.46Å; D7-A10 PolarHBondContact O-N 3.04Å; H8-A10 VanDerWaalsContact C-N 3.31Å; H8-A10 PolarHBondContact O-N 2.99Å; A10-V13 PolarHBondContact O-N 3.36Å; A10-W14 WeakPolarHBondContact O-CB 3.06Å; A10-W14 PolarHBondContact O-N 3.26Å
11	C	67	Low	62.1	Low	60 Å²	60	106.9 Å²	106.9	41%	0.405	54%	0.539	S	S	.	.	H	α-helix	trans	-60.8	-45	175.4	-76.2	0	0	0	0	112.5	D7 H8 W14 R15	D7-C11 WeakPolarHBondContact O-CB 3.44Å; D7-C11 PolarHBondContact O-N 3.41Å; D7-C11 PolarHBondContact O-SG 2.9Å; D7-C11 VanDerWaalsContact O-SG 3.34Å; H8-C11 PolarHBondContact O-N 3.25Å; C11-W14 PolarHBondContact O-N 2.96Å; C11-R15 WeakPolarHBondContact O-CG 3.36Å; C11-R15 PolarHBondContact O-N 3.29Å
12	E	66.4	Low	63.7	Low	79 Å²	79	98.9 Å²	98.9	37%	0.369	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-41.6	179.2	-72.4	-60.9	101.6	0	0	112.2	H8 S9 W14 R15 S16	H8-E12 WeakPolarHBondContact O-CG 3.49Å; H8-E12 PolarHBondContact O-N 2.9Å; S9-E12 PolarHBondContact O-N 2.67Å; E12-W14 VanDerWaalsContact C-N 3.31Å; E12-W14 PolarHBondContact O-N 2.81Å; E12-R15 PolarHBondContact O-N 2.71Å; E12-R15 IonicContact OE1-NH1 3.03Å; E12-R15 PolarHBondContact OE1-NH1 2.92Å; E12-S16 VanDerWaalsContact O-CB 3.29Å; E12-S16 WeakPolarHBondContact O-CB 3.4Å; E12-S16 PolarHBondContact O-N 3.17Å
13	V	66	Low	65.5	Low	81 Å²	81	90.8 Å²	90.8	49%	0.491	48%	0.477	S	S	.	.	H	α-helix	trans	-62.7	-40.5	173.7	171.3	0	0	0	0	111	S9 A10 S16 R17	S9-V13 WeakPolarHBondContact O-CG2 3.29Å; S9-V13 PolarHBondContact O-N 3.01Å; S9-V13 VanDerWaalsContact O-N 3.12Å; A10-V13 PolarHBondContact O-N 3.36Å; V13-S16 PolarHBondContact O-N 3.43Å; V13-R17 WeakPolarHBondContact O-CB 3.48Å; V13-R17 WeakPolarHBondContact O-CG 3.49Å; V13-R17 PolarHBondContact O-N 2.67Å
14	W	64.2	Low	67	Low	180 Å²	180	92.3 Å²	92.3	68%	0.682	47%	0.471	S	S	*	.	H	α-helix	trans	-66.6	-44.8	178.2	-166	80.7	0	0	0	111.7	A10 C11 E12 S16 R17 D18	A10-W14 WeakPolarHBondContact O-CB 3.06Å; A10-W14 PolarHBondContact O-N 3.26Å; C11-W14 PolarHBondContact O-N 2.96Å; E12-W14 VanDerWaalsContact C-N 3.31Å; E12-W14 PolarHBondContact O-N 2.81Å; W14-S16 PolarHBondContact O-N 2.83Å; W14-R17 PolarHBondContact O-N 3.32Å; W14-D18 WeakPolarHBondContact O-CB 3.46Å; W14-D18 PolarHBondContact O-N 3.42Å
15	R	66.1	Low	68.7	Low	135 Å²	135	86.8 Å²	86.8	51%	0.509	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-42.1	174.6	-73.2	-174.5	-177.3	108.9	5.9	112.5	C11 E12 R17 D18 R19	C11-R15 WeakPolarHBondContact O-CG 3.36Å; C11-R15 PolarHBondContact O-N 3.29Å; E12-R15 PolarHBondContact O-N 2.71Å; E12-R15 IonicContact OE1-NH1 3.03Å; E12-R15 PolarHBondContact OE1-NH1 2.92Å; R15-R17 VanDerWaalsContact C-N 3.34Å; R15-D18 PolarHBondContact O-N 3.25Å; R15-R19 VanDerWaalsContact O-CG 3.3Å; R15-R19 WeakPolarHBondContact O-CG 3.36Å; R15-R19 PolarHBondContact O-N 3.28Å
16	S	64.1	Low	70.2	Confident	20 Å²	20	80.8 Å²	80.8	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-44.9	175.4	-174.7	0	0	0	0	110.6	E12 V13 W14 R19 L20 G56	E12-S16 VanDerWaalsContact O-CB 3.29Å; E12-S16 WeakPolarHBondContact O-CB 3.4Å; E12-S16 PolarHBondContact O-N 3.17Å; V13-S16 PolarHBondContact O-N 3.43Å; W14-S16 PolarHBondContact O-N 2.83Å; S16-R19 PolarHBondContact O-N 3.31Å; S16-L20 PolarHBondContact O-N 2.82Å; S16-G56 WeakPolarHBondContact O-CA 3.16Å; S16-G56 VanDerWaalsContact OG-CA 3.32Å; S16-G56 WeakPolarHBondContact OG-CA 3.37Å; S16-G56 PolarHBondContact OG-N 3.31Å
17	R	68.8	Low	71.3	Confident	128 Å²	128	76.3 Å²	76.3	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-45.9	174.6	-77.5	177.5	135.3	157.7	-4.5	112.7	V13 W14 R15 R19 L20 Y21	V13-R17 WeakPolarHBondContact O-CB 3.48Å; V13-R17 WeakPolarHBondContact O-CG 3.49Å; V13-R17 PolarHBondContact O-N 2.67Å; W14-R17 PolarHBondContact O-N 3.32Å; R15-R17 VanDerWaalsContact C-N 3.34Å; R17-R19 VanDerWaalsContact C-N 3.3Å; R17-R19 PolarHBondContact O-N 2.85Å; R17-L20 WeakPolarHBondContact O-CB 3.37Å; R17-L20 PolarHBondContact O-N 3.42Å; R17-L20 VanDerWaalsContact O-N 3.08Å; R17-Y21 WeakPolarHBondContact O-CD2 3.35Å
18	D	69.8	Low	72.3	Confident	74 Å²	74	70.8 Å²	70.8	40%	0.396	35%	0.353	S	S	.	.	H	α-helix	trans	-57.5	-44.2	178.5	-174.6	71.6	0	0	0	111.4	W14 R15 L20 Y21 S22	W14-D18 WeakPolarHBondContact O-CB 3.46Å; W14-D18 PolarHBondContact O-N 3.42Å; R15-D18 PolarHBondContact O-N 3.25Å; D18-L20 VanDerWaalsContact C-N 3.27Å; D18-L20 PolarHBondContact O-N 2.81Å; D18-Y21 WeakPolarHBondContact O-CA 3.39Å; D18-Y21 PolarHBondContact O-N 3.04Å; D18-S22 PolarHBondContact O-N 3.12Å; D18-S22 PolarHBondContact O-OG 3.15Å; D18-S22 PolarHBondContact OD2-OG 3.18Å
19	R	70.7	Confident	72.9	Confident	120 Å²	120	65.6 Å²	65.6	45%	0.453	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-30.7	176.5	-70.8	178.2	105.7	-136.8	8.8	113.6	R15 S16 R17 Y21 S23 G56	R15-R19 VanDerWaalsContact O-CG 3.3Å; R15-R19 WeakPolarHBondContact O-CG 3.36Å; R15-R19 PolarHBondContact O-N 3.28Å; S16-R19 PolarHBondContact O-N 3.31Å; R17-R19 VanDerWaalsContact C-N 3.3Å; R17-R19 PolarHBondContact O-N 2.85Å; R19-Y21 PolarHBondContact O-N 3.25Å; R19-S23 VanDerWaalsContact O-CB 3.32Å; R19-S23 WeakPolarHBondContact O-CB 3.48Å; R19-S23 PolarHBondContact O-N 2.93Å; R19-S23 PolarHBondContact O-OG 3.13Å; R19-G56 PolarHBondContact NH1-O 3.49Å
20	L	69.1	Low	73.8	Confident	5 Å²	5	64 Å²	64	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-68	-15.3	173.9	-70.7	174.2	0	0	0	113	S16 R17 D18 V25 A26 P29 L121	S16-L20 PolarHBondContact O-N 2.82Å; R17-L20 WeakPolarHBondContact O-CB 3.37Å; R17-L20 PolarHBondContact O-N 3.42Å; R17-L20 VanDerWaalsContact O-N 3.08Å; D18-L20 VanDerWaalsContact C-N 3.27Å; D18-L20 PolarHBondContact O-N 2.81Å; L20-V25 HydrophobicContact CD2-CB 4.44Å; L20-V25 HydrophobicContact CD2-CG1 3.66Å; L20-A26 WeakPolarHBondContact O-CA 3.45Å; L20-A26 WeakPolarHBondContact O-CB 3.47Å; L20-P29 HydrophobicContact CD2-CG 4.4Å; L20-L121 HydrophobicContact CD1-CD1 3.35Å
21	Y	65.9	Low	74.9	Confident	82 Å²	82	62.6 Å²	62.6	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-105.7	-34.8	176.8	-63.3	-67.2	0	0	0	112.7	R17 D18 R19 W110 S114 I119	R17-Y21 WeakPolarHBondContact O-CD2 3.35Å; D18-Y21 WeakPolarHBondContact O-CA 3.39Å; D18-Y21 PolarHBondContact O-N 3.04Å; R19-Y21 PolarHBondContact O-N 3.25Å; Y21-W110 AromaticContact CD1-NE1 3.65Å; Y21-W110 AromaticContact CE1-CZ2 4Å; Y21-W110 HydrophobicContact CE1-CZ2 4Å; Y21-W110 AromaticContact CE1-NE1 3.91Å; Y21-S114 WeakPolarHBondContact CD1-OG 3.33Å; Y21-S114 VanDerWaalsContact CE1-OG 3.23Å; Y21-S114 WeakPolarHBondContact CE1-OG 3.45Å; Y21-I119 HydrophobicContact CE1-CB 4.31Å; Y21-I119 HydrophobicContact CE1-CD1 4.37Å; Y21-I119 HydrophobicContact CE1-CG2 4.37Å; Y21-I119 PolarHBondContact OH-O 3.47Å
22	S	68.9	Low	76.1	Confident	82 Å²	82	59.8 Å²	59.8	57%	0.573	29%	0.29	S	S	*	.	H	α-helix	trans	-97.9	-3.1	-171.8	63.1	0	0	0	0	114.9	D18	D18-S22 PolarHBondContact O-N 3.12Å; D18-S22 PolarHBondContact O-OG 3.15Å; D18-S22 PolarHBondContact OD2-OG 3.18Å
23	S	76.9	Confident	77.3	Confident	39 Å²	39	58.9 Å²	58.9	27%	0.273	29%	0.287	S	S	.	.	S	Bend	trans	-126.5	168.2	-177.3	82.1	0	0	0	0	112.8	R19 V25 A26	R19-S23 VanDerWaalsContact O-CB 3.32Å; R19-S23 WeakPolarHBondContact O-CB 3.48Å; R19-S23 PolarHBondContact O-N 2.93Å; R19-S23 PolarHBondContact O-OG 3.13Å; S23-V25 PolarHBondContact O-N 3.31Å; S23-V25 WeakPolarHBondContact OG-CB 3.33Å; S23-V25 VanDerWaalsContact OG-CG2 3.29Å; S23-V25 WeakPolarHBondContact OG-CG2 3.47Å; S23-V25 PolarHBondContact OG-N 2.82Å; S23-A26 VanDerWaalsContact O-CB 3.24Å; S23-A26 WeakPolarHBondContact O-CB 3.45Å; S23-A26 PolarHBondContact O-N 3.49Å
24	L	82.5	Confident	78.5	Confident	124 Å²	124	56.9 Å²	56.9	65%	0.649	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-57.3	-17.7	173.7	-168.5	63.5	0	0	0	112.8	A26 I27 L107	L24-A26 PolarHBondContact O-N 2.95Å; L24-A26 VanDerWaalsContact O-N 3.13Å; L24-I27 WeakPolarHBondContact O-CG2 3.18Å; L24-I27 PolarHBondContact O-N 3.07Å; L24-I27 VanDerWaalsContact O-N 3.11Å; L24-L107 HydrophobicContact CD1-CD1 4.11Å
25	V	85.4	Confident	79.8	Confident	19 Å²	19	53.3 Å²	53.3	12%	0.115	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-60.2	-20.5	173.4	-170.3	0	0	0	0	111.7	L20 S23 I27 F28 P29	L20-V25 HydrophobicContact CD2-CB 4.44Å; L20-V25 HydrophobicContact CD2-CG1 3.66Å; S23-V25 PolarHBondContact O-N 3.31Å; S23-V25 WeakPolarHBondContact OG-CB 3.33Å; S23-V25 VanDerWaalsContact OG-CG2 3.29Å; S23-V25 WeakPolarHBondContact OG-CG2 3.47Å; S23-V25 PolarHBondContact OG-N 2.82Å; V25-I27 PolarHBondContact O-N 3.05Å; V25-I27 VanDerWaalsContact O-N 3.07Å; V25-F28 HydrophobicContact CG1-CD2 4.03Å; V25-F28 WeakPolarHBondContact O-CB 3.26Å; V25-F28 WeakPolarHBondContact O-CD2 3.4Å; V25-F28 PolarHBondContact O-N 2.85Å; V25-P29 VanDerWaalsContact O-CD 3.23Å; V25-P29 WeakPolarHBondContact O-CD 3.49Å
26	A	85.6	Confident	81.1	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.033	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-53.8	-26.5	172.1	0	0	0	0	0	113.8	L20 S23 L24 F28 P29 A30 L107	L20-A26 WeakPolarHBondContact O-CA 3.45Å; L20-A26 WeakPolarHBondContact O-CB 3.47Å; S23-A26 VanDerWaalsContact O-CB 3.24Å; S23-A26 WeakPolarHBondContact O-CB 3.45Å; S23-A26 PolarHBondContact O-N 3.49Å; L24-A26 PolarHBondContact O-N 2.95Å; L24-A26 VanDerWaalsContact O-N 3.13Å; A26-F28 PolarHBondContact O-N 2.82Å; A26-P29 VanDerWaalsContact O-CD 3.24Å; A26-P29 WeakPolarHBondContact O-CD 3.38Å; A26-P29 WeakPolarHBondContact O-CG 3.42Å; A26-A30 WeakPolarHBondContact O-CB 3.35Å; A26-A30 PolarHBondContact O-N 3.35Å; A26-L107 HydrophobicContact CB-CD2 3.83Å
27	I	88	Confident	82.6	Confident	9 Å²	9	50.5 Å²	50.5	5%	0.046	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-29	178.3	-164.6	57.1	0	0	0	112.6	L24 V25 A31 L32 I103 T106 L107	L24-I27 WeakPolarHBondContact O-CG2 3.18Å; L24-I27 PolarHBondContact O-N 3.07Å; L24-I27 VanDerWaalsContact O-N 3.11Å; V25-I27 PolarHBondContact O-N 3.05Å; V25-I27 VanDerWaalsContact O-N 3.07Å; I27-A31 HydrophobicContact CD1-CB 3.79Å; I27-A31 HydrophobicContact CG1-CB 4.34Å; I27-A31 WeakPolarHBondContact O-CB 3.45Å; I27-A31 PolarHBondContact O-N 2.87Å; I27-L32 HydrophobicContact CG2-CD1 4.42Å; I27-L32 PolarHBondContact O-N 2.76Å; I27-I103 HydrophobicContact CD1-CB 4.41Å; I27-I103 HydrophobicContact CD1-CG1 4.42Å; I27-I103 HydrophobicContact CD1-CG2 4.02Å; I27-I103 HydrophobicContact CG1-CG2 4.42Å; I27-T106 HydrophobicContact CD1-CG2 4.39Å; I27-L107 HydrophobicContact CB-CD2 4.18Å; I27-L107 HydrophobicContact CD1-CD2 4.28Å; I27-L107 HydrophobicContact CD1-CG 4.22Å
28	F	89.9	Confident	83.9	Confident	15 Å²	15	46 Å²	46	7%	0.066	26%	0.258	C	S	.	.	I	π-helix	trans	-65.6	-59.6	-178.3	-70.5	-99.7	0	0	0	111.6	V25 A26 A30 L32 I33 L51 C54 M58 L60 V95	V25-F28 HydrophobicContact CG1-CD2 4.03Å; V25-F28 WeakPolarHBondContact O-CB 3.26Å; V25-F28 WeakPolarHBondContact O-CD2 3.4Å; V25-F28 PolarHBondContact O-N 2.85Å; A26-F28 PolarHBondContact O-N 2.82Å; F28-A30 VanDerWaalsContact C-N 3.29Å; F28-A30 PolarHBondContact O-N 2.8Å; F28-L32 HydrophobicContact CD1-CD1 3.81Å; F28-L32 HydrophobicContact CE1-CD1 4.08Å; F28-L32 HydrophobicContact CG-CD1 4.13Å; F28-L32 PolarHBondContact O-N 2.8Å; F28-I33 PolarHBondContact O-N 2.83Å; F28-I33 VanDerWaalsContact O-N 3.11Å; F28-L51 HydrophobicContact CB-CD2 4.32Å; F28-L51 HydrophobicContact CD1-CD2 3.75Å; F28-C54 HydrophobicContact CB-CB 3.76Å; F28-C54 HydrophobicContact CD1-CB 4.42Å; F28-C54 HydrophobicContact CG-CB 4.32Å; F28-M58 HydrophobicContact CE2-CG 4.25Å; F28-M58 HydrophobicContact CE2-SD 4.31Å; F28-M58 HydrophobicContact CZ-CG 4.16Å; F28-M58 HydrophobicContact CZ-SD 4.25Å; F28-L60 HydrophobicContact CD1-CD2 3.74Å; F28-L60 HydrophobicContact CE1-CD1 3.88Å; F28-L60 HydrophobicContact CE1-CD2 3.72Å; F28-L60 HydrophobicContact CE1-CG 4.48Å; F28-V95 HydrophobicContact CE1-CB 4.18Å; F28-V95 HydrophobicContact CE1-CG1 3.89Å; F28-V95 HydrophobicContact CE1-CG2 3.96Å; F28-V95 HydrophobicContact CZ-CB 4.1Å; F28-V95 HydrophobicContact CZ-CG1 4.29Å; F28-V95 HydrophobicContact CZ-CG2 3.85Å
29	P	85.4	Confident	85.1	Confident	15 Å²	15	42.5 Å²	42.5	10%	0.097	24%	0.239	C	C	.	.	I	π-helix	trans	-67.5	-28.5	175.5	29.8	-36.8	0	0	0	113.3	L20 V25 A26 I33 W110 L121	L20-P29 HydrophobicContact CD2-CG 4.4Å; V25-P29 VanDerWaalsContact O-CD 3.23Å; V25-P29 WeakPolarHBondContact O-CD 3.49Å; A26-P29 VanDerWaalsContact O-CD 3.24Å; A26-P29 WeakPolarHBondContact O-CD 3.38Å; A26-P29 WeakPolarHBondContact O-CG 3.42Å; P29-I33 HydrophobicContact CB-CD1 4.01Å; P29-W110 HydrophobicContact CB-CH2 3.62Å; P29-W110 HydrophobicContact CB-CZ2 3.86Å; P29-W110 HydrophobicContact CB-CZ3 4.29Å; P29-W110 HydrophobicContact CG-CH2 4.01Å; P29-W110 HydrophobicContact CG-CZ2 3.71Å; P29-L121 HydrophobicContact CB-CD2 3.41Å; P29-L121 VanDerWaalsContact CB-CD2 3.41Å; P29-L121 HydrophobicContact CG-CD2 4.19Å
30	A	85.6	Confident	86.3	Confident	27 Å²	27	38.2 Å²	38.2	22%	0.223	23%	0.225	C	C	.	.	I	π-helix	trans	-71.4	-37.4	179.6	0	0	0	0	0	113.8	A26 F28 T106 W110	A26-A30 WeakPolarHBondContact O-CB 3.35Å; A26-A30 PolarHBondContact O-N 3.35Å; F28-A30 VanDerWaalsContact C-N 3.29Å; F28-A30 PolarHBondContact O-N 2.8Å; A30-T106 HydrophobicContact CB-CG2 3.83Å; A30-W110 HydrophobicContact CB-CB 3.75Å; A30-W110 HydrophobicContact CB-CD2 3.75Å; A30-W110 HydrophobicContact CB-CE3 3.68Å; A30-W110 HydrophobicContact CB-CG 3.8Å; A30-W110 HydrophobicContact CB-CZ3 4.49Å
31	A	87.3	Confident	87.5	Confident	17 Å²	17	38.8 Å²	38.8	14%	0.14	23%	0.228	C	C	.	.	I	π-helix	trans	-136	-26.2	-165.2	0	0	0	0	0	115.6	I27 K35 I101 T106	I27-A31 HydrophobicContact CD1-CB 3.79Å; I27-A31 HydrophobicContact CG1-CB 4.34Å; I27-A31 WeakPolarHBondContact O-CB 3.45Å; I27-A31 PolarHBondContact O-N 2.87Å; A31-K35 WeakPolarHBondContact O-CG 3.37Å; A31-I101 HydrophobicContact CB-CD1 4Å; A31-I101 HydrophobicContact CB-CG2 3.83Å; A31-T106 HydrophobicContact CB-CG2 3.62Å
32	L	90.9	Very high	88.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	23%	0.232	C	C	.	.	I	π-helix	trans	-101.7	-23.4	-167.2	-57.8	-179.3	0	0	0	113.6	I27 F28 G34 K35 V37 L51 V97 I101	I27-L32 HydrophobicContact CG2-CD1 4.42Å; I27-L32 PolarHBondContact O-N 2.76Å; F28-L32 HydrophobicContact CD1-CD1 3.81Å; F28-L32 HydrophobicContact CE1-CD1 4.08Å; F28-L32 HydrophobicContact CG-CD1 4.13Å; F28-L32 PolarHBondContact O-N 2.8Å; L32-G34 PolarHBondContact O-N 3.06Å; L32-K35 VanDerWaalsContact O-CB 3.28Å; L32-K35 WeakPolarHBondContact O-CB 3.32Å; L32-K35 PolarHBondContact O-N 2.82Å; L32-V37 HydrophobicContact CB-CG1 4.47Å; L32-L51 HydrophobicContact CB-CD2 3.55Å; L32-V97 HydrophobicContact CD1-CG2 4.37Å; L32-V97 HydrophobicContact CD2-CG1 4.23Å; L32-V97 HydrophobicContact CD2-CG2 4.49Å; L32-I101 HydrophobicContact CD2-CD1 3.81Å
33	I	91.2	Very high	90	Very high	60 Å²	60	37.7 Å²	37.7	31%	0.308	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	130.7	176.7	-67.9	179.7	0	0	0	109.9	F28 P29 K35 L51	F28-I33 PolarHBondContact O-N 2.83Å; F28-I33 VanDerWaalsContact O-N 3.11Å; P29-I33 HydrophobicContact CB-CD1 4.01Å; I33-K35 VanDerWaalsContact C-N 3.28Å; I33-K35 PolarHBondContact O-N 2.84Å; I33-L51 HydrophobicContact CG1-CD2 4.41Å
34	G	92	Very high	90.6	Very high	39 Å²	39	39.5 Å²	39.5	40%	0.402	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	-4	-175.9	0	0	0	0	0	114.9	L32 R50 L51	L32-G34 PolarHBondContact O-N 3.06Å; G34-R50 WeakPolarHBondContact O-CD 3.45Å; G34-R50 VanDerWaalsContact O-CG 3.3Å; G34-R50 WeakPolarHBondContact O-CG 3.32Å; G34-L51 PolarHBondContact N-O 3.39Å
35	K	92.4	Very high	91.1	Very high	104 Å²	104	34.3 Å²	34.3	45%	0.452	20%	0.198	S	C	.	.	S	Bend	trans	-95.8	149.8	-179.4	-55.8	-60.9	-176.5	179	0	111.8	A31 L32 I33 V37 R50 L51	A31-K35 WeakPolarHBondContact O-CG 3.37Å; L32-K35 VanDerWaalsContact O-CB 3.28Å; L32-K35 WeakPolarHBondContact O-CB 3.32Å; L32-K35 PolarHBondContact O-N 2.82Å; I33-K35 VanDerWaalsContact C-N 3.28Å; I33-K35 PolarHBondContact O-N 2.84Å; K35-V37 PolarHBondContact O-N 3.2Å; K35-R50 WeakPolarHBondContact O-CA 3.06Å; K35-L51 PolarHBondContact O-N 3.39Å
36	P	93.3	Very high	91.5	Very high	94 Å²	94	40 Å²	40	61%	0.61	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.3	168.5	29.3	-33.4	0	0	0	109.7	G49	P36-G49 CarbonylContact C-O 3.52Å; P36-G49 WeakPolarHBondContact CA-O 3.42Å
37	V	94.8	Very high	91.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	152.5	177.6	-61.9	0	0	0	0	109.8	L32 K35 V39 T48 G49 L51 L62 V95	L32-V37 HydrophobicContact CB-CG1 4.47Å; K35-V37 PolarHBondContact O-N 3.2Å; V37-V39 HydrophobicContact CG2-CG2 4.4Å; V37-T48 WeakPolarHBondContact O-CA 3.33Å; V37-G49 PolarHBondContact N-O 3.39Å; V37-G49 PolarHBondContact O-N 2.9Å; V37-G49 VanDerWaalsContact O-O 3.08Å; V37-L51 HydrophobicContact CG1-CB 4.36Å; V37-L51 HydrophobicContact CG2-CB 3.94Å; V37-L62 HydrophobicContact CG2-CD2 3.57Å; V37-V95 HydrophobicContact CB-CG1 4.27Å
38	T	95.6	Very high	92.3	Very high	35 Å²	35	41.6 Å²	41.6	22%	0.215	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.4	166.6	-59.2	0	0	0	0	108.5	R46 I47 T48 V95 T96	T38-R46 HydrophobicContact CG2-CB 4.49Å; T38-I47 CarbonylContact C-O 3.43Å; T38-I47 WeakPolarHBondContact CA-O 3.5Å; T38-T48 PolarHBondContact OG1-OG1 2.76Å; T38-V95 WeakPolarHBondContact O-CA 3.24Å; T38-T96 PolarHBondContact N-OG1 3.08Å; T38-T96 PolarHBondContact O-N 2.93Å; T38-T96 PolarHBondContact O-OG1 3.39Å
39	V	95.7	Very high	92.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.5	176.1	-176.5	0	0	0	0	107.5	V37 L41 I47 L60 L62 I87 I92 Y94 V95	V37-V39 HydrophobicContact CG2-CG2 4.4Å; V39-L41 HydrophobicContact CG1-CD2 3.97Å; V39-I47 HydrophobicContact CB-CB 4.46Å; V39-I47 PolarHBondContact N-O 2.97Å; V39-I47 PolarHBondContact O-N 3.28Å; V39-L60 HydrophobicContact CG2-CD1 3.82Å; V39-L62 HydrophobicContact CG2-CD1 4.05Å; V39-I87 HydrophobicContact CB-CD1 4.07Å; V39-I87 HydrophobicContact CG1-CD1 4.11Å; V39-I87 HydrophobicContact CG1-CG2 4.41Å; V39-I87 HydrophobicContact CG2-CD1 4.06Å; V39-I92 HydrophobicContact CG1-CB 4.38Å; V39-I92 HydrophobicContact CG1-CD1 4.08Å; V39-I92 HydrophobicContact CG1-CG1 3.81Å; V39-I92 HydrophobicContact CG1-CG2 3.91Å; V39-Y94 WeakPolarHBondContact CA-O 3.42Å; V39-V95 HydrophobicContact CG1-CG2 4.4Å; V39-V95 HydrophobicContact CG2-CG1 4.46Å; V39-V95 HydrophobicContact CG2-CG2 4.32Å
40	I	95.5	Very high	93	Very high	29 Å²	29	45.7 Å²	45.7	15%	0.149	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	120.7	174.5	-52.4	178.4	0	0	0	107	R46 R93 Y94	I40-R46 HydrophobicContact CG1-CG 4.39Å; I40-R93 WeakPolarHBondContact O-CA 3.49Å; I40-R93 WeakPolarHBondContact O-CB 3.23Å; I40-R93 PolarHBondContact O-N 3.47Å; I40-Y94 HydrophobicContact CB-CD2 4.33Å; I40-Y94 HydrophobicContact CD1-CD2 4.3Å; I40-Y94 HydrophobicContact CG2-CD2 4.48Å; I40-Y94 PolarHBondContact N-O 2.92Å; I40-Y94 PolarHBondContact O-N 2.87Å
41	L	95.7	Very high	93.4	Very high	18 Å²	18	44.4 Å²	44.4	9%	0.094	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	168.9	179.9	-57.5	-169.4	0	0	0	111.8	V39 D43 E44 T45 I47 I87 R91 I92	V39-L41 HydrophobicContact CG1-CD2 3.97Å; L41-D43 WeakPolarHBondContact CB-OD1 3.02Å; L41-D43 PolarHBondContact O-N 3.24Å; L41-E44 WeakPolarHBondContact O-CA 3.28Å; L41-E44 PolarHBondContact O-N 3.32Å; L41-T45 PolarHBondContact N-O 3.5Å; L41-I47 HydrophobicContact CD1-CD1 3.81Å; L41-I47 HydrophobicContact CD2-CD1 4.29Å; L41-I47 HydrophobicContact CG-CD1 4.11Å; L41-I87 HydrophobicContact CD2-CG2 3.6Å; L41-R91 CarbonylContact C-O 3.57Å; L41-R91 WeakPolarHBondContact CA-O 3.14Å; L41-R91 WeakPolarHBondContact CB-O 3.21Å; L41-R91 HydrophobicContact CD2-CB 4.37Å; L41-I92 HydrophobicContact CD2-CG1 4.19Å
42	L	94.5	Very high	93.7	Very high	78 Å²	78	45.7 Å²	45.7	41%	0.408	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.2	175.9	-70.9	174	0	0	0	113.2	E44 K90 R91 R93	L42-E44 PolarHBondContact O-N 2.86Å; L42-K90 VanDerWaalsContact CD1-O 3.29Å; L42-K90 WeakPolarHBondContact CD1-O 3.17Å; L42-R91 PolarHBondContact N-O 3.44Å; L42-R93 HydrophobicContact CD2-CB 4.14Å; L42-R93 PolarHBondContact O-NH1 3.23Å; L42-R93 PolarHBondContact O-NH2 2.98Å
43	D	91.3	Very high	93.7	Very high	63 Å²	63	46.8 Å²	46.8	34%	0.337	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	15.9	173.9	57.3	31.4	0	0	0	112.4	L41 T45 P71 R91	L41-D43 WeakPolarHBondContact CB-OD1 3.02Å; L41-D43 PolarHBondContact O-N 3.24Å; D43-T45 PolarHBondContact O-N 3.11Å; D43-T45 VanDerWaalsContact O-N 3.07Å; D43-T45 WeakPolarHBondContact OD1-CB 3.3Å; D43-T45 PolarHBondContact OD1-N 3.19Å; D43-T45 PolarHBondContact OD1-OG1 3.02Å; D43-P71 VanDerWaalsContact O-CG 3.28Å; D43-P71 WeakPolarHBondContact O-CG 3.49Å; D43-R91 IonicContact OD2-CZ 3.95Å; D43-R91 IonicContact OD2-NH2 2.85Å; D43-R91 PolarHBondContact OD2-NH2 3.26Å
44	E	90.9	Very high	93.6	Very high	76 Å²	76	44.7 Å²	44.7	36%	0.355	24%	0.237	S	C	.	.			trans	63	7.6	-178.6	-63.6	-65.6	156.2	0	0	115.2	L41 L42 R46 P71 R93	L41-E44 WeakPolarHBondContact O-CA 3.28Å; L41-E44 PolarHBondContact O-N 3.32Å; L42-E44 PolarHBondContact O-N 2.86Å; E44-R46 PolarHBondContact O-N 2.88Å; E44-P71 HydrophobicContact CB-CB 3.72Å; E44-P71 HydrophobicContact CB-CG 4.06Å; E44-R93 IonicContact OE1-CZ 3.72Å; E44-R93 IonicContact OE1-NH1 2.58Å; E44-R93 PolarHBondContact OE1-NH1 3.19Å
45	T	91.6	Very high	93.3	Very high	15 Å²	15	45.2 Å²	45.2	9%	0.092	23%	0.231	C	C	.	.			trans	-62.7	130	169.5	-57.2	0	0	0	0	109.8	L41 D43 I47 I68 R69	L41-T45 PolarHBondContact N-O 3.5Å; D43-T45 PolarHBondContact O-N 3.11Å; D43-T45 VanDerWaalsContact O-N 3.07Å; D43-T45 WeakPolarHBondContact OD1-CB 3.3Å; D43-T45 PolarHBondContact OD1-N 3.19Å; D43-T45 PolarHBondContact OD1-OG1 3.02Å; T45-I47 HydrophobicContact CG2-CG1 4.22Å; T45-I68 HydrophobicContact CG2-CG2 3.59Å; T45-R69 CarbonylContact C-O 3.59Å; T45-R69 WeakPolarHBondContact CA-O 3.42Å; T45-R69 WeakPolarHBondContact CG2-O 3.39Å
46	R	93.8	Very high	92.8	Very high	140 Å²	140	40.3 Å²	40.3	53%	0.528	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.2	178.7	-58	-176.1	178.2	-175.6	-0.1	109.8	T38 I40 E44 I68 R69	T38-R46 HydrophobicContact CG2-CB 4.49Å; I40-R46 HydrophobicContact CG1-CG 4.39Å; E44-R46 PolarHBondContact O-N 2.88Å; R46-I68 CarbonylContact O-C 3.53Å; R46-I68 WeakPolarHBondContact O-CA 3.32Å; R46-R69 HydrophobicContact CB-CB 4.37Å; R46-R69 PolarHBondContact N-O 3.46Å; R46-R69 PolarHBondContact O-N 2.83Å
47	I	94.9	Very high	92.4	Very high	6 Å²	6	40 Å²	40	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.7	179.1	-53	178.6	0	0	0	108.4	T38 V39 L41 T45 L62 V66 I67 I68 I85 I87	T38-I47 CarbonylContact C-O 3.43Å; T38-I47 WeakPolarHBondContact CA-O 3.5Å; V39-I47 HydrophobicContact CB-CB 4.46Å; V39-I47 PolarHBondContact N-O 2.97Å; V39-I47 PolarHBondContact O-N 3.28Å; L41-I47 HydrophobicContact CD1-CD1 3.81Å; L41-I47 HydrophobicContact CD2-CD1 4.29Å; L41-I47 HydrophobicContact CG-CD1 4.11Å; T45-I47 HydrophobicContact CG2-CG1 4.22Å; I47-L62 HydrophobicContact CG2-CD1 3.77Å; I47-V66 HydrophobicContact CG2-CG1 3.35Å; I47-I67 CarbonylContact C-O 3.6Å; I47-I67 WeakPolarHBondContact CA-O 3.3Å; I47-I68 HydrophobicContact CG1-CG1 4.28Å; I47-I68 HydrophobicContact CG1-CG2 4.28Å; I47-I68 HydrophobicContact CG2-CG1 4.17Å; I47-I85 HydrophobicContact CD1-CD1 4.35Å; I47-I85 HydrophobicContact CG2-CG2 4.2Å; I47-I87 HydrophobicContact CB-CD1 4.18Å; I47-I87 HydrophobicContact CD1-CD1 3.81Å; I47-I87 HydrophobicContact CD1-CG1 4.1Å; I47-I87 HydrophobicContact CG2-CD1 4Å
48	T	95.3	Very high	92.2	Very high	40 Å²	40	42.1 Å²	42.1	25%	0.245	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129.7	179.1	-52.8	0	0	0	0	109.5	V37 T38 V66 I67	V37-T48 WeakPolarHBondContact O-CA 3.33Å; T38-T48 PolarHBondContact OG1-OG1 2.76Å; T48-V66 CarbonylContact O-C 3.55Å; T48-V66 VanDerWaalsContact O-CA 3.3Å; T48-V66 WeakPolarHBondContact O-CA 3.3Å; T48-I67 PolarHBondContact N-O 3.4Å; T48-I67 PolarHBondContact O-N 3.13Å
49	G	94.8	Very high	92	Very high	7 Å²	7	42 Å²	42	7%	0.072	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	-178.3	178.8	0	0	0	0	0	111.1	P36 V37	P36-G49 CarbonylContact C-O 3.52Å; P36-G49 WeakPolarHBondContact CA-O 3.42Å; V37-G49 PolarHBondContact N-O 3.39Å; V37-G49 PolarHBondContact O-N 2.9Å; V37-G49 VanDerWaalsContact O-O 3.08Å
50	R	95.6	Very high	91.9	Very high	108 Å²	108	42.1 Å²	42.1	41%	0.408	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.6	173.8	-167.8	-162.8	-37.7	-89.8	-1	109.5	G34 K35 C52 L62 D63 S64	G34-R50 WeakPolarHBondContact O-CD 3.45Å; G34-R50 VanDerWaalsContact O-CG 3.3Å; G34-R50 WeakPolarHBondContact O-CG 3.32Å; K35-R50 WeakPolarHBondContact O-CA 3.06Å; R50-C52 PolarHBondContact O-N 3.22Å; R50-L62 CarbonylContact O-C 3.58Å; R50-L62 WeakPolarHBondContact O-CA 3.4Å; R50-D63 WeakPolarHBondContact CB-OD1 3.32Å; R50-D63 PolarHBondContact N-O 2.8Å; R50-D63 IonicContact NE-OD1 2.99Å; R50-D63 PolarHBondContact NE-OD1 3.41Å; R50-D63 PolarHBondContact O-N 3.11Å; R50-S64 VanDerWaalsContact CZ-OG 3.28Å; R50-S64 PolarHBondContact NE-OG 2.94Å; R50-S64 PolarHBondContact NH2-OG 3.38Å
51	L	95	Very high	91.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	117.8	177	-176.8	68.1	0	0	0	110.4	F28 L32 I33 G34 K35 V37 S53 L60 L62	F28-L51 HydrophobicContact CB-CD2 4.32Å; F28-L51 HydrophobicContact CD1-CD2 3.75Å; L32-L51 HydrophobicContact CB-CD2 3.55Å; I33-L51 HydrophobicContact CG1-CD2 4.41Å; G34-L51 PolarHBondContact N-O 3.39Å; K35-L51 PolarHBondContact O-N 3.39Å; V37-L51 HydrophobicContact CG1-CB 4.36Å; V37-L51 HydrophobicContact CG2-CB 3.94Å; L51-S53 WeakPolarHBondContact CD1-O 3.29Å; L51-L60 HydrophobicContact CD1-CB 3.95Å; L51-L60 HydrophobicContact CD1-CD1 4.43Å; L51-L60 HydrophobicContact CD1-CD2 4.02Å; L51-L60 HydrophobicContact CD1-CG 4.35Å; L51-L62 HydrophobicContact CB-CD2 4.11Å; L51-L62 HydrophobicContact CD1-CD2 3.79Å
52	C	93.4	Very high	91.9	Very high	45 Å²	45	41.9 Å²	41.9	30%	0.304	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-46.5	-179.3	-169.7	0	0	0	0	111.4	R50 Q61 D63	R50-C52 PolarHBondContact O-N 3.22Å; C52-Q61 HydrophobicContact CB-CB 4.31Å; C52-Q61 HydrophobicContact CB-CG 4.3Å; C52-Q61 WeakPolarHBondContact CB-O 3.3Å; C52-Q61 PolarHBondContact N-O 3.13Å; C52-D63 HydrophobicContact CB-CB 4.42Å; C52-D63 VanDerWaalsContact CB-OD2 3.3Å; C52-D63 WeakPolarHBondContact CB-OD2 3.27Å; C52-D63 PolarHBondContact SG-OD2 2.89Å
53	S	91	Very high	91.8	Very high	23 Å²	23	39.8 Å²	39.8	16%	0.161	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	157	-179.6	68.3	0	0	0	0	111.7	L51 Q61	L51-S53 WeakPolarHBondContact CD1-O 3.29Å; S53-Q61 PolarHBondContact N-O 3.11Å; S53-Q61 PolarHBondContact O-N 2.62Å; S53-Q61 VanDerWaalsContact OG-CB 3.22Å; S53-Q61 WeakPolarHBondContact OG-CB 3.44Å; S53-Q61 PolarHBondContact OG-OE1 2.78Å; S53-Q61 VanDerWaalsContact OG-OE1 3.13Å
54	C	89.7	Confident	91.8	Very high	16 Å²	16	39.7 Å²	39.7	11%	0.108	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	137	176	179.4	0	0	0	0	108.6	F28 N59 L60	F28-C54 HydrophobicContact CB-CB 3.76Å; F28-C54 HydrophobicContact CD1-CB 4.42Å; F28-C54 HydrophobicContact CG-CB 4.32Å; C54-N59 WeakPolarHBondContact CA-O 3.17Å; C54-L60 HydrophobicContact CB-CD2 3.77Å; C54-L60 WeakPolarHBondContact SG-CD2 3.32Å
55	D	85.5	Confident	91.6	Very high	51 Å²	51	37.4 Å²	37.4	27%	0.273	20%	0.2	S	C	.	.			trans	-105.2	174.4	171.6	73.4	14.4	0	0	0	112.3	L57 M58 N59	D55-L57 PolarHBondContact O-N 2.97Å; D55-L57 WeakPolarHBondContact OD1-CA 3.28Å; D55-L57 WeakPolarHBondContact OD1-CB 3.4Å; D55-L57 PolarHBondContact OD1-N 3.1Å; D55-M58 PolarHBondContact O-N 3.47Å; D55-M58 PolarHBondContact OD1-N 3.39Å; D55-M58 VanDerWaalsContact OD1-N 3.1Å; D55-N59 PolarHBondContact N-O 3.18Å; D55-N59 WeakPolarHBondContact OD1-CB 3.42Å; D55-N59 PolarHBondContact OD1-N 2.74Å; D55-N59 PolarHBondContact OD1-ND2 2.91Å; D55-N59 WeakPolarHBondContact OD2-CB 3.32Å; D55-N59 PolarHBondContact OD2-ND2 2.99Å
56	G	82	Confident	91.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-3.8	179.7	0	0	0	0	0	115.7	S16 R19 M58	S16-G56 WeakPolarHBondContact O-CA 3.16Å; S16-G56 VanDerWaalsContact OG-CA 3.32Å; S16-G56 WeakPolarHBondContact OG-CA 3.37Å; S16-G56 PolarHBondContact OG-N 3.31Å; R19-G56 PolarHBondContact NH1-O 3.49Å; G56-M58 VanDerWaalsContact C-N 3.33Å
57	L	84.9	Confident	91.5	Very high	88 Å²	88	32.5 Å²	32.5	46%	0.461	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	5.9	169.6	-60.5	179.4	0	0	0	111.3	D55 N59	D55-L57 PolarHBondContact O-N 2.97Å; D55-L57 WeakPolarHBondContact OD1-CA 3.28Å; D55-L57 WeakPolarHBondContact OD1-CB 3.4Å; D55-L57 PolarHBondContact OD1-N 3.1Å; L57-N59 PolarHBondContact O-N 2.84Å
58	M	89.3	Confident	91.5	Very high	46 Å²	46	33.2 Å²	33.2	23%	0.227	19%	0.187	C	C	.	.			trans	63.3	25.4	-177	-152.8	178.9	75.3	0	0	112.7	F28 D55 G56 L60 G89 I92	F28-M58 HydrophobicContact CE2-CG 4.25Å; F28-M58 HydrophobicContact CE2-SD 4.31Å; F28-M58 HydrophobicContact CZ-CG 4.16Å; F28-M58 HydrophobicContact CZ-SD 4.25Å; D55-M58 PolarHBondContact O-N 3.47Å; D55-M58 PolarHBondContact OD1-N 3.39Å; D55-M58 VanDerWaalsContact OD1-N 3.1Å; G56-M58 VanDerWaalsContact C-N 3.33Å; M58-L60 HydrophobicContact CG-CD2 4.49Å; M58-L60 PolarHBondContact O-N 2.85Å; M58-G89 WeakPolarHBondContact O-CA 3.24Å; M58-I92 HydrophobicContact CE-CB 3.55Å; M58-I92 HydrophobicContact CE-CD1 4.16Å; M58-I92 HydrophobicContact CE-CG1 4.42Å; M58-I92 HydrophobicContact CE-CG2 3.54Å; M58-I92 WeakPolarHBondContact O-CD1 3.27Å
59	N	91.2	Very high	91.3	Very high	33 Å²	33	36 Å²	36	18%	0.176	19%	0.193	C	C	.	.			trans	-71.7	127.5	166.8	-56.2	-47.5	0	0	0	108.2	C54 D55 L57 I87 F88 G89	C54-N59 WeakPolarHBondContact CA-O 3.17Å; D55-N59 PolarHBondContact N-O 3.18Å; D55-N59 WeakPolarHBondContact OD1-CB 3.42Å; D55-N59 PolarHBondContact OD1-N 2.74Å; D55-N59 PolarHBondContact OD1-ND2 2.91Å; D55-N59 WeakPolarHBondContact OD2-CB 3.32Å; D55-N59 PolarHBondContact OD2-ND2 2.99Å; L57-N59 PolarHBondContact O-N 2.84Å; N59-I87 CarbonylContact C-O 3.16Å; N59-I87 VanDerWaalsContact CA-O 3.27Å; N59-I87 WeakPolarHBondContact CA-O 3.4Å; N59-F88 VanDerWaalsContact OD1-CA 3.28Å; N59-F88 WeakPolarHBondContact OD1-CA 3.32Å; N59-G89 PolarHBondContact OD1-N 2.86Å
60	L	94.1	Very high	90.9	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.2	-174.6	-52.7	-176.1	0	0	0	110	F28 V39 L51 C54 M58 M86 I87 I92 V95	F28-L60 HydrophobicContact CD1-CD2 3.74Å; F28-L60 HydrophobicContact CE1-CD1 3.88Å; F28-L60 HydrophobicContact CE1-CD2 3.72Å; F28-L60 HydrophobicContact CE1-CG 4.48Å; V39-L60 HydrophobicContact CG2-CD1 3.82Å; L51-L60 HydrophobicContact CD1-CB 3.95Å; L51-L60 HydrophobicContact CD1-CD1 4.43Å; L51-L60 HydrophobicContact CD1-CD2 4.02Å; L51-L60 HydrophobicContact CD1-CG 4.35Å; C54-L60 HydrophobicContact CB-CD2 3.77Å; C54-L60 WeakPolarHBondContact SG-CD2 3.32Å; M58-L60 HydrophobicContact CG-CD2 4.49Å; M58-L60 PolarHBondContact O-N 2.85Å; L60-M86 CarbonylContact O-C 3.53Å; L60-M86 WeakPolarHBondContact O-CA 3.4Å; L60-I87 HydrophobicContact CB-CB 4.47Å; L60-I87 PolarHBondContact N-O 2.94Å; L60-I87 PolarHBondContact O-N 2.99Å; L60-I92 HydrophobicContact CB-CD1 4.46Å; L60-I92 HydrophobicContact CD1-CD1 3.55Å; L60-I92 HydrophobicContact CG-CD1 3.64Å; L60-V95 HydrophobicContact CD1-CG2 4.03Å
61	Q	95.1	Very high	90.1	Very high	42 Å²	42	38.2 Å²	38.2	20%	0.196	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.3	165.4	-169.7	177.1	9.3	0	0	108.7	C52 S53 T84 I85	C52-Q61 HydrophobicContact CB-CB 4.31Å; C52-Q61 HydrophobicContact CB-CG 4.3Å; C52-Q61 WeakPolarHBondContact CB-O 3.3Å; C52-Q61 PolarHBondContact N-O 3.13Å; S53-Q61 PolarHBondContact N-O 3.11Å; S53-Q61 PolarHBondContact O-N 2.62Å; S53-Q61 VanDerWaalsContact OG-CB 3.22Å; S53-Q61 WeakPolarHBondContact OG-CB 3.44Å; S53-Q61 PolarHBondContact OG-OE1 2.78Å; S53-Q61 VanDerWaalsContact OG-OE1 3.13Å; Q61-T84 HydrophobicContact CG-CG2 4Å; Q61-I85 WeakPolarHBondContact CA-O 3.3Å
62	L	95.5	Very high	88.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	143	171.9	-53	-177.5	0	0	0	110.1	V37 V39 I47 R50 L51 V66 T84 I85 I87	V37-L62 HydrophobicContact CG2-CD2 3.57Å; V39-L62 HydrophobicContact CG2-CD1 4.05Å; I47-L62 HydrophobicContact CG2-CD1 3.77Å; R50-L62 CarbonylContact O-C 3.58Å; R50-L62 WeakPolarHBondContact O-CA 3.4Å; L51-L62 HydrophobicContact CB-CD2 4.11Å; L51-L62 HydrophobicContact CD1-CD2 3.79Å; L62-V66 HydrophobicContact CB-CG1 4.47Å; L62-V66 HydrophobicContact CB-CG2 3.76Å; L62-V66 HydrophobicContact CD1-CG1 4.49Å; L62-T84 CarbonylContact O-C 3.57Å; L62-T84 VanDerWaalsContact O-CA 3.24Å; L62-T84 WeakPolarHBondContact O-CA 3.21Å; L62-T84 WeakPolarHBondContact O-CG2 3.41Å; L62-I85 HydrophobicContact CB-CG2 3.98Å; L62-I85 HydrophobicContact CG-CG2 4.43Å; L62-I85 PolarHBondContact N-O 3.37Å; L62-I85 PolarHBondContact O-N 3.36Å; L62-I87 HydrophobicContact CD1-CD1 3.7Å; L62-I87 HydrophobicContact CG-CD1 4.02Å
63	D	93.9	Very high	87	Confident	35 Å²	35	44.4 Å²	44.4	19%	0.187	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	-174.8	176.2	71.8	33.7	0	0	0	112.3	R50 C52 E83	R50-D63 WeakPolarHBondContact CB-OD1 3.32Å; R50-D63 PolarHBondContact N-O 2.8Å; R50-D63 IonicContact NE-OD1 2.99Å; R50-D63 PolarHBondContact NE-OD1 3.41Å; R50-D63 PolarHBondContact O-N 3.11Å; C52-D63 HydrophobicContact CB-CB 4.42Å; C52-D63 VanDerWaalsContact CB-OD2 3.3Å; C52-D63 WeakPolarHBondContact CB-OD2 3.27Å; C52-D63 PolarHBondContact SG-OD2 2.89Å; D63-E83 CarbonylContact C-O 3.52Å; D63-E83 WeakPolarHBondContact CA-O 3.36Å
64	S	90.8	Very high	85.3	Confident	60 Å²	60	50.8 Å²	50.8	42%	0.42	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.1	54.3	171.8	-57	0	0	0	0	114.8	R50 E83	R50-S64 VanDerWaalsContact CZ-OG 3.28Å; R50-S64 PolarHBondContact NE-OG 2.94Å; R50-S64 PolarHBondContact NH2-OG 3.38Å; S64-E83 PolarHBondContact N-O 2.94Å
65	G	85.5	Confident	83.5	Confident	29 Å²	29	60.8 Å²	60.8	30%	0.299	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73.3	66	177.9	0	0	0	0	0	111.6	V82	G65-V82 CarbonylContact C-O 3.58Å
66	V	92.1	Very high	81.8	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	129.5	178.6	-177	0	0	0	0	110.1	I47 T48 L62 I68 V81 V82 I85	I47-V66 HydrophobicContact CG2-CG1 3.35Å; T48-V66 CarbonylContact O-C 3.55Å; T48-V66 VanDerWaalsContact O-CA 3.3Å; T48-V66 WeakPolarHBondContact O-CA 3.3Å; L62-V66 HydrophobicContact CB-CG1 4.47Å; L62-V66 HydrophobicContact CB-CG2 3.76Å; L62-V66 HydrophobicContact CD1-CG1 4.49Å; V66-I68 HydrophobicContact CG1-CG1 4.45Å; V66-V81 CarbonylContact O-C 3.56Å; V66-V81 VanDerWaalsContact O-CA 3.3Å; V66-V81 WeakPolarHBondContact O-CA 3.48Å; V66-V82 WeakPolarHBondContact CA-O 3.41Å; V66-V82 HydrophobicContact CB-CG2 3.81Å; V66-V82 WeakPolarHBondContact CB-O 3.32Å; V66-V82 HydrophobicContact CG1-CG2 4.26Å; V66-V82 PolarHBondContact N-O 3.18Å; V66-V82 PolarHBondContact O-N 3.4Å; V66-I85 HydrophobicContact CB-CG2 4.38Å; V66-I85 HydrophobicContact CG1-CG2 3.71Å; V66-I85 HydrophobicContact CG2-CG2 4.18Å
67	I	93	Very high	80.5	Confident	51 Å²	51	72.4 Å²	72.4	26%	0.262	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.7	-178.1	-54	-179.6	0	0	0	108.9	I47 T48 R69 V79	I47-I67 CarbonylContact C-O 3.6Å; I47-I67 WeakPolarHBondContact CA-O 3.3Å; T48-I67 PolarHBondContact N-O 3.4Å; T48-I67 PolarHBondContact O-N 3.13Å; I67-R69 HydrophobicContact CG2-CG 4.46Å; I67-V79 HydrophobicContact CG2-CG1 3.46Å; I67-V79 VanDerWaalsContact CG2-CG1 3.46Å
68	I	93.5	Very high	79.6	Confident	22 Å²	22	70.6 Å²	70.6	11%	0.113	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.9	179.4	-53.9	168.2	0	0	0	108.8	T45 R46 I47 V66 V79 I80 V82 I85	T45-I68 HydrophobicContact CG2-CG2 3.59Å; R46-I68 CarbonylContact O-C 3.53Å; R46-I68 WeakPolarHBondContact O-CA 3.32Å; I47-I68 HydrophobicContact CG1-CG1 4.28Å; I47-I68 HydrophobicContact CG1-CG2 4.28Å; I47-I68 HydrophobicContact CG2-CG1 4.17Å; V66-I68 HydrophobicContact CG1-CG1 4.45Å; I68-V79 WeakPolarHBondContact O-CA 3.45Å; I68-I80 HydrophobicContact CB-CB 4.22Å; I68-I80 HydrophobicContact CD1-CG2 4.49Å; I68-I80 PolarHBondContact N-O 3.02Å; I68-I80 PolarHBondContact O-N 3.37Å; I68-V82 HydrophobicContact CD1-CG2 4.2Å; I68-I85 HydrophobicContact CD1-CD1 3.76Å
69	R	90.9	Very high	79.2	Confident	99 Å²	99	71.1 Å²	71.1	37%	0.374	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.1	177.8	-63.9	-177.3	174.9	90.5	-1.2	110.1	T45 R46 I67 V79	T45-R69 CarbonylContact C-O 3.59Å; T45-R69 WeakPolarHBondContact CA-O 3.42Å; T45-R69 WeakPolarHBondContact CG2-O 3.39Å; R46-R69 HydrophobicContact CB-CB 4.37Å; R46-R69 PolarHBondContact N-O 3.46Å; R46-R69 PolarHBondContact O-N 2.83Å; I67-R69 HydrophobicContact CG2-CG 4.46Å; R69-V79 HydrophobicContact CG-CG2 4.09Å
70	K	86.2	Confident	79.1	Confident	76 Å²	76	73.2 Å²	73.2	33%	0.33	39%	0.388	S	S	.	.			trans	-83.3	148.6	175.5	-70	-173	176.7	-176	0	111.4	D72 S73	K70-D72 VanDerWaalsContact C-N 3.32Å; K70-D72 PolarHBondContact O-N 2.81Å; K70-S73 PolarHBondContact O-OG 3.46Å
71	P	78.4	Confident	79	Confident	85 Å²	85	77.7 Å²	77.7	55%	0.552	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-26.8	-175.2	30.7	-40.8	0	0	0	114.3	D43 E44	D43-P71 VanDerWaalsContact O-CG 3.28Å; D43-P71 WeakPolarHBondContact O-CG 3.49Å; E44-P71 HydrophobicContact CB-CB 3.72Å; E44-P71 HydrophobicContact CB-CG 4.06Å
72	D	66.5	Low	78.9	Confident	138 Å²	138	77.9 Å²	77.9	74%	0.738	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	29.2	-170	-159.5	10.4	0	0	0	113.4	K70 D74	K70-D72 VanDerWaalsContact C-N 3.32Å; K70-D72 PolarHBondContact O-N 2.81Å; D72-D74 PolarHBondContact O-N 3.06Å
73	S	58.6	Low	78.8	Confident	37 Å²	37	84.2 Å²	84.2	26%	0.259	45%	0.448	S	S	.	.			trans	-84.9	60.5	172.3	57	0	0	0	0	110.9	K70 R75	K70-S73 PolarHBondContact O-OG 3.46Å; S73-R75 PolarHBondContact O-N 2.63Å
74	D	54.7	Low	78.8	Confident	156 Å²	156	84.9 Å²	84.9	83%	0.834	45%	0.454	S	S	*	.			trans	-63.8	0.8	171.6	-119.8	4.5	0	0	0	112.7	D72	D72-D74 PolarHBondContact O-N 3.06Å
75	R	51	Low	78.9	Confident	226 Å²	226	83.5 Å²	83.5	85%	0.853	44%	0.442	S	S	*	.	S	Bend	trans	-131.6	105.1	168	-63.4	-178.5	178.4	-175.8	-0.3	107.9	S73	S73-R75 PolarHBondContact O-N 2.63Å
76	L	50.6	Low	79.4	Confident	165 Å²	165	87.5 Å²	87.5	86%	0.864	45%	0.454	S	S	*	.	S	Bend	trans	51	84.7	167.8	-69.5	157.4	0	0	0	114.7	A78	L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.19Å
77	N	55.1	Low	79.5	Confident	130 Å²	130	87.9 Å²	87.9	70%	0.695	46%	0.456	S	S	*	.			trans	23.1	68	150.5	-74.4	-33.5	0	0	0	113.8	V79	N77-V79 HydrophobicContact CB-CG2 4.03Å; N77-V79 WeakPolarHBondContact O-CG2 3.38Å; N77-V79 PolarHBondContact O-N 3.03Å
78	A	64.8	Low	79.5	Confident	50 Å²	50	88.3 Å²	88.3	41%	0.413	46%	0.456	S	S	.	.			trans	-69	89.6	176.8	0	0	0	0	0	106.8	L76	L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.19Å
79	V	82.7	Confident	79.4	Confident	58 Å²	58	87.7 Å²	87.7	35%	0.352	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	110	-173.9	171.8	0	0	0	0	106.6	I67 I68 R69 N77 V81	I67-V79 HydrophobicContact CG2-CG1 3.46Å; I67-V79 VanDerWaalsContact CG2-CG1 3.46Å; I68-V79 WeakPolarHBondContact O-CA 3.45Å; R69-V79 HydrophobicContact CG-CG2 4.09Å; N77-V79 HydrophobicContact CB-CG2 4.03Å; N77-V79 WeakPolarHBondContact O-CG2 3.38Å; N77-V79 PolarHBondContact O-N 3.03Å; V79-V81 HydrophobicContact CG1-CG2 3.96Å
80	I	88.4	Confident	79.5	Confident	76 Å²	76	90.6 Å²	90.6	39%	0.39	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	126	172.5	-55.1	170.5	0	0	0	106.9	I68 V82	I68-I80 HydrophobicContact CB-CB 4.22Å; I68-I80 HydrophobicContact CD1-CG2 4.49Å; I68-I80 PolarHBondContact N-O 3.02Å; I68-I80 PolarHBondContact O-N 3.37Å; I80-V82 HydrophobicContact CG2-CG1 4.03Å
81	V	91.5	Very high	79.8	Confident	96 Å²	96	92.8 Å²	92.8	58%	0.582	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.2	175.9	-174.4	0	0	0	0	108.8	V66 V79	V66-V81 CarbonylContact O-C 3.56Å; V66-V81 VanDerWaalsContact O-CA 3.3Å; V66-V81 WeakPolarHBondContact O-CA 3.48Å; V79-V81 HydrophobicContact CG1-CG2 3.96Å
82	V	92.7	Very high	80.6	Confident	47 Å²	47	89.5 Å²	89.5	29%	0.285	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.6	177.1	-59.9	0	0	0	0	110.1	G65 V66 I68 I80 T84 I85	G65-V82 CarbonylContact C-O 3.58Å; V66-V82 WeakPolarHBondContact CA-O 3.41Å; V66-V82 HydrophobicContact CB-CG2 3.81Å; V66-V82 WeakPolarHBondContact CB-O 3.32Å; V66-V82 HydrophobicContact CG1-CG2 4.26Å; V66-V82 PolarHBondContact N-O 3.18Å; V66-V82 PolarHBondContact O-N 3.4Å; I68-V82 HydrophobicContact CD1-CG2 4.2Å; I80-V82 HydrophobicContact CG2-CG1 4.03Å; V82-T84 VanDerWaalsContact C-N 3.34Å; V82-T84 PolarHBondContact O-N 3.03Å; V82-I85 HydrophobicContact CG2-CB 4.22Å
83	E	93.2	Very high	82	Confident	132 Å²	132	87.4 Å²	87.4	62%	0.617	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	-36.5	-179.2	-74.4	-65.7	171.2	0	0	112.8	D63 S64	D63-E83 CarbonylContact C-O 3.52Å; D63-E83 WeakPolarHBondContact CA-O 3.36Å; S64-E83 PolarHBondContact N-O 2.94Å
84	T	94	Very high	83.7	Confident	49 Å²	49	92.5 Å²	92.5	30%	0.301	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	144.8	-175.9	-55.7	0	0	0	0	109	Q61 L62 V82	Q61-T84 HydrophobicContact CG-CG2 4Å; L62-T84 CarbonylContact O-C 3.57Å; L62-T84 VanDerWaalsContact O-CA 3.24Å; L62-T84 WeakPolarHBondContact O-CA 3.21Å; L62-T84 WeakPolarHBondContact O-CG2 3.41Å; V82-T84 VanDerWaalsContact C-N 3.34Å; V82-T84 PolarHBondContact O-N 3.03Å
85	I	94.1	Very high	85.6	Confident	32 Å²	32	86.6 Å²	86.6	16%	0.164	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.6	172.8	-167.6	162.7	0	0	0	110.5	I47 Q61 L62 V66 I68 V82 I87	I47-I85 HydrophobicContact CD1-CD1 4.35Å; I47-I85 HydrophobicContact CG2-CG2 4.2Å; Q61-I85 WeakPolarHBondContact CA-O 3.3Å; L62-I85 HydrophobicContact CB-CG2 3.98Å; L62-I85 HydrophobicContact CG-CG2 4.43Å; L62-I85 PolarHBondContact N-O 3.37Å; L62-I85 PolarHBondContact O-N 3.36Å; V66-I85 HydrophobicContact CB-CG2 4.38Å; V66-I85 HydrophobicContact CG1-CG2 3.71Å; V66-I85 HydrophobicContact CG2-CG2 4.18Å; I68-I85 HydrophobicContact CD1-CD1 3.76Å; V82-I85 HydrophobicContact CG2-CB 4.22Å; I85-I87 HydrophobicContact CG1-CG1 4.44Å; I85-I87 HydrophobicContact CG2-CD1 4.24Å; I85-I87 HydrophobicContact CG2-CG1 4.01Å
86	M	95.3	Very high	87.7	Confident	113 Å²	113	78.8 Å²	78.8	56%	0.557	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.8	165.3	-174.8	168.5	-72.8	0	0	109	L60	L60-M86 CarbonylContact O-C 3.53Å; L60-M86 WeakPolarHBondContact O-CA 3.4Å
87	I	94.3	Very high	89.5	Confident	7 Å²	7	73.4 Å²	73.4	4%	0.036	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.4	-177.9	-51.9	171.5	0	0	0	107.6	V39 L41 I47 N59 L60 L62 I85 I92	V39-I87 HydrophobicContact CB-CD1 4.07Å; V39-I87 HydrophobicContact CG1-CD1 4.11Å; V39-I87 HydrophobicContact CG1-CG2 4.41Å; V39-I87 HydrophobicContact CG2-CD1 4.06Å; L41-I87 HydrophobicContact CD2-CG2 3.6Å; I47-I87 HydrophobicContact CB-CD1 4.18Å; I47-I87 HydrophobicContact CD1-CD1 3.81Å; I47-I87 HydrophobicContact CD1-CG1 4.1Å; I47-I87 HydrophobicContact CG2-CD1 4Å; N59-I87 CarbonylContact C-O 3.16Å; N59-I87 VanDerWaalsContact CA-O 3.27Å; N59-I87 WeakPolarHBondContact CA-O 3.4Å; L60-I87 HydrophobicContact CB-CB 4.47Å; L60-I87 PolarHBondContact N-O 2.94Å; L60-I87 PolarHBondContact O-N 2.99Å; L62-I87 HydrophobicContact CD1-CD1 3.7Å; L62-I87 HydrophobicContact CG-CD1 4.02Å; I85-I87 HydrophobicContact CG1-CG1 4.44Å; I85-I87 HydrophobicContact CG2-CD1 4.24Å; I85-I87 HydrophobicContact CG2-CG1 4.01Å; I87-I92 HydrophobicContact CB-CD1 4.45Å; I87-I92 HydrophobicContact CG2-CD1 3.84Å; I87-I92 HydrophobicContact CG2-CG1 3.64Å
88	F	93.1	Very high	91	Very high	61 Å²	61	68.8 Å²	68.8	27%	0.268	35%	0.348	S	S	.	.			trans	-77.1	133.6	178.7	-64.5	-72.8	0	0	0	111.5	N59 K90 R91 M193	N59-F88 VanDerWaalsContact OD1-CA 3.28Å; N59-F88 WeakPolarHBondContact OD1-CA 3.32Å; F88-K90 PolarHBondContact O-N 3.46Å; F88-K90 VanDerWaalsContact O-N 3.13Å; F88-R91 PolarHBondContact O-N 3.24Å; F88-M193 HydrophobicContact CE2-SD 3.74Å; F88-M193 HydrophobicContact CZ-CE 4.25Å; F88-M193 HydrophobicContact CZ-SD 3.59Å; F88-M193 VanDerWaalsContact CZ-SD 3.59Å
89	G	91.1	Very high	92.1	Very high	9 Å²	9	76.9 Å²	76.9	9%	0.093	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-56.4	-33.8	-175.9	0	0	0	0	0	113.7	M58 N59 R91 I92	M58-G89 WeakPolarHBondContact O-CA 3.24Å; N59-G89 PolarHBondContact OD1-N 2.86Å; G89-R91 PolarHBondContact O-N 2.91Å; G89-R91 VanDerWaalsContact O-N 3.15Å; G89-I92 PolarHBondContact O-N 3.2Å; G89-I92 VanDerWaalsContact O-N 3.12Å
90	K	92.8	Very high	92.2	Very high	160 Å²	160	79.5 Å²	79.5	70%	0.696	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-59.9	-22.7	176	-63.6	-178.4	-178.5	176.3	0	113.9	L42 F88	L42-K90 VanDerWaalsContact CD1-O 3.29Å; L42-K90 WeakPolarHBondContact CD1-O 3.17Å; F88-K90 PolarHBondContact O-N 3.46Å; F88-K90 VanDerWaalsContact O-N 3.13Å
91	R	93.7	Very high	92.1	Very high	121 Å²	121	77.3 Å²	77.3	46%	0.457	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-95.4	-9.4	-179.3	-63.3	-66.6	-68	-153.9	-1.5	113	L41 L42 D43 F88 G89	L41-R91 CarbonylContact C-O 3.57Å; L41-R91 WeakPolarHBondContact CA-O 3.14Å; L41-R91 WeakPolarHBondContact CB-O 3.21Å; L41-R91 HydrophobicContact CD2-CB 4.37Å; L42-R91 PolarHBondContact N-O 3.44Å; D43-R91 IonicContact OD2-CZ 3.95Å; D43-R91 IonicContact OD2-NH2 2.85Å; D43-R91 PolarHBondContact OD2-NH2 3.26Å; F88-R91 PolarHBondContact O-N 3.24Å; G89-R91 PolarHBondContact O-N 2.91Å; G89-R91 VanDerWaalsContact O-N 3.15Å
92	I	94.5	Very high	92	Very high	16 Å²	16	77 Å²	77	8%	0.082	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	128.8	-172.9	-62.5	176.1	0	0	0	109.7	V39 L41 M58 L60 I87 G89 V95	V39-I92 HydrophobicContact CG1-CB 4.38Å; V39-I92 HydrophobicContact CG1-CD1 4.08Å; V39-I92 HydrophobicContact CG1-CG1 3.81Å; V39-I92 HydrophobicContact CG1-CG2 3.91Å; L41-I92 HydrophobicContact CD2-CG1 4.19Å; M58-I92 HydrophobicContact CE-CB 3.55Å; M58-I92 HydrophobicContact CE-CD1 4.16Å; M58-I92 HydrophobicContact CE-CG1 4.42Å; M58-I92 HydrophobicContact CE-CG2 3.54Å; M58-I92 WeakPolarHBondContact O-CD1 3.27Å; L60-I92 HydrophobicContact CB-CD1 4.46Å; L60-I92 HydrophobicContact CD1-CD1 3.55Å; L60-I92 HydrophobicContact CG-CD1 3.64Å; I87-I92 HydrophobicContact CB-CD1 4.45Å; I87-I92 HydrophobicContact CG2-CD1 3.84Å; I87-I92 HydrophobicContact CG2-CG1 3.64Å; G89-I92 PolarHBondContact O-N 3.2Å; G89-I92 VanDerWaalsContact O-N 3.12Å; I92-V95 HydrophobicContact CG2-CG2 3.72Å
93	R	95.2	Very high	91.6	Very high	94 Å²	94	78 Å²	78	36%	0.355	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-51	172.8	-174.5	176.8	-79.6	144.1	7.1	111.3	I40 L42 E44	I40-R93 WeakPolarHBondContact O-CA 3.49Å; I40-R93 WeakPolarHBondContact O-CB 3.23Å; I40-R93 PolarHBondContact O-N 3.47Å; L42-R93 HydrophobicContact CD2-CB 4.14Å; L42-R93 PolarHBondContact O-NH1 3.23Å; L42-R93 PolarHBondContact O-NH2 2.98Å; E44-R93 IonicContact OE1-CZ 3.72Å; E44-R93 IonicContact OE1-NH1 2.58Å; E44-R93 PolarHBondContact OE1-NH1 3.19Å
94	Y	95.4	Very high	91.3	Very high	145 Å²	145	76 Å²	76	57%	0.569	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	149.8	-179.3	-55.8	-61.4	0	0	0	111.7	V39 I40	V39-Y94 WeakPolarHBondContact CA-O 3.42Å; I40-Y94 HydrophobicContact CB-CD2 4.33Å; I40-Y94 HydrophobicContact CD1-CD2 4.3Å; I40-Y94 HydrophobicContact CG2-CD2 4.48Å; I40-Y94 PolarHBondContact N-O 2.92Å; I40-Y94 PolarHBondContact O-N 2.87Å
95	V	94.7	Very high	91	Very high	31 Å²	31	75.9 Å²	75.9	19%	0.188	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	127.9	167.1	-176.4	0	0	0	0	108	F28 V37 T38 V39 L60 I92 V97	F28-V95 HydrophobicContact CE1-CB 4.18Å; F28-V95 HydrophobicContact CE1-CG1 3.89Å; F28-V95 HydrophobicContact CE1-CG2 3.96Å; F28-V95 HydrophobicContact CZ-CB 4.1Å; F28-V95 HydrophobicContact CZ-CG1 4.29Å; F28-V95 HydrophobicContact CZ-CG2 3.85Å; V37-V95 HydrophobicContact CB-CG1 4.27Å; T38-V95 WeakPolarHBondContact O-CA 3.24Å; V39-V95 HydrophobicContact CG1-CG2 4.4Å; V39-V95 HydrophobicContact CG2-CG1 4.46Å; V39-V95 HydrophobicContact CG2-CG2 4.32Å; L60-V95 HydrophobicContact CD1-CG2 4.03Å; I92-V95 HydrophobicContact CG2-CG2 3.72Å; V95-V97 PolarHBondContact O-N 3.27Å
96	T	93.5	Very high	90.7	Very high	62 Å²	62	75.8 Å²	75.8	38%	0.38	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-72.9	129.8	177.4	61.7	0	0	0	0	110.5	T38	T38-T96 PolarHBondContact N-OG1 3.08Å; T38-T96 PolarHBondContact O-N 2.93Å; T38-T96 PolarHBondContact O-OG1 3.39Å
97	V	90.3	Very high	90.2	Very high	53 Å²	53	72.4 Å²	72.4	32%	0.321	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-99.9	128.6	171.2	178.9	0	0	0	0	108.7	L32 V95 K99 I101 I103	L32-V97 HydrophobicContact CD1-CG2 4.37Å; L32-V97 HydrophobicContact CD2-CG1 4.23Å; L32-V97 HydrophobicContact CD2-CG2 4.49Å; V95-V97 PolarHBondContact O-N 3.27Å; V97-K99 PolarHBondContact O-N 3.22Å; V97-I101 HydrophobicContact CG1-CB 4.24Å; V97-I101 HydrophobicContact CG1-CD1 4.34Å; V97-I103 HydrophobicContact CG1-CD1 4.38Å; V97-I103 HydrophobicContact CG1-CG1 4.36Å
98	P	86.6	Confident	89.8	Confident	33 Å²	33	74.8 Å²	74.8	21%	0.214	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-53.4	131.8	172.7	-26.7	32.6	0	0	0	112.2	S100 I101	P98-S100 PolarHBondContact O-N 3.29Å; P98-I101 HydrophobicContact CB-CD1 4.02Å; P98-I101 HydrophobicContact CB-CG1 4.26Å; P98-I101 HydrophobicContact CG-CD1 3.92Å; P98-I101 PolarHBondContact O-N 3.38Å
99	K	86.2	Confident	89.5	Confident	220 Å²	220	77 Å²	77	96%	0.957	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.4	-178.4	-65	-175.4	179.3	-178.1	0	114.5	V97 I101	V97-K99 PolarHBondContact O-N 3.22Å; K99-I101 PolarHBondContact O-N 3.4Å
100	S	86.1	Confident	89.1	Confident	112 Å²	112	78 Å²	78	78%	0.783	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-9.1	178.2	59.8	0	0	0	0	113.7	P98	P98-S100 PolarHBondContact O-N 3.29Å
101	I	86	Confident	88.4	Confident	31 Å²	31	76.1 Å²	76.1	16%	0.159	40%	0.395	C	S	.	.			trans	-94.4	119.6	-177.7	-61.9	173.5	0	0	0	108.4	A31 L32 V97 P98 K99 I103	A31-I101 HydrophobicContact CB-CD1 4Å; A31-I101 HydrophobicContact CB-CG2 3.83Å; L32-I101 HydrophobicContact CD2-CD1 3.81Å; V97-I101 HydrophobicContact CG1-CB 4.24Å; V97-I101 HydrophobicContact CG1-CD1 4.34Å; P98-I101 HydrophobicContact CB-CD1 4.02Å; P98-I101 HydrophobicContact CB-CG1 4.26Å; P98-I101 HydrophobicContact CG-CD1 3.92Å; P98-I101 PolarHBondContact O-N 3.38Å; K99-I101 PolarHBondContact O-N 3.4Å; I101-I103 PolarHBondContact O-N 3.37Å
102	D	88.6	Confident	87.8	Confident	90 Å²	90	73.8 Å²	73.8	48%	0.481	40%	0.397	S	S	.	.			trans	-81.9	107.4	163.2	174.1	17.7	0	0	0	108.9	S104 S105 T106	D102-S104 VanDerWaalsContact C-N 3.27Å; D102-S104 PolarHBondContact O-N 2.85Å; D102-S104 PolarHBondContact OD1-N 3.18Å; D102-S104 VanDerWaalsContact OD1-N 3.13Å; D102-S105 VanDerWaalsContact CB-OG 3.3Å; D102-S105 WeakPolarHBondContact CB-OG 3.34Å; D102-S105 PolarHBondContact O-OG 3.18Å; D102-S105 VanDerWaalsContact OD2-CB 3.27Å; D102-S105 WeakPolarHBondContact OD2-CB 3.22Å; D102-S105 PolarHBondContact OD2-OG 2.75Å; D102-T106 WeakPolarHBondContact O-CB 3.41Å; D102-T106 PolarHBondContact O-N 3.07Å; D102-T106 VanDerWaalsContact O-N 3.14Å; D102-T106 PolarHBondContact O-OG1 2.92Å
103	I	85.6	Confident	87	Confident	68 Å²	68	78 Å²	78	35%	0.349	42%	0.415	S	S	.	.	H	α-helix	trans	-61	-39.6	-176.1	-62.9	172.8	0	0	0	110.4	I27 V97 I101 L107	I27-I103 HydrophobicContact CD1-CB 4.41Å; I27-I103 HydrophobicContact CD1-CG1 4.42Å; I27-I103 HydrophobicContact CD1-CG2 4.02Å; I27-I103 HydrophobicContact CG1-CG2 4.42Å; V97-I103 HydrophobicContact CG1-CD1 4.38Å; V97-I103 HydrophobicContact CG1-CG1 4.36Å; I101-I103 PolarHBondContact O-N 3.37Å; I103-L107 HydrophobicContact CG2-CD1 3.76Å; I103-L107 HydrophobicContact CG2-CG 4.32Å; I103-L107 WeakPolarHBondContact O-CB 3.47Å; I103-L107 VanDerWaalsContact O-CG 3.27Å; I103-L107 WeakPolarHBondContact O-CG 3.47Å; I103-L107 PolarHBondContact O-N 3.05Å
104	S	86.6	Confident	85.8	Confident	88 Å²	88	74.8 Å²	74.8	62%	0.615	41%	0.407	S	S	*	.	H	α-helix	trans	-70.1	-49.5	-171.7	-53.5	0	0	0	0	111.4	D102 L107 A108	D102-S104 VanDerWaalsContact C-N 3.27Å; D102-S104 PolarHBondContact O-N 2.85Å; D102-S104 PolarHBondContact OD1-N 3.18Å; D102-S104 VanDerWaalsContact OD1-N 3.13Å; S104-L107 PolarHBondContact O-N 2.97Å; S104-A108 PolarHBondContact O-N 2.87Å; S104-A108 VanDerWaalsContact O-N 3.08Å
105	S	88.2	Confident	84.3	Confident	47 Å²	47	75 Å²	75	33%	0.329	41%	0.413	S	S	.	.	H	α-helix	trans	-64.7	-40.8	176.7	51.7	0	0	0	0	111.9	D102 L107 A108 E109	D102-S105 VanDerWaalsContact CB-OG 3.3Å; D102-S105 WeakPolarHBondContact CB-OG 3.34Å; D102-S105 PolarHBondContact O-OG 3.18Å; D102-S105 VanDerWaalsContact OD2-CB 3.27Å; D102-S105 WeakPolarHBondContact OD2-CB 3.22Å; D102-S105 PolarHBondContact OD2-OG 2.75Å; S105-L107 VanDerWaalsContact C-N 3.35Å; S105-L107 PolarHBondContact O-N 2.94Å; S105-A108 PolarHBondContact O-N 3.18Å; S105-E109 WeakPolarHBondContact O-CG 3.38Å; S105-E109 PolarHBondContact O-N 2.95Å
106	T	87.5	Confident	82.7	Confident	30 Å²	30	78.6 Å²	78.6	18%	0.184	43%	0.431	C	S	.	.	H	α-helix	trans	-63.9	-39.9	-179.9	-53.2	0	0	0	0	112.2	I27 A30 A31 D102 W110	I27-T106 HydrophobicContact CD1-CG2 4.39Å; A30-T106 HydrophobicContact CB-CG2 3.83Å; A31-T106 HydrophobicContact CB-CG2 3.62Å; D102-T106 WeakPolarHBondContact O-CB 3.41Å; D102-T106 PolarHBondContact O-N 3.07Å; D102-T106 VanDerWaalsContact O-N 3.14Å; D102-T106 PolarHBondContact O-OG1 2.92Å; T106-W110 WeakPolarHBondContact O-CB 3.42Å; T106-W110 PolarHBondContact O-N 3.23Å
107	L	85.3	Confident	80.9	Confident	43 Å²	43	78.5 Å²	78.5	23%	0.225	44%	0.443	C	S	.	.	H	α-helix	trans	-68.8	-41.6	175.8	-72.9	175.1	0	0	0	112.2	L24 A26 I27 I103 S104 S105 E109 W110 E111	L24-L107 HydrophobicContact CD1-CD1 4.11Å; A26-L107 HydrophobicContact CB-CD2 3.83Å; I27-L107 HydrophobicContact CB-CD2 4.18Å; I27-L107 HydrophobicContact CD1-CD2 4.28Å; I27-L107 HydrophobicContact CD1-CG 4.22Å; I103-L107 HydrophobicContact CG2-CD1 3.76Å; I103-L107 HydrophobicContact CG2-CG 4.32Å; I103-L107 WeakPolarHBondContact O-CB 3.47Å; I103-L107 VanDerWaalsContact O-CG 3.27Å; I103-L107 WeakPolarHBondContact O-CG 3.47Å; I103-L107 PolarHBondContact O-N 3.05Å; S104-L107 PolarHBondContact O-N 2.97Å; S105-L107 VanDerWaalsContact C-N 3.35Å; S105-L107 PolarHBondContact O-N 2.94Å; L107-E109 VanDerWaalsContact C-N 3.34Å; L107-E109 PolarHBondContact O-N 2.93Å; L107-W110 WeakPolarHBondContact O-CB 3.27Å; L107-W110 PolarHBondContact O-N 3.29Å; L107-E111 WeakPolarHBondContact O-CB 3.47Å; L107-E111 PolarHBondContact O-N 3.08Å
108	A	85.7	Confident	79	Confident	57 Å²	57	85.4 Å²	85.4	47%	0.471	46%	0.463	S	S	.	.	H	α-helix	trans	-62	-41.9	176.6	0	0	0	0	0	111.9	S104 S105 S112	S104-A108 PolarHBondContact O-N 2.87Å; S104-A108 VanDerWaalsContact O-N 3.08Å; S105-A108 PolarHBondContact O-N 3.18Å; A108-S112 WeakPolarHBondContact O-CB 3.42Å; A108-S112 PolarHBondContact O-N 2.91Å
109	E	85.6	Confident	77.5	Confident	107 Å²	107	85.4 Å²	85.4	50%	0.5	46%	0.461	S	S	.	.	H	α-helix	trans	-63.4	-41.2	173.2	-77.1	-171	-156.1	0	0	112.5	S105 L107 K113	S105-E109 WeakPolarHBondContact O-CG 3.38Å; S105-E109 PolarHBondContact O-N 2.95Å; L107-E109 VanDerWaalsContact C-N 3.34Å; L107-E109 PolarHBondContact O-N 2.93Å; E109-K113 WeakPolarHBondContact O-CB 3.13Å; E109-K113 WeakPolarHBondContact O-CD 3.2Å; E109-K113 VanDerWaalsContact O-CG 3.27Å; E109-K113 WeakPolarHBondContact O-CG 3.42Å; E109-K113 PolarHBondContact O-N 3.46Å; E109-K113 IonicContact OE2-NZ 3.42Å; E109-K113 PolarHBondContact OE2-NZ 3.06Å
110	W	82.7	Confident	75.9	Confident	31 Å²	31	83.5 Å²	83.5	12%	0.117	45%	0.453	C	S	.	.	H	α-helix	trans	-63.7	-46.4	178.2	179.9	-98.2	0	0	0	111.5	Y21 P29 A30 T106 L107 S112 K113 S114 I119 L121	Y21-W110 AromaticContact CD1-NE1 3.65Å; Y21-W110 AromaticContact CE1-CZ2 4Å; Y21-W110 HydrophobicContact CE1-CZ2 4Å; Y21-W110 AromaticContact CE1-NE1 3.91Å; P29-W110 HydrophobicContact CB-CH2 3.62Å; P29-W110 HydrophobicContact CB-CZ2 3.86Å; P29-W110 HydrophobicContact CB-CZ3 4.29Å; P29-W110 HydrophobicContact CG-CH2 4.01Å; P29-W110 HydrophobicContact CG-CZ2 3.71Å; A30-W110 HydrophobicContact CB-CB 3.75Å; A30-W110 HydrophobicContact CB-CD2 3.75Å; A30-W110 HydrophobicContact CB-CE3 3.68Å; A30-W110 HydrophobicContact CB-CG 3.8Å; A30-W110 HydrophobicContact CB-CZ3 4.49Å; T106-W110 WeakPolarHBondContact O-CB 3.42Å; T106-W110 PolarHBondContact O-N 3.23Å; L107-W110 WeakPolarHBondContact O-CB 3.27Å; L107-W110 PolarHBondContact O-N 3.29Å; W110-S112 PolarHBondContact O-N 2.8Å; W110-K113 PolarHBondContact O-N 3.11Å; W110-S114 WeakPolarHBondContact O-CB 3.47Å; W110-S114 PolarHBondContact O-N 3.47Å; W110-S114 PolarHBondContact O-OG 2.88Å; W110-I119 HydrophobicContact CD2-CD1 3.79Å; W110-I119 HydrophobicContact CE3-CD1 3.77Å; W110-I119 HydrophobicContact CH2-CD1 3.84Å; W110-I119 HydrophobicContact CH2-CG2 3.3Å; W110-I119 HydrophobicContact CZ2-CD1 3.85Å; W110-I119 HydrophobicContact CZ2-CG2 3.67Å; W110-I119 HydrophobicContact CZ3-CD1 3.8Å; W110-I119 HydrophobicContact CZ3-CG2 4Å; W110-L121 HydrophobicContact CH2-CD2 3.89Å; W110-L121 HydrophobicContact CZ2-CD2 4.21Å
111	E	79	Confident	74.5	Confident	120 Å²	120	80.1 Å²	80.1	56%	0.561	43%	0.426	S	S	*	.	H	α-helix	trans	-59.9	-46	177.4	-173.7	173.6	-167.9	0	0	111.1	L107 K113 S114 Q115	L107-E111 WeakPolarHBondContact O-CB 3.47Å; L107-E111 PolarHBondContact O-N 3.08Å; E111-K113 PolarHBondContact O-N 2.97Å; E111-S114 WeakPolarHBondContact O-CB 3.24Å; E111-S114 PolarHBondContact O-N 3.44Å; E111-S114 VanDerWaalsContact O-N 3.14Å; E111-Q115 WeakPolarHBondContact O-CG 3.42Å; E111-Q115 PolarHBondContact O-N 3.5Å
112	S	80	Confident	72.7	Confident	71 Å²	71	83.5 Å²	83.5	50%	0.497	45%	0.45	S	S	.	.	H	α-helix	trans	-58.8	-46.3	175.4	175.7	0	0	0	0	112.3	A108 W110 S114 Q115	A108-S112 WeakPolarHBondContact O-CB 3.42Å; A108-S112 PolarHBondContact O-N 2.91Å; W110-S112 PolarHBondContact O-N 2.8Å; S112-S114 VanDerWaalsContact C-N 3.28Å; S112-S114 PolarHBondContact O-N 2.92Å; S112-Q115 PolarHBondContact O-N 3.2Å
113	K	77.9	Confident	70.7	Confident	106 Å²	106	90 Å²	90	46%	0.461	47%	0.467	S	S	.	.	H	α-helix	trans	-66.3	-30.1	177	-71.3	165.9	-170.7	157.7	0	112.6	E109 W110 E111 I119	E109-K113 WeakPolarHBondContact O-CB 3.13Å; E109-K113 WeakPolarHBondContact O-CD 3.2Å; E109-K113 VanDerWaalsContact O-CG 3.27Å; E109-K113 WeakPolarHBondContact O-CG 3.42Å; E109-K113 PolarHBondContact O-N 3.46Å; E109-K113 IonicContact OE2-NZ 3.42Å; E109-K113 PolarHBondContact OE2-NZ 3.06Å; W110-K113 PolarHBondContact O-N 3.11Å; E111-K113 PolarHBondContact O-N 2.97Å; K113-I119 HydrophobicContact CB-CD1 3.77Å; K113-I119 HydrophobicContact CB-CG1 4.15Å
114	S	70	Confident	68.6	Low	26 Å²	26	90.4 Å²	90.4	18%	0.182	48%	0.475	C	S	.	.	H	α-helix	trans	-73.4	-40.4	-179	-58.6	0	0	0	0	111.7	Y21 W110 E111 S112 D116 G117 I119	Y21-S114 WeakPolarHBondContact CD1-OG 3.33Å; Y21-S114 VanDerWaalsContact CE1-OG 3.23Å; Y21-S114 WeakPolarHBondContact CE1-OG 3.45Å; W110-S114 WeakPolarHBondContact O-CB 3.47Å; W110-S114 PolarHBondContact O-N 3.47Å; W110-S114 PolarHBondContact O-OG 2.88Å; E111-S114 WeakPolarHBondContact O-CB 3.24Å; E111-S114 PolarHBondContact O-N 3.44Å; E111-S114 VanDerWaalsContact O-N 3.14Å; S112-S114 VanDerWaalsContact C-N 3.28Å; S112-S114 PolarHBondContact O-N 2.92Å; S114-D116 PolarHBondContact O-N 2.73Å; S114-G117 PolarHBondContact O-N 3.25Å; S114-I119 WeakPolarHBondContact OG-CD1 3.4Å
115	Q	64.9	Low	66.5	Low	150 Å²	150	92.3 Å²	92.3	70%	0.701	48%	0.483	S	S	*	.	H	α-helix	trans	-63.4	-29.6	177.3	-71.6	179.2	3.7	0	0	112.4	E111 S112 G117	E111-Q115 WeakPolarHBondContact O-CG 3.42Å; E111-Q115 PolarHBondContact O-N 3.5Å; S112-Q115 PolarHBondContact O-N 3.2Å; Q115-G117 PolarHBondContact O-N 3.48Å; Q115-G117 VanDerWaalsContact O-N 3.17Å
116	D	60.3	Low	64	Low	105 Å²	105	99.2 Å²	99.2	56%	0.561	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-2.7	174.3	-76.8	-14.5	0	0	0	113.9	S114 R118	S114-D116 PolarHBondContact O-N 2.73Å; D116-R118 HydrophobicContact CB-CG 4.21Å; D116-R118 WeakPolarHBondContact O-CG 3.28Å; D116-R118 PolarHBondContact O-N 3.42Å
117	G	56.9	Low	61.5	Low	61 Å²	61	102.7 Å²	102.7	63%	0.629	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	13.1	178.9	0	0	0	0	0	114.5	S114 Q115	S114-G117 PolarHBondContact O-N 3.25Å; Q115-G117 PolarHBondContact O-N 3.48Å; Q115-G117 VanDerWaalsContact O-N 3.17Å
118	R	50.2	Low	59.2	Low	198 Å²	198	105 Å²	105	75%	0.747	55%	0.552	S	S	*	*			trans	-95.5	-3.7	-171.2	-63.2	-171.1	-164.1	-168.7	6.5	115.1	D116 F120	D116-R118 HydrophobicContact CB-CG 4.21Å; D116-R118 WeakPolarHBondContact O-CG 3.28Å; D116-R118 PolarHBondContact O-N 3.42Å; R118-F120 PolarHBondContact O-N 3Å; R118-F120 VanDerWaalsContact O-N 3.13Å
119	I	54.1	Low	56.8	Low	33 Å²	33	111.9 Å²	111.9	17%	0.169	57%	0.571	C	S	.	*			trans	-84.9	97.2	-174.3	-54.4	-164.3	0	0	0	111.2	Y21 W110 K113 S114	Y21-I119 HydrophobicContact CE1-CB 4.31Å; Y21-I119 HydrophobicContact CE1-CD1 4.37Å; Y21-I119 HydrophobicContact CE1-CG2 4.37Å; Y21-I119 PolarHBondContact OH-O 3.47Å; W110-I119 HydrophobicContact CD2-CD1 3.79Å; W110-I119 HydrophobicContact CE3-CD1 3.77Å; W110-I119 HydrophobicContact CH2-CD1 3.84Å; W110-I119 HydrophobicContact CH2-CG2 3.3Å; W110-I119 HydrophobicContact CZ2-CD1 3.85Å; W110-I119 HydrophobicContact CZ2-CG2 3.67Å; W110-I119 HydrophobicContact CZ3-CD1 3.8Å; W110-I119 HydrophobicContact CZ3-CG2 4Å; K113-I119 HydrophobicContact CB-CD1 3.77Å; K113-I119 HydrophobicContact CB-CG1 4.15Å; S114-I119 WeakPolarHBondContact OG-CD1 3.4Å
120	F	53.5	Low	54.3	Low	180 Å²	180	113 Å²	113	79%	0.789	59%	0.588	S	S	*	*			trans	-88.3	102.5	162.2	-79.1	-93.3	0	0	0	109	R118	R118-F120 PolarHBondContact O-N 3Å; R118-F120 VanDerWaalsContact O-N 3.13Å
121	L	56	Low	52.1	Low	40 Å²	40	119.4 Å²	119.4	21%	0.209	62%	0.624	C	S	.	*	P	Polyproline II helix	trans	-59.5	129.7	168.2	-70.8	166.7	0	0	0	109.3	L20 P29 W110 R123	L20-L121 HydrophobicContact CD1-CD1 3.35Å; P29-L121 HydrophobicContact CB-CD2 3.41Å; P29-L121 VanDerWaalsContact CB-CD2 3.41Å; P29-L121 HydrophobicContact CG-CD2 4.19Å; W110-L121 HydrophobicContact CH2-CD2 3.89Å; W110-L121 HydrophobicContact CZ2-CD2 4.21Å; L121-R123 PolarHBondContact O-N 3.14Å
122	P	48.3	Very low	49.8	Very low	102 Å²	102	124.5 Å²	124.5	66%	0.662	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-57.5	126.4	175.9	-19.7	29.6	0	0	0	109.9
123	R	45.8	Very low	47.6	Very low	227 Å²	227	130.1 Å²	130.1	86%	0.857	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-71.3	133.2	170	-151.1	177.2	-157.7	-171.3	5.2	107.3	L121 T125	L121-R123 PolarHBondContact O-N 3.14Å; R123-T125 PolarHBondContact O-N 2.94Å; R123-T125 VanDerWaalsContact O-N 3.07Å
124	P	42.6	Very low	45.5	Very low	77 Å²	77	131.3 Å²	131.3	50%	0.5	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-55.4	119.5	179.2	17.7	-29	0	0	0	110.3	K126	P124-K126 PolarHBondContact O-N 3.27Å
125	T	41.6	Very low	43.7	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-77.7	116.5	176.2	45.2	0	0	0	0	109.1	R123 S127	R123-T125 PolarHBondContact O-N 2.94Å; R123-T125 VanDerWaalsContact O-N 3.07Å; T125-S127 PolarHBondContact O-N 2.7Å; T125-S127 VanDerWaalsContact O-N 3.12Å
126	K	36.5	Very low	42.3	Very low	191 Å²	191	139.4 Å²	139.4	83%	0.83	71%	0.706	S	S	*	*			trans	-64.9	106	175.1	-68.4	-176.2	177.3	-173.1	0	110.1	P124	P124-K126 PolarHBondContact O-N 3.27Å
127	S	34	Very low	41	Very low	103 Å²	103	144 Å²	144	72%	0.72	72%	0.721	S	S	*	*			trans	-157.5	96.8	158.9	65.2	0	0	0	0	112.9	T125	T125-S127 PolarHBondContact O-N 2.7Å; T125-S127 VanDerWaalsContact O-N 3.12Å
128	S	38.5	Very low	40	Very low	93 Å²	93	146.3 Å²	146.3	65%	0.65	73%	0.728	S	S	*	*			trans	-142.6	112.6	156.4	-36	0	0	0	0	108.4
129	K	34.7	Very low	39.3	Very low	200 Å²	200	144.8 Å²	144.8	87%	0.87	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-69.5	132.8	170.4	-65.9	172.8	179.9	174	0	107.6	L131	K129-L131 PolarHBondContact O-N 2.94Å
130	P	32.7	Very low	38.3	Very low	130 Å²	130	151.8 Å²	151.8	84%	0.844	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-69.3	121.7	175.3	26.5	-30.7	0	0	0	109.7
131	L	35.6	Very low	37.5	Very low	166 Å²	166	150.4 Å²	150.4	87%	0.869	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-86.2	137.2	170	-98.8	161	0	0	0	109.6	K129	K129-L131 PolarHBondContact O-N 2.94Å
132	R	31.9	Very low	36.7	Very low	227 Å²	227	156.8 Å²	156.8	86%	0.857	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-63.5	127.9	-173.1	-76.3	-177.6	165.8	-174.9	-4.9	112.4
133	E	33.8	Very low	36.1	Very low	190 Å²	190	159.7 Å²	159.7	89%	0.888	81%	0.805	S	S	*	*			trans	-77	115.3	164.4	-170.8	168.8	-155.7	0	0	109
134	N	33.5	Very low	35.4	Very low	130 Å²	130	155.3 Å²	155.3	70%	0.695	81%	0.807	S	S	*	*			trans	-128.1	123.3	172.1	-100.2	-12	0	0	0	107.7
135	Q	33	Very low	34.8	Very low	181 Å²	181	161 Å²	161	85%	0.846	83%	0.827	S	S	*	*			trans	81	86.2	161.1	-51.3	-165.9	35.6	0	0	118.4
136	I	35.3	Very low	34.5	Very low	166 Å²	166	160.5 Å²	160.5	85%	0.851	83%	0.829	S	S	*	*			trans	-135.9	102.5	136.3	-56.4	-178.8	0	0	0	107.9
137	K	31.3	Very low	34.1	Very low	202 Å²	202	156.6 Å²	156.6	88%	0.878	83%	0.826	S	S	*	*			trans	-84.5	121.9	163.7	-75.4	176.6	174.4	179.3	0	107.2
138	S	36.9	Very low	34.2	Very low	109 Å²	109	160.6 Å²	160.6	76%	0.762	84%	0.836	S	S	*	*			trans	-152.8	137.5	155.6	-56.6	0	0	0	0	109.7
139	N	35.6	Very low	33.9	Very low	166 Å²	166	162.3 Å²	162.3	89%	0.888	84%	0.842	S	S	*	*			trans	-72	150.7	-163.7	-67.9	-33.9	0	0	0	115
140	E	33.3	Very low	34.2	Very low	179 Å²	179	157.7 Å²	157.7	84%	0.836	84%	0.835	S	S	*	*			trans	-60.9	132.1	163.8	-52	172.1	151.4	0	0	110.3
141	N	37.4	Very low	34.3	Very low	152 Å²	152	159 Å²	159	81%	0.813	84%	0.835	S	S	*	*			trans	179.3	140.5	133.4	-95.7	-12.3	0	0	0	113.4
142	E	38.8	Very low	34.3	Very low	174 Å²	174	158.9 Å²	158.9	81%	0.813	84%	0.835	S	S	*	*			trans	79.1	101.6	158.6	-66.2	179.2	146.3	0	0	118.4
143	L	34.5	Very low	34.4	Very low	163 Å²	163	157.1 Å²	157.1	85%	0.853	83%	0.834	S	S	*	*				59.8	105.2	92.3	-109.7	95.6	0	0	0	113.8
144	C	32.1	Very low	34.8	Very low	134 Å²	134	154 Å²	154	91%	0.905	83%	0.827	S	S	*	*				-170.6	122.5	123.8	-96	0	0	0	0	111.1
145	Q	30.6	Very low	35	Very low	197 Å²	197	153.7 Å²	153.7	92%	0.921	83%	0.826	S	S	*	*			trans	-74.3	141.2	165.7	-68.7	171.3	-17.4	0	0	109.7
146	S	34.5	Very low	35.4	Very low	118 Å²	118	152.4 Å²	152.4	83%	0.825	82%	0.824	S	S	*	*			trans	-152.2	109.1	150.9	-179.6	0	0	0	0	109.6
147	S	28.7	Very low	35.8	Very low	108 Å²	108	151.9 Å²	151.9	76%	0.755	82%	0.822	S	S	*	*			trans	-56.5	150.3	162.1	-54.7	0	0	0	0	111.3
148	M	36	Very low	36.3	Very low	188 Å²	188	150.5 Å²	150.5	93%	0.926	81%	0.813	S	S	*	*			trans	-167.1	134.1	137.1	-90.7	-72.9	169.2	0	0	108.4
149	T	31.6	Very low	36.8	Very low	128 Å²	128	150.3 Å²	150.3	79%	0.785	81%	0.807	S	S	*	*			trans	-89	148.9	-169.9	44.7	0	0	0	0	114
150	S	41	Very low	37.2	Very low	104 Å²	104	149.5 Å²	149.5	73%	0.727	80%	0.803	S	S	*	*			trans	146.6	132.7	149.3	60	0	0	0	0	109.1
151	D	33.9	Very low	37.7	Very low	156 Å²	156	148.1 Å²	148.1	83%	0.834	80%	0.801	S	S	*	*			cis	-155.4	146.8	9.1	-87.7	-34.6	0	0	0	109.1
152	N	37.5	Very low	38.4	Very low	164 Å²	164	144.1 Å²	144.1	88%	0.877	78%	0.782	S	S	*	*			trans	-77.8	129.8	-175.7	-69.5	-48.1	0	0	0	112.7
153	F	34	Very low	39.3	Very low	190 Å²	190	144.1 Å²	144.1	83%	0.833	78%	0.782	S	S	*	*			trans	-153	87.8	143.4	-153.9	-90.7	0	0	0	108.9
154	V	42.4	Very low	40.6	Very low	124 Å²	124	143.9 Å²	143.9	75%	0.752	78%	0.782	S	S	*	*			trans	-123.7	115.6	167	-178.8	0	0	0	0	106.1	I156	V154-I156 WeakPolarHBondContact O-CG1 3.48Å; V154-I156 PolarHBondContact O-N 3.44Å
155	D	36	Very low	42.4	Very low	124 Å²	124	138.7 Å²	138.7	66%	0.663	75%	0.745	S	S	*	*			trans	-54	120	168.8	-98.4	-40.6	0	0	0	109.2	D157	D155-D157 PolarHBondContact O-N 3.3Å
156	I	41.3	Very low	44.7	Very low	155 Å²	155	134.7 Å²	134.7	80%	0.795	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	2.1	-170.3	-69.4	174.3	0	0	0	112.7	V154	V154-I156 WeakPolarHBondContact O-CG1 3.48Å; V154-I156 PolarHBondContact O-N 3.44Å
157	D	43.6	Very low	47	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	15.9	-172.6	-75.3	-18.6	0	0	0	115.7	D155	D155-D157 PolarHBondContact O-N 3.3Å
158	Y	43.5	Very low	49.6	Very low	172 Å²	172	128.1 Å²	128.1	68%	0.675	68%	0.678	S	S	*	*	S	Bend	trans	-105	2.3	-175.6	-145.8	-106.4	0	0	0	116.2	K182	Y158-K182 HydrophobicContact CE1-CD 4.39Å; Y158-K182 WeakPolarHBondContact OH-CE 3.42Å
159	V	46	Very low	51.9	Low	106 Å²	106	125.8 Å²	125.8	64%	0.642	66%	0.664	S	S	*	*			trans	-114.8	46.4	-170.4	-160.5	0	0	0	0	112.5
160	D	44.6	Very low	54.3	Low	149 Å²	149	125.1 Å²	125.1	80%	0.797	65%	0.652	S	S	*	*	S	Bend	trans	-129.6	19.3	179.8	-144.5	16.3	0	0	0	115
161	N	44.3	Very low	56.3	Low	149 Å²	149	122.9 Å²	122.9	80%	0.797	64%	0.637	S	S	*	*			trans	-151.2	25.4	177.2	-88.2	-42.3	0	0	0	115.2	E163	N161-E163 PolarHBondContact O-N 2.84Å
162	T	51	Low	58.7	Low	69 Å²	69	115.8 Å²	115.8	42%	0.423	60%	0.599	S	S	.	*			trans	-80.6	97.1	165	36.5	0	0	0	0	108.5	N164	T162-N164 PolarHBondContact O-N 2.99Å
163	E	58.3	Low	60.8	Low	173 Å²	173	109.5 Å²	109.5	81%	0.808	57%	0.565	S	S	*	*			trans	-39.3	132.9	165.3	-68.5	-178.6	158.2	0	0	109.6	N161 I165	N161-E163 PolarHBondContact O-N 2.84Å; E163-I165 WeakPolarHBondContact O-CG1 3.2Å; E163-I165 PolarHBondContact O-N 3.34Å
164	N	62	Low	63	Low	158 Å²	158	106.1 Å²	106.1	85%	0.845	55%	0.552	S	S	*	*			trans	-49.5	99.7	-175.8	-159.9	-4.1	0	0	0	110.8	T162 P166	T162-N164 PolarHBondContact O-N 2.99Å; N164-P166 WeakPolarHBondContact O-CD 3.06Å
165	I	69.1	Low	64.8	Low	26 Å²	26	101.9 Å²	101.9	13%	0.133	52%	0.524	C	S	.	.			trans	-92.1	98.9	-178.5	-52.4	-167	0	0	0	108.2	E163 W167 L168 P183	E163-I165 WeakPolarHBondContact O-CG1 3.2Å; E163-I165 PolarHBondContact O-N 3.34Å; I165-W167 HydrophobicContact CG2-CD2 3.69Å; I165-W167 HydrophobicContact CG2-CE3 4.33Å; I165-W167 HydrophobicContact CG2-CG 4.08Å; I165-W167 HydrophobicContact CG2-CH2 4.15Å; I165-W167 HydrophobicContact CG2-CZ2 3.48Å; I165-W167 VanDerWaalsContact CG2-CZ2 3.48Å; I165-W167 VanDerWaalsContact CG2-NE1 3.27Å; I165-W167 PolarHBondContact O-N 2.97Å; I165-L168 HydrophobicContact CB-CB 4.49Å; I165-L168 HydrophobicContact CB-CD1 4.38Å; I165-L168 HydrophobicContact CD1-CD1 4.17Å; I165-L168 HydrophobicContact CG2-CB 4.3Å; I165-L168 HydrophobicContact CG2-CD1 3.94Å; I165-L168 HydrophobicContact CG2-CG 3.93Å; I165-L168 PolarHBondContact O-N 3.44Å; I165-P183 HydrophobicContact CD1-CB 3.56Å; I165-P183 HydrophobicContact CD1-CG 3.31Å
166	P	78.9	Confident	66.9	Low	112 Å²	112	96 Å²	96	73%	0.727	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	0.5	-164.5	30.3	-36.2	0	0	0	114.6	N164	N164-P166 WeakPolarHBondContact O-CD 3.06Å
167	W	83.8	Confident	68.7	Low	74 Å²	74	91.8 Å²	91.8	28%	0.28	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	3.1	179.4	59.8	75.7	0	0	0	113.6	I165 G185 K187	I165-W167 HydrophobicContact CG2-CD2 3.69Å; I165-W167 HydrophobicContact CG2-CE3 4.33Å; I165-W167 HydrophobicContact CG2-CG 4.08Å; I165-W167 HydrophobicContact CG2-CH2 4.15Å; I165-W167 HydrophobicContact CG2-CZ2 3.48Å; I165-W167 VanDerWaalsContact CG2-CZ2 3.48Å; I165-W167 VanDerWaalsContact CG2-NE1 3.27Å; I165-W167 PolarHBondContact O-N 2.97Å; W167-G185 WeakPolarHBondContact CZ2-O 3.49Å; W167-K187 HydrophobicContact CB-CD 4.13Å; W167-K187 HydrophobicContact CB-CG 4.18Å; W167-K187 HydrophobicContact CD2-CB 3.7Å; W167-K187 HydrophobicContact CD2-CD 3.94Å; W167-K187 HydrophobicContact CD2-CG 3.69Å; W167-K187 VanDerWaalsContact CE2-CA 3.43Å; W167-K187 HydrophobicContact CE3-CB 4.05Å; W167-K187 HydrophobicContact CE3-CD 3.96Å; W167-K187 HydrophobicContact CE3-CG 4.16Å; W167-K187 HydrophobicContact CG-CB 4.17Å; W167-K187 HydrophobicContact CG-CD 4.02Å; W167-K187 HydrophobicContact CG-CG 3.67Å; W167-K187 HydrophobicContact CH2-CB 4.22Å; W167-K187 HydrophobicContact CZ2-CB 3.87Å; W167-K187 HydrophobicContact CZ3-CB 4.31Å
168	L	83	Confident	70.2	Confident	15 Å²	15	88.3 Å²	88.3	8%	0.079	47%	0.468	C	S	.	.	S	Bend	trans	-114.3	128	174.1	-66.7	179.8	0	0	0	109	I165 D172 L173 F176 P183 D190 V194	I165-L168 HydrophobicContact CB-CB 4.49Å; I165-L168 HydrophobicContact CB-CD1 4.38Å; I165-L168 HydrophobicContact CD1-CD1 4.17Å; I165-L168 HydrophobicContact CG2-CB 4.3Å; I165-L168 HydrophobicContact CG2-CD1 3.94Å; I165-L168 HydrophobicContact CG2-CG 3.93Å; I165-L168 PolarHBondContact O-N 3.44Å; L168-D172 HydrophobicContact CB-CB 4.34Å; L168-D172 HydrophobicContact CD2-CB 4.16Å; L168-L173 HydrophobicContact CB-CD2 4.29Å; L168-L173 HydrophobicContact CB-CG 4.32Å; L168-L173 HydrophobicContact CD1-CD2 3.91Å; L168-F176 HydrophobicContact CD1-CD2 4.36Å; L168-F176 HydrophobicContact CD1-CE2 3.79Å; L168-F176 HydrophobicContact CD1-CZ 4.39Å; L168-F176 HydrophobicContact CD2-CE2 4.1Å; L168-P183 HydrophobicContact CD1-CB 3.6Å; L168-P183 HydrophobicContact CD1-CG 4.15Å; L168-D190 HydrophobicContact CD1-CB 4.13Å; L168-D190 HydrophobicContact CD2-CB 4.21Å; L168-D190 HydrophobicContact CG-CB 4.48Å; L168-V194 HydrophobicContact CD2-CG2 3.49Å; L168-V194 VanDerWaalsContact CD2-CG2 3.49Å
169	E	83.8	Confident	71.8	Confident	138 Å²	138	82.6 Å²	82.6	65%	0.645	45%	0.449	S	S	*	.			trans	-72.8	159	171.4	-65.6	-67.4	157.7	0	0	110	S171 D172 L173	E169-S171 PolarHBondContact O-N 3.1Å; E169-D172 PolarHBondContact N-OD2 3.01Å; E169-D172 WeakPolarHBondContact O-CA 3.49Å; E169-D172 WeakPolarHBondContact O-CB 3.42Å; E169-D172 PolarHBondContact O-N 3.38Å; E169-L173 PolarHBondContact O-N 2.95Å; E169-L173 VanDerWaalsContact O-N 3.11Å
170	Q	82.1	Confident	73.2	Confident	115 Å²	115	80 Å²	80	54%	0.537	44%	0.443	S	S	.	.	H	α-helix	trans	-55	-38.5	176.5	-173.5	64.1	19.4	0	0	111.8	D172 L173 E174	Q170-D172 PolarHBondContact O-N 3.26Å; Q170-L173 PolarHBondContact O-N 2.85Å; Q170-E174 WeakPolarHBondContact O-CG 3.37Å; Q170-E174 PolarHBondContact O-N 3.49Å
171	S	83	Confident	74.6	Confident	57 Å²	57	74.8 Å²	74.8	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-62.8	-30.1	175.2	60.4	0	0	0	0	113.5	E169 Q175	E169-S171 PolarHBondContact O-N 3.1Å; S171-Q175 WeakPolarHBondContact O-CG 3.35Å; S171-Q175 PolarHBondContact O-N 2.99Å
172	D	84.1	Confident	76.4	Confident	7 Å²	7	72.9 Å²	72.9	4%	0.037	40%	0.401	C	S	.	.	H	α-helix	trans	-74.4	-44.5	177.4	-65.1	-21.7	0	0	0	109.3	L168 E169 Q170 E174 Q175 F176 V194 K198	L168-D172 HydrophobicContact CB-CB 4.34Å; L168-D172 HydrophobicContact CD2-CB 4.16Å; E169-D172 PolarHBondContact N-OD2 3.01Å; E169-D172 WeakPolarHBondContact O-CA 3.49Å; E169-D172 WeakPolarHBondContact O-CB 3.42Å; E169-D172 PolarHBondContact O-N 3.38Å; Q170-D172 PolarHBondContact O-N 3.26Å; D172-E174 VanDerWaalsContact C-N 3.29Å; D172-E174 PolarHBondContact O-N 3.25Å; D172-Q175 WeakPolarHBondContact O-CA 3.45Å; D172-Q175 WeakPolarHBondContact O-CB 3.29Å; D172-Q175 PolarHBondContact O-N 2.92Å; D172-F176 WeakPolarHBondContact O-CD2 3.25Å; D172-F176 PolarHBondContact O-N 3.01Å; D172-V194 HydrophobicContact CB-CG1 4.14Å; D172-V194 HydrophobicContact CB-CG2 3.7Å; D172-V194 VanDerWaalsContact CG-CG1 3.43Å; D172-V194 VanDerWaalsContact OD1-CG1 3.28Å; D172-V194 WeakPolarHBondContact OD1-CG1 3.32Å; D172-K198 WeakPolarHBondContact OD1-CE 3.46Å; D172-K198 IonicContact OD1-NZ 2.76Å; D172-K198 PolarHBondContact OD1-NZ 3.46Å; D172-K198 IonicContact OD2-NZ 3.64Å
173	L	81.6	Confident	77.8	Confident	32 Å²	32	70.6 Å²	70.6	17%	0.168	39%	0.388	C	S	.	.	H	α-helix	trans	-59.3	-39.1	174.2	-66.7	173.9	0	0	0	112.2	L168 E169 Q170 Q175 F176 A177 P183	L168-L173 HydrophobicContact CB-CD2 4.29Å; L168-L173 HydrophobicContact CB-CG 4.32Å; L168-L173 HydrophobicContact CD1-CD2 3.91Å; E169-L173 PolarHBondContact O-N 2.95Å; E169-L173 VanDerWaalsContact O-N 3.11Å; Q170-L173 PolarHBondContact O-N 2.85Å; L173-Q175 VanDerWaalsContact C-N 3.33Å; L173-Q175 PolarHBondContact O-N 3.2Å; L173-F176 WeakPolarHBondContact O-CB 3.35Å; L173-F176 PolarHBondContact O-N 3.12Å; L173-A177 WeakPolarHBondContact O-CB 3.38Å; L173-A177 PolarHBondContact O-N 3.44Å; L173-P183 HydrophobicContact CD2-CG 3.83Å
174	E	81.1	Confident	79	Confident	118 Å²	118	67 Å²	67	55%	0.551	38%	0.378	S	S	*	.	H	α-helix	trans	-62.8	-38.6	172.7	-74.5	170.8	-170.3	0	0	111.9	Q170 D172 A177 S178	Q170-E174 WeakPolarHBondContact O-CG 3.37Å; Q170-E174 PolarHBondContact O-N 3.49Å; D172-E174 VanDerWaalsContact C-N 3.29Å; D172-E174 PolarHBondContact O-N 3.25Å; E174-A177 PolarHBondContact O-N 2.72Å; E174-S178 WeakPolarHBondContact O-CB 3.18Å; E174-S178 PolarHBondContact O-N 3.04Å
175	Q	79.5	Confident	79.8	Confident	36 Å²	36	61.6 Å²	61.6	17%	0.168	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-42	173.9	-73.8	174.1	48.4	0	0	111.8	S171 D172 L173 S178 I179 L197	S171-Q175 WeakPolarHBondContact O-CG 3.35Å; S171-Q175 PolarHBondContact O-N 2.99Å; D172-Q175 WeakPolarHBondContact O-CA 3.45Å; D172-Q175 WeakPolarHBondContact O-CB 3.29Å; D172-Q175 PolarHBondContact O-N 2.92Å; L173-Q175 VanDerWaalsContact C-N 3.33Å; L173-Q175 PolarHBondContact O-N 3.2Å; Q175-S178 PolarHBondContact O-N 2.82Å; Q175-S178 PolarHBondContact O-OG 2.94Å; Q175-I179 PolarHBondContact O-N 3.42Å; Q175-L197 HydrophobicContact CB-CB 4.47Å; Q175-L197 HydrophobicContact CB-CD1 4.21Å
176	F	80.3	Confident	80.4	Confident	1 Å²	1	63.2 Å²	63.2	0%	0.004	37%	0.368	C	S	.	.	H	α-helix	trans	-57.6	-48.4	171.8	-85.1	-84.7	0	0	0	111.1	L168 D172 L173 S178 I179 G180 V181 P183 D190 M193 V194	L168-F176 HydrophobicContact CD1-CD2 4.36Å; L168-F176 HydrophobicContact CD1-CE2 3.79Å; L168-F176 HydrophobicContact CD1-CZ 4.39Å; L168-F176 HydrophobicContact CD2-CE2 4.1Å; D172-F176 WeakPolarHBondContact O-CD2 3.25Å; D172-F176 PolarHBondContact O-N 3.01Å; L173-F176 WeakPolarHBondContact O-CB 3.35Å; L173-F176 PolarHBondContact O-N 3.12Å; F176-S178 VanDerWaalsContact C-N 3.33Å; F176-S178 PolarHBondContact O-N 3.23Å; F176-I179 WeakPolarHBondContact O-CG1 3.45Å; F176-I179 PolarHBondContact O-N 3.47Å; F176-G180 PolarHBondContact O-N 2.88Å; F176-V181 CarbonylContact C-O 3.58Å; F176-V181 WeakPolarHBondContact CB-O 3.37Å; F176-V181 HydrophobicContact CD1-CB 4.49Å; F176-V181 HydrophobicContact CD1-CG1 4.22Å; F176-V181 PolarHBondContact O-N 2.97Å; F176-P183 HydrophobicContact CD1-CB 4.38Å; F176-P183 HydrophobicContact CE1-CB 4.09Å; F176-P183 HydrophobicContact CE2-CB 4.36Å; F176-P183 HydrophobicContact CZ-CB 4.14Å; F176-D190 HydrophobicContact CZ-CB 4.17Å; F176-M193 HydrophobicContact CD1-CE 3.36Å; F176-M193 HydrophobicContact CE1-CB 4.08Å; F176-M193 HydrophobicContact CE1-CE 3.08Å; F176-M193 HydrophobicContact CE1-CG 4.45Å; F176-M193 HydrophobicContact CG-CE 4.44Å; F176-M193 HydrophobicContact CZ-CB 3.87Å; F176-M193 HydrophobicContact CZ-CE 3.98Å; F176-V194 HydrophobicContact CD2-CG2 4.32Å; F176-V194 HydrophobicContact CE2-CG2 3.43Å; F176-V194 VanDerWaalsContact CE2-CG2 3.43Å; F176-V194 HydrophobicContact CZ-CG2 4.1Å
177	A	78.6	Confident	80.5	Confident	66 Å²	66	63.4 Å²	63.4	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-39.1	178.2	0	0	0	0	0	112.2	L173 E174 I179 G180	L173-A177 WeakPolarHBondContact O-CB 3.38Å; L173-A177 PolarHBondContact O-N 3.44Å; E174-A177 PolarHBondContact O-N 2.72Å; A177-I179 PolarHBondContact O-N 3.49Å; A177-G180 PolarHBondContact O-N 3.45Å
178	S	76.5	Confident	80.3	Confident	82 Å²	82	67.9 Å²	67.9	57%	0.573	38%	0.379	S	S	*	.	H	α-helix	trans	-60.5	-28.4	-179.1	78.7	0	0	0	0	113.3	E174 Q175 F176	E174-S178 WeakPolarHBondContact O-CB 3.18Å; E174-S178 PolarHBondContact O-N 3.04Å; Q175-S178 PolarHBondContact O-N 2.82Å; Q175-S178 PolarHBondContact O-OG 2.94Å; F176-S178 VanDerWaalsContact C-N 3.33Å; F176-S178 PolarHBondContact O-N 3.23Å
179	I	76.7	Confident	80.1	Confident	52 Å²	52	70.1 Å²	70.1	27%	0.267	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	1.3	176.5	63.6	167.1	0	0	0	113.1	Q175 F176 A177 V181 M193 L197	Q175-I179 PolarHBondContact O-N 3.42Å; F176-I179 WeakPolarHBondContact O-CG1 3.45Å; F176-I179 PolarHBondContact O-N 3.47Å; A177-I179 PolarHBondContact O-N 3.49Å; I179-V181 HydrophobicContact CD1-CB 3.77Å; I179-V181 HydrophobicContact CD1-CG2 3.6Å; I179-V181 HydrophobicContact CG1-CB 3.87Å; I179-V181 HydrophobicContact CG1-CG2 3.78Å; I179-M193 HydrophobicContact CD1-CE 3.88Å; I179-M193 HydrophobicContact CD1-SD 4.45Å; I179-L197 HydrophobicContact CD1-CD1 3.66Å; I179-L197 HydrophobicContact CD1-CD2 3.66Å; I179-L197 HydrophobicContact CD1-CG 4.27Å; I179-L197 HydrophobicContact CG1-CD1 4.47Å; I179-L197 HydrophobicContact CG2-CD2 4.12Å
180	G	75.4	Confident	80.1	Confident	50 Å²	50	63.5 Å²	63.5	52%	0.515	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	36.9	-177.4	0	0	0	0	0	113.5	F176 A177	F176-G180 PolarHBondContact O-N 2.88Å; A177-G180 PolarHBondContact O-N 3.45Å
181	V	74.6	Confident	80.2	Confident	41 Å²	41	61.2 Å²	61.2	25%	0.248	35%	0.353	C	S	.	.			trans	-119.6	139.4	176.6	179.8	0	0	0	0	108.7	F176 I179 M193	F176-V181 CarbonylContact C-O 3.58Å; F176-V181 WeakPolarHBondContact CB-O 3.37Å; F176-V181 HydrophobicContact CD1-CB 4.49Å; F176-V181 HydrophobicContact CD1-CG1 4.22Å; F176-V181 PolarHBondContact O-N 2.97Å; I179-V181 HydrophobicContact CD1-CB 3.77Å; I179-V181 HydrophobicContact CD1-CG2 3.6Å; I179-V181 HydrophobicContact CG1-CB 3.87Å; I179-V181 HydrophobicContact CG1-CG2 3.78Å; V181-M193 HydrophobicContact CB-CE 4.2Å; V181-M193 HydrophobicContact CG1-CE 3.67Å
182	K	81	Confident	80.2	Confident	108 Å²	108	62.6 Å²	62.6	47%	0.47	36%	0.359	S	S	.	.			trans	-93.3	146.3	169.4	-67.9	-171.2	-177.1	-174.9	0	109.9	Y158	Y158-K182 HydrophobicContact CE1-CD 4.39Å; Y158-K182 WeakPolarHBondContact OH-CE 3.42Å
183	P	81.3	Confident	80.2	Confident	21 Å²	21	63.4 Å²	63.4	14%	0.136	36%	0.363	C	S	.	.			trans	-56.4	144.8	169.4	24.3	-33.4	0	0	0	110.8	I165 L168 L173 F176 G185	I165-P183 HydrophobicContact CD1-CB 3.56Å; I165-P183 HydrophobicContact CD1-CG 3.31Å; L168-P183 HydrophobicContact CD1-CB 3.6Å; L168-P183 HydrophobicContact CD1-CG 4.15Å; L173-P183 HydrophobicContact CD2-CG 3.83Å; F176-P183 HydrophobicContact CD1-CB 4.38Å; F176-P183 HydrophobicContact CE1-CB 4.09Å; F176-P183 HydrophobicContact CE2-CB 4.36Å; F176-P183 HydrophobicContact CZ-CB 4.14Å; P183-G185 VanDerWaalsContact C-N 3.32Å
184	T	81.9	Confident	80.3	Confident	99 Å²	99	62.1 Å²	62.1	61%	0.607	36%	0.356	S	S	*	.			trans	-76.9	-21.7	-173.4	-42.5	0	0	0	0	111.8	D186 D190	T184-D186 VanDerWaalsContact C-N 3.25Å; T184-D190 WeakPolarHBondContact CB-OD1 3.19Å; T184-D190 PolarHBondContact N-OD1 3.31Å; T184-D190 PolarHBondContact OG1-OD1 3.04Å
185	G	80.3	Confident	80.4	Confident	44 Å²	44	62.8 Å²	62.8	45%	0.454	36%	0.36	S	S	.	.	S	Bend	trans	84.1	-4.1	-171.3	0	0	0	0	0	113.4	W167 P183 D190	W167-G185 WeakPolarHBondContact CZ2-O 3.49Å; P183-G185 VanDerWaalsContact C-N 3.32Å; G185-D190 PolarHBondContact N-OD2 3.01Å
186	D	80.2	Confident	80.4	Confident	60 Å²	60	64 Å²	64	32%	0.321	37%	0.369	S	S	.	.			trans	-92.7	110.1	169.5	-176.2	-31.8	0	0	0	109	T184 K188 V189 D190	T184-D186 VanDerWaalsContact C-N 3.25Å; D186-K188 PolarHBondContact O-N 3.14Å; D186-K188 PolarHBondContact OD1-N 3.13Å; D186-V189 HydrophobicContact CB-CB 4.13Å; D186-V189 HydrophobicContact CB-CG2 3.96Å; D186-V189 PolarHBondContact O-N 3.44Å; D186-D190 PolarHBondContact O-N 2.65Å
187	K	82.8	Confident	80.4	Confident	115 Å²	115	64.3 Å²	64.3	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-47.1	-39.1	-179.1	-179.4	169.4	-177.7	174	0	114.1	W167 L191	W167-K187 HydrophobicContact CB-CD 4.13Å; W167-K187 HydrophobicContact CB-CG 4.18Å; W167-K187 HydrophobicContact CD2-CB 3.7Å; W167-K187 HydrophobicContact CD2-CD 3.94Å; W167-K187 HydrophobicContact CD2-CG 3.69Å; W167-K187 VanDerWaalsContact CE2-CA 3.43Å; W167-K187 HydrophobicContact CE3-CB 4.05Å; W167-K187 HydrophobicContact CE3-CD 3.96Å; W167-K187 HydrophobicContact CE3-CG 4.16Å; W167-K187 HydrophobicContact CG-CB 4.17Å; W167-K187 HydrophobicContact CG-CD 4.02Å; W167-K187 HydrophobicContact CG-CG 3.67Å; W167-K187 HydrophobicContact CH2-CB 4.22Å; W167-K187 HydrophobicContact CZ2-CB 3.87Å; W167-K187 HydrophobicContact CZ3-CB 4.31Å; K187-L191 HydrophobicContact CG-CD1 3.86Å; K187-L191 WeakPolarHBondContact O-CB 3.02Å; K187-L191 WeakPolarHBondContact O-CD1 3.43Å; K187-L191 WeakPolarHBondContact O-CG 3.39Å; K187-L191 PolarHBondContact O-N 3.48Å
188	K	78.9	Confident	80.5	Confident	168 Å²	168	65.4 Å²	65.4	73%	0.73	36%	0.364	S	S	*	.	H	α-helix	trans	-73.2	-43.4	-178.5	-71.3	-176.3	178.7	179.4	0	111.6	D186 V192	D186-K188 PolarHBondContact O-N 3.14Å; D186-K188 PolarHBondContact OD1-N 3.13Å; K188-V192 VanDerWaalsContact O-CG2 3.25Å; K188-V192 WeakPolarHBondContact O-CG2 3.44Å; K188-V192 PolarHBondContact O-N 3Å
189	V	77.8	Confident	80.6	Confident	62 Å²	62	66 Å²	66	38%	0.376	36%	0.363	S	S	.	.	H	α-helix	trans	-66.3	-46.3	-179	178.5	0	0	0	0	109.8	D186 L191 V192 M193	D186-V189 HydrophobicContact CB-CB 4.13Å; D186-V189 HydrophobicContact CB-CG2 3.96Å; D186-V189 PolarHBondContact O-N 3.44Å; V189-L191 PolarHBondContact O-N 3.28Å; V189-V192 PolarHBondContact O-N 2.99Å; V189-M193 WeakPolarHBondContact O-CB 3.13Å; V189-M193 PolarHBondContact O-N 3.21Å
190	D	84.1	Confident	80.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-63.9	-44.4	-176.7	-65.7	-19.9	0	0	0	111.4	L168 F176 T184 G185 D186 V192 M193 V194	L168-D190 HydrophobicContact CD1-CB 4.13Å; L168-D190 HydrophobicContact CD2-CB 4.21Å; L168-D190 HydrophobicContact CG-CB 4.48Å; F176-D190 HydrophobicContact CZ-CB 4.17Å; T184-D190 WeakPolarHBondContact CB-OD1 3.19Å; T184-D190 PolarHBondContact N-OD1 3.31Å; T184-D190 PolarHBondContact OG1-OD1 3.04Å; G185-D190 PolarHBondContact N-OD2 3.01Å; D186-D190 PolarHBondContact O-N 2.65Å; D190-V192 PolarHBondContact O-N 2.74Å; D190-M193 WeakPolarHBondContact O-CB 3.23Å; D190-M193 PolarHBondContact O-N 2.99Å; D190-V194 VanDerWaalsContact O-CG2 3.32Å; D190-V194 WeakPolarHBondContact O-CG2 3.46Å; D190-V194 PolarHBondContact O-N 2.84Å
191	L	84.6	Confident	80	Confident	67 Å²	67	70.6 Å²	70.6	35%	0.351	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-38.3	176.7	-72.2	172.5	0	0	0	113	K187 V189 V194 Q195	K187-L191 HydrophobicContact CG-CD1 3.86Å; K187-L191 WeakPolarHBondContact O-CB 3.02Å; K187-L191 WeakPolarHBondContact O-CD1 3.43Å; K187-L191 WeakPolarHBondContact O-CG 3.39Å; K187-L191 PolarHBondContact O-N 3.48Å; V189-L191 PolarHBondContact O-N 3.28Å; L191-V194 PolarHBondContact O-N 3.36Å; L191-Q195 WeakPolarHBondContact O-CG 3.38Å; L191-Q195 PolarHBondContact O-N 3.3Å
192	V	84	Confident	79.6	Confident	85 Å²	85	75 Å²	75	52%	0.515	40%	0.399	S	S	.	.	H	α-helix	trans	-66.5	-41	175.3	170.7	0	0	0	0	110.8	K188 V189 D190 Q195 T196	K188-V192 VanDerWaalsContact O-CG2 3.25Å; K188-V192 WeakPolarHBondContact O-CG2 3.44Å; K188-V192 PolarHBondContact O-N 3Å; V189-V192 PolarHBondContact O-N 2.99Å; D190-V192 PolarHBondContact O-N 2.74Å; V192-Q195 PolarHBondContact O-N 2.95Å; V192-T196 WeakPolarHBondContact O-CB 3.27Å; V192-T196 PolarHBondContact O-N 3.34Å; V192-T196 PolarHBondContact O-OG1 3.17Å
193	M	83.5	Confident	78.2	Confident	25 Å²	25	73.5 Å²	73.5	12%	0.123	40%	0.4	C	S	.	.	H	α-helix	trans	-60.4	-49.3	174.3	-111.1	-88.4	-74.5	0	0	110.9	F88 F176 I179 V181 V189 D190 Q195 T196 L197	F88-M193 HydrophobicContact CE2-SD 3.74Å; F88-M193 HydrophobicContact CZ-CE 4.25Å; F88-M193 HydrophobicContact CZ-SD 3.59Å; F88-M193 VanDerWaalsContact CZ-SD 3.59Å; F176-M193 HydrophobicContact CD1-CE 3.36Å; F176-M193 HydrophobicContact CE1-CB 4.08Å; F176-M193 HydrophobicContact CE1-CE 3.08Å; F176-M193 HydrophobicContact CE1-CG 4.45Å; F176-M193 HydrophobicContact CG-CE 4.44Å; F176-M193 HydrophobicContact CZ-CB 3.87Å; F176-M193 HydrophobicContact CZ-CE 3.98Å; I179-M193 HydrophobicContact CD1-CE 3.88Å; I179-M193 HydrophobicContact CD1-SD 4.45Å; V181-M193 HydrophobicContact CB-CE 4.2Å; V181-M193 HydrophobicContact CG1-CE 3.67Å; V189-M193 WeakPolarHBondContact O-CB 3.13Å; V189-M193 PolarHBondContact O-N 3.21Å; D190-M193 WeakPolarHBondContact O-CB 3.23Å; D190-M193 PolarHBondContact O-N 2.99Å; M193-Q195 PolarHBondContact O-N 2.86Å; M193-T196 CarbonylContact O-C 3.56Å; M193-T196 WeakPolarHBondContact O-CA 3.4Å; M193-T196 WeakPolarHBondContact O-CB 3.35Å; M193-T196 PolarHBondContact O-N 3.42Å; M193-T196 VanDerWaalsContact O-N 3.11Å; M193-L197 HydrophobicContact CE-CD1 4.1Å; M193-L197 VanDerWaalsContact O-CG 3.3Å; M193-L197 WeakPolarHBondContact O-CG 3.46Å; M193-L197 PolarHBondContact O-N 3.49Å; M193-L197 HydrophobicContact SD-CD1 4.3Å; M193-L197 HydrophobicContact SD-CG 4.42Å
194	V	83.8	Confident	76.6	Confident	4 Å²	4	84.2 Å²	84.2	2%	0.024	46%	0.455	C	S	.	.	H	α-helix	trans	-56.1	-48.3	175.2	169.6	0	0	0	0	111.8	L168 D172 F176 D190 L191 T196 L197 K198	L168-V194 HydrophobicContact CD2-CG2 3.49Å; L168-V194 VanDerWaalsContact CD2-CG2 3.49Å; D172-V194 HydrophobicContact CB-CG1 4.14Å; D172-V194 HydrophobicContact CB-CG2 3.7Å; D172-V194 VanDerWaalsContact CG-CG1 3.43Å; D172-V194 VanDerWaalsContact OD1-CG1 3.28Å; D172-V194 WeakPolarHBondContact OD1-CG1 3.32Å; F176-V194 HydrophobicContact CD2-CG2 4.32Å; F176-V194 HydrophobicContact CE2-CG2 3.43Å; F176-V194 VanDerWaalsContact CE2-CG2 3.43Å; F176-V194 HydrophobicContact CZ-CG2 4.1Å; D190-V194 VanDerWaalsContact O-CG2 3.32Å; D190-V194 WeakPolarHBondContact O-CG2 3.46Å; D190-V194 PolarHBondContact O-N 2.84Å; L191-V194 PolarHBondContact O-N 3.36Å; V194-T196 VanDerWaalsContact C-N 3.27Å; V194-T196 PolarHBondContact O-N 3.2Å; V194-L197 PolarHBondContact O-N 3.03Å; V194-K198 HydrophobicContact CG1-CD 3.83Å; V194-K198 VanDerWaalsContact CG1-CE 3.47Å; V194-K198 HydrophobicContact CG1-CG 4.31Å; V194-K198 WeakPolarHBondContact O-CB 3.49Å; V194-K198 WeakPolarHBondContact O-CG 3.3Å; V194-K198 PolarHBondContact O-N 3.24Å
195	Q	82.4	Confident	76.3	Confident	133 Å²	133	83.5 Å²	83.5	62%	0.621	45%	0.447	S	S	*	.	H	α-helix	trans	-59.5	-42.3	177.6	-77.6	-177.9	-31.9	0	0	111.3	L191 V192 M193 K198 V199	L191-Q195 WeakPolarHBondContact O-CG 3.38Å; L191-Q195 PolarHBondContact O-N 3.3Å; V192-Q195 PolarHBondContact O-N 2.95Å; M193-Q195 PolarHBondContact O-N 2.86Å; Q195-K198 PolarHBondContact O-N 3.07Å; Q195-V199 WeakPolarHBondContact O-CG2 3.3Å; Q195-V199 PolarHBondContact O-N 3.12Å
196	T	80.3	Confident	76.1	Confident	61 Å²	61	85.6 Å²	85.6	37%	0.374	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-45.1	176.6	-53	0	0	0	0	111	V192 M193 V194 V199 L200	V192-T196 WeakPolarHBondContact O-CB 3.27Å; V192-T196 PolarHBondContact O-N 3.34Å; V192-T196 PolarHBondContact O-OG1 3.17Å; M193-T196 CarbonylContact O-C 3.56Å; M193-T196 WeakPolarHBondContact O-CA 3.4Å; M193-T196 WeakPolarHBondContact O-CB 3.35Å; M193-T196 PolarHBondContact O-N 3.42Å; M193-T196 VanDerWaalsContact O-N 3.11Å; V194-T196 VanDerWaalsContact C-N 3.27Å; V194-T196 PolarHBondContact O-N 3.2Å; T196-V199 PolarHBondContact O-N 3.11Å; T196-L200 HydrophobicContact CG2-CD1 4.03Å; T196-L200 HydrophobicContact CG2-CG 4.49Å; T196-L200 WeakPolarHBondContact O-CB 3.49Å; T196-L200 VanDerWaalsContact O-CG 3.26Å; T196-L200 WeakPolarHBondContact O-CG 3.33Å; T196-L200 PolarHBondContact O-N 3.17Å
197	L	79.5	Confident	75.8	Confident	8 Å²	8	87 Å²	87	4%	0.042	45%	0.453	C	S	.	.	H	α-helix	trans	-66.9	-37.7	178.8	-66	175.7	0	0	0	112.6	Q175 I179 M193 V194 V199 L200 N201	Q175-L197 HydrophobicContact CB-CB 4.47Å; Q175-L197 HydrophobicContact CB-CD1 4.21Å; I179-L197 HydrophobicContact CD1-CD1 3.66Å; I179-L197 HydrophobicContact CD1-CD2 3.66Å; I179-L197 HydrophobicContact CD1-CG 4.27Å; I179-L197 HydrophobicContact CG1-CD1 4.47Å; I179-L197 HydrophobicContact CG2-CD2 4.12Å; M193-L197 HydrophobicContact CE-CD1 4.1Å; M193-L197 VanDerWaalsContact O-CG 3.3Å; M193-L197 WeakPolarHBondContact O-CG 3.46Å; M193-L197 PolarHBondContact O-N 3.49Å; M193-L197 HydrophobicContact SD-CD1 4.3Å; M193-L197 HydrophobicContact SD-CG 4.42Å; V194-L197 PolarHBondContact O-N 3.03Å; L197-V199 PolarHBondContact O-N 2.87Å; L197-L200 HydrophobicContact CD2-CD1 4.47Å; L197-L200 PolarHBondContact O-N 3.39Å; L197-N201 WeakPolarHBondContact O-CB 3.46Å; L197-N201 PolarHBondContact O-N 3.31Å
198	K	81.2	Confident	75.4	Confident	89 Å²	89	85.4 Å²	85.4	39%	0.387	45%	0.451	S	S	.	.	H	α-helix	trans	-60.1	-45.1	173.2	-76.7	176.3	178.9	164.8	0	111.3	D172 V194 Q195 L200 N202	D172-K198 WeakPolarHBondContact OD1-CE 3.46Å; D172-K198 IonicContact OD1-NZ 2.76Å; D172-K198 PolarHBondContact OD1-NZ 3.46Å; D172-K198 IonicContact OD2-NZ 3.64Å; V194-K198 HydrophobicContact CG1-CD 3.83Å; V194-K198 VanDerWaalsContact CG1-CE 3.47Å; V194-K198 HydrophobicContact CG1-CG 4.31Å; V194-K198 WeakPolarHBondContact O-CB 3.49Å; V194-K198 WeakPolarHBondContact O-CG 3.3Å; V194-K198 PolarHBondContact O-N 3.24Å; Q195-K198 PolarHBondContact O-N 3.07Å; K198-L200 VanDerWaalsContact C-N 3.34Å; K198-N202 PolarHBondContact O-N 3.24Å
199	V	78.1	Confident	75.2	Confident	93 Å²	93	80.2 Å²	80.2	56%	0.564	43%	0.433	S	S	*	.	H	α-helix	trans	-67.1	-34.8	177	173.2	0	0	0	0	112.2	Q195 T196 L197 N202	Q195-V199 WeakPolarHBondContact O-CG2 3.3Å; Q195-V199 PolarHBondContact O-N 3.12Å; T196-V199 PolarHBondContact O-N 3.11Å; L197-V199 PolarHBondContact O-N 2.87Å; V199-N202 CarbonylContact O-C 3.57Å
200	L	70.2	Confident	75	Confident	111 Å²	111	81.4 Å²	81.4	58%	0.581	44%	0.437	S	S	*	.	H	α-helix	trans	-73.5	-41.9	178.9	-72.2	172.3	0	0	0	112.5	T196 L197 K198	T196-L200 HydrophobicContact CG2-CD1 4.03Å; T196-L200 HydrophobicContact CG2-CG 4.49Å; T196-L200 WeakPolarHBondContact O-CB 3.49Å; T196-L200 VanDerWaalsContact O-CG 3.26Å; T196-L200 WeakPolarHBondContact O-CG 3.33Å; T196-L200 PolarHBondContact O-N 3.17Å; L197-L200 HydrophobicContact CD2-CD1 4.47Å; L197-L200 PolarHBondContact O-N 3.39Å; K198-L200 VanDerWaalsContact C-N 3.34Å
201	N	69.8	Low	74.4	Confident	89 Å²	89	87.2 Å²	87.2	48%	0.476	47%	0.468	S	S	.	.	H	α-helix	trans	-85.3	-27.1	-176.2	-69.7	-15.5	0	0	0	113.2	L197	L197-N201 WeakPolarHBondContact O-CB 3.46Å; L197-N201 PolarHBondContact O-N 3.31Å
202	N	65.9	Low	73.6	Confident	134 Å²	134	88.8 Å²	88.8	72%	0.717	48%	0.477	S	S	*	.	S	Bend	trans	-125.3	85.5	171.3	-98.6	-17	0	0	0	108.9	K198 V199 L204	K198-N202 PolarHBondContact O-N 3.24Å; V199-N202 CarbonylContact O-C 3.57Å; N202-L204 PolarHBondContact O-N 3.13Å
203	P	51.9	Low	72.7	Confident	76 Å²	76	89.1 Å²	89.1	49%	0.494	47%	0.474	S	S	.	.			trans	-66.7	121.2	167	28.5	-30.4	0	0	0	108.4
204	L	46.5	Very low	71.8	Confident	246 Å²	246	94.9 Å²	94.9	100%	1.288	51%	0.506	S	S	*	.			trans	-50.1	0	162.4	-73.3	164.2	0	0	0	111.2	N202	N202-L204 PolarHBondContact O-N 3.13Å

Retrieved 204 of 204 residues in 142.2 ms (Link to these results)

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