A0A096MNF7_PAPAN Loading...

Junctional adhesion molecule B

AlphaFold DB (P57087), UniProt , Accession A0A096MNF7, Species PAPAN (Papio anubis, Olive baboon), Gene JAM2, Length 298 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	54.3	Low	68.5	Low	230 Å²	230	148.8 Å²	148.8	100%	1.133	69%	0.693	S	S	*	*				0	-19	0	-71.5	175	-171.8	0	0	115	R3	M1-R3 PolarHBondContact O-N 3.12Å
2	A	58.3	Low	69.4	Low	80 Å²	80	144 Å²	144	66%	0.661	68%	0.675	S	S	*	*	H	α-helix	trans	-65	-31.2	-175.4	0	0	0	0	0	116.3	R4 S5	A2-R4 VanDerWaalsContact C-N 3.33Å; A2-R4 PolarHBondContact O-N 2.71Å; A2-S5 PolarHBondContact O-N 3.48Å
3	R	58.5	Low	70.2	Confident	225 Å²	225	140.8 Å²	140.8	85%	0.849	67%	0.665	S	S	*	*	H	α-helix	trans	-68.3	-28.6	-176.8	-158.3	172.2	-174.4	176.4	1.4	113.7	M1	M1-R3 PolarHBondContact O-N 3.12Å
4	R	62.5	Low	70.4	Confident	197 Å²	197	137.9 Å²	137.9	74%	0.743	65%	0.654	S	S	*	*	H	α-helix	trans	-76.5	-26.4	179.5	-154.2	173.9	-170.1	180	2.3	112.5	A2 R8	A2-R4 VanDerWaalsContact C-N 3.33Å; A2-R4 PolarHBondContact O-N 2.71Å; R4-R8 PolarHBondContact O-N 2.92Å
5	S	67.4	Low	70.3	Confident	79 Å²	79	141.1 Å²	141.1	55%	0.552	66%	0.658	S	S	*	*	H	α-helix	trans	-74.1	-43.9	178.8	-175.2	0	0	0	0	112	A2 H7 R8 L9	A2-S5 PolarHBondContact O-N 3.48Å; S5-H7 VanDerWaalsContact C-N 3.32Å; S5-H7 PolarHBondContact O-N 3.34Å; S5-R8 PolarHBondContact O-N 3.03Å; S5-R8 VanDerWaalsContact O-N 3.13Å; S5-L9 PolarHBondContact O-N 3.06Å; S5-L9 VanDerWaalsContact O-N 3.09Å
6	R	70.6	Confident	70.2	Confident	212 Å²	212	143 Å²	143	80%	0.8	66%	0.659	S	S	*	*	H	α-helix	trans	-60	-39.3	177.6	-74.3	-173.1	172.2	-173.5	-2.1	112.9	L9 L10	R6-L9 PolarHBondContact O-N 3.26Å; R6-L10 PolarHBondContact O-N 2.99Å; R6-L10 VanDerWaalsContact O-N 3.09Å
7	H	72.3	Confident	70	Confident	123 Å²	123	140.6 Å²	140.6	57%	0.569	65%	0.651	S	S	*	*	H	α-helix	trans	-64.5	-39.2	175.9	-106.9	-69	0	0	0	112.8	S5 L11	S5-H7 VanDerWaalsContact C-N 3.32Å; S5-H7 PolarHBondContact O-N 3.34Å; H7-L11 WeakPolarHBondContact O-CB 3.47Å; H7-L11 WeakPolarHBondContact O-CD1 3.49Å; H7-L11 WeakPolarHBondContact O-CG 3.45Å; H7-L11 PolarHBondContact O-N 3.21Å; H7-L11 VanDerWaalsContact O-N 3.09Å
8	R	74.5	Confident	69.7	Low	172 Å²	172	138.5 Å²	138.5	65%	0.649	65%	0.65	S	S	*	*	H	α-helix	trans	-65.2	-41.6	177.1	-76.2	-175.8	174.4	-168.7	-2.1	111.8	R4 S5 L11 L12	R4-R8 PolarHBondContact O-N 2.92Å; S5-R8 PolarHBondContact O-N 3.03Å; S5-R8 VanDerWaalsContact O-N 3.13Å; R8-L11 PolarHBondContact O-N 3.09Å; R8-L12 WeakPolarHBondContact O-CG 3.44Å; R8-L12 PolarHBondContact O-N 3.29Å
9	L	79.2	Confident	69.4	Low	112 Å²	112	135.5 Å²	135.5	59%	0.586	64%	0.641	S	S	*	*	H	α-helix	trans	-66.1	-42.3	178.9	-159.9	77	0	0	0	111.9	S5 R6 L11 L12 L13	S5-L9 PolarHBondContact O-N 3.06Å; S5-L9 VanDerWaalsContact O-N 3.09Å; R6-L9 PolarHBondContact O-N 3.26Å; L9-L11 PolarHBondContact O-N 3.26Å; L9-L12 PolarHBondContact O-N 2.86Å; L9-L13 WeakPolarHBondContact O-CG 3.46Å; L9-L13 PolarHBondContact O-N 2.98Å
10	L	78.9	Confident	68.9	Low	105 Å²	105	131.8 Å²	131.8	55%	0.55	64%	0.635	S	S	.	*	H	α-helix	trans	-64.1	-41.1	177.7	-158.1	83.3	0	0	0	112	R6 L12 L13 L14	R6-L10 PolarHBondContact O-N 2.99Å; R6-L10 VanDerWaalsContact O-N 3.09Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L13 PolarHBondContact O-N 3.48Å; L10-L14 HydrophobicContact CG-CD1 4.41Å; L10-L14 WeakPolarHBondContact O-CB 3.4Å; L10-L14 PolarHBondContact O-N 3.18Å
11	L	76.7	Confident	68.2	Low	102 Å²	102	131.6 Å²	131.6	53%	0.534	64%	0.637	S	S	.	*	H	α-helix	trans	-64.5	-37	176	-81.3	158.9	0	0	0	112.4	H7 R8 L9 R15	H7-L11 WeakPolarHBondContact O-CB 3.47Å; H7-L11 WeakPolarHBondContact O-CD1 3.49Å; H7-L11 WeakPolarHBondContact O-CG 3.45Å; H7-L11 PolarHBondContact O-N 3.21Å; H7-L11 VanDerWaalsContact O-N 3.09Å; R8-L11 PolarHBondContact O-N 3.09Å; L9-L11 PolarHBondContact O-N 3.26Å; L11-R15 WeakPolarHBondContact O-CG 3.42Å; L11-R15 PolarHBondContact O-N 3.36Å
12	L	79.3	Confident	68	Low	91 Å²	91	123.1 Å²	123.1	48%	0.476	61%	0.608	S	S	.	*	H	α-helix	trans	-65.8	-47.6	174.8	-74.5	164.2	0	0	0	110.8	R8 L9 L10 L14 R15 Y16	R8-L12 WeakPolarHBondContact O-CG 3.44Å; R8-L12 PolarHBondContact O-N 3.29Å; L9-L12 PolarHBondContact O-N 2.86Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L12-L14 VanDerWaalsContact C-N 3.35Å; L12-L14 PolarHBondContact O-N 2.82Å; L12-R15 PolarHBondContact O-N 3.33Å; L12-R15 VanDerWaalsContact O-N 3.17Å; L12-Y16 VanDerWaalsContact O-CD2 3.22Å; L12-Y16 WeakPolarHBondContact O-CD2 3.46Å; L12-Y16 PolarHBondContact O-N 2.87Å
13	L	79.4	Confident	67.5	Low	103 Å²	103	128.5 Å²	128.5	54%	0.539	61%	0.613	S	S	.	*	H	α-helix	trans	-61.2	-41.7	178.2	-71	168.1	0	0	0	112.2	L9 L10 Y16 L17	L9-L13 WeakPolarHBondContact O-CG 3.46Å; L9-L13 PolarHBondContact O-N 2.98Å; L10-L13 PolarHBondContact O-N 3.48Å; L13-Y16 PolarHBondContact O-N 3.4Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 PolarHBondContact O-N 3.48Å
14	L	74.2	Confident	66.6	Low	99 Å²	99	126 Å²	126	52%	0.518	61%	0.611	S	S	.	*	H	α-helix	trans	-62.5	-40.9	174.2	-90.6	154	0	0	0	112.4	L10 L12 L17 V18	L10-L14 HydrophobicContact CG-CD1 4.41Å; L10-L14 WeakPolarHBondContact O-CB 3.4Å; L10-L14 PolarHBondContact O-N 3.18Å; L12-L14 VanDerWaalsContact C-N 3.35Å; L12-L14 PolarHBondContact O-N 2.82Å; L14-L17 PolarHBondContact O-N 3.11Å; L14-V18 WeakPolarHBondContact O-CG2 3.28Å; L14-V18 PolarHBondContact O-N 2.91Å
15	R	68.3	Low	65.5	Low	186 Å²	186	124.4 Å²	124.4	70%	0.702	61%	0.609	S	S	*	*	H	α-helix	trans	-62.8	-43.9	173.9	-76.9	-178.4	177.7	-161.1	-1.1	111.7	L11 L12 L17 V18 V19	L11-R15 WeakPolarHBondContact O-CG 3.42Å; L11-R15 PolarHBondContact O-N 3.36Å; L12-R15 PolarHBondContact O-N 3.33Å; L12-R15 VanDerWaalsContact O-N 3.17Å; R15-L17 VanDerWaalsContact C-N 3.31Å; R15-L17 PolarHBondContact O-N 2.93Å; R15-V18 PolarHBondContact O-N 3.44Å; R15-V19 WeakPolarHBondContact O-CB 3.28Å; R15-V19 VanDerWaalsContact O-CG2 3.22Å; R15-V19 WeakPolarHBondContact O-CG2 3.45Å; R15-V19 PolarHBondContact O-N 3.13Å
16	Y	68.4	Low	64.3	Low	172 Å²	172	125.1 Å²	125.1	68%	0.675	62%	0.619	S	S	*	*	H	α-helix	trans	-61.9	-39.1	175.5	-85.5	-75.7	0	0	0	112.1	L12 L13 V19 A20	L12-Y16 VanDerWaalsContact O-CD2 3.22Å; L12-Y16 WeakPolarHBondContact O-CD2 3.46Å; L12-Y16 PolarHBondContact O-N 2.87Å; L13-Y16 PolarHBondContact O-N 3.4Å; Y16-V19 PolarHBondContact O-N 2.94Å; Y16-A20 VanDerWaalsContact O-CB 3.3Å; Y16-A20 WeakPolarHBondContact O-CB 3.47Å; Y16-A20 PolarHBondContact O-N 3.3Å
17	L	67.9	Low	63.1	Low	102 Å²	102	123.4 Å²	123.4	53%	0.534	61%	0.614	S	S	.	*	H	α-helix	trans	-67.6	-40.8	177.1	-114.5	148.1	0	0	0	112.7	L13 L14 R15 A20 L21	L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 PolarHBondContact O-N 3.48Å; L14-L17 PolarHBondContact O-N 3.11Å; R15-L17 VanDerWaalsContact C-N 3.31Å; R15-L17 PolarHBondContact O-N 2.93Å; L17-A20 PolarHBondContact O-N 3.33Å; L17-L21 HydrophobicContact CD2-CD1 3.81Å; L17-L21 HydrophobicContact CD2-CG 4.31Å; L17-L21 VanDerWaalsContact O-CB 3.3Å; L17-L21 WeakPolarHBondContact O-CB 3.28Å; L17-L21 WeakPolarHBondContact O-CD1 3.34Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.35Å; L17-L21 PolarHBondContact O-N 2.9Å
18	V	64.3	Low	61.6	Low	103 Å²	103	121.3 Å²	121.3	62%	0.624	63%	0.626	S	S	*	*	H	α-helix	trans	-67	-38.3	175.6	174.6	0	0	0	0	111.1	L14 R15 G22	L14-V18 WeakPolarHBondContact O-CG2 3.28Å; L14-V18 PolarHBondContact O-N 2.91Å; R15-V18 PolarHBondContact O-N 3.44Å; V18-G22 PolarHBondContact O-N 3.49Å
19	V	63.5	Low	60	Low	81 Å²	81	122.4 Å²	122.4	49%	0.491	64%	0.636	S	S	.	*	H	α-helix	trans	-64.9	-46.7	174	174.1	0	0	0	0	110.1	R15 Y16 L21 G22 Y23	R15-V19 WeakPolarHBondContact O-CB 3.28Å; R15-V19 VanDerWaalsContact O-CG2 3.22Å; R15-V19 WeakPolarHBondContact O-CG2 3.45Å; R15-V19 PolarHBondContact O-N 3.13Å; Y16-V19 PolarHBondContact O-N 2.94Å; V19-L21 PolarHBondContact O-N 3.45Å; V19-G22 PolarHBondContact O-N 2.87Å; V19-Y23 HydrophobicContact CG1-CD2 4.11Å; V19-Y23 HydrophobicContact CG1-CE2 3.57Å; V19-Y23 WeakPolarHBondContact O-CD2 3.47Å; V19-Y23 PolarHBondContact O-N 2.89Å
20	A	59.5	Low	58.3	Low	62 Å²	62	121.7 Å²	121.7	51%	0.512	64%	0.64	S	S	.	*	H	α-helix	trans	-63.4	-39.8	178.3	0	0	0	0	0	113.1	Y16 L17	Y16-A20 VanDerWaalsContact O-CB 3.3Å; Y16-A20 WeakPolarHBondContact O-CB 3.47Å; Y16-A20 PolarHBondContact O-N 3.3Å; L17-A20 PolarHBondContact O-N 3.33Å
21	L	54.3	Low	56.8	Low	128 Å²	128	120 Å²	120	67%	0.67	64%	0.641	S	S	*	*	H	α-helix	trans	-73.5	-26.4	176.2	-72.2	165.3	0	0	0	112.6	L17 V19 Y23	L17-L21 HydrophobicContact CD2-CD1 3.81Å; L17-L21 HydrophobicContact CD2-CG 4.31Å; L17-L21 VanDerWaalsContact O-CB 3.3Å; L17-L21 WeakPolarHBondContact O-CB 3.28Å; L17-L21 WeakPolarHBondContact O-CD1 3.34Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.35Å; L17-L21 PolarHBondContact O-N 2.9Å; V19-L21 PolarHBondContact O-N 3.45Å; L21-Y23 VanDerWaalsContact C-N 3.27Å; L21-Y23 PolarHBondContact O-N 2.8Å
22	G	49.7	Very low	55.4	Low	52 Å²	52	121.1 Å²	121.1	54%	0.536	66%	0.655	S	S	.	*	H	α-helix	trans	-69.3	-21	176.1	0	0	0	0	0	114.2	V18 V19	V18-G22 PolarHBondContact O-N 3.49Å; V19-G22 PolarHBondContact O-N 2.87Å
23	Y	47.1	Very low	54.4	Low	192 Å²	192	122.6 Å²	122.6	75%	0.753	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	0.8	-177.9	-79	-68.9	0	0	0	115.1	V19 L21	V19-Y23 HydrophobicContact CG1-CD2 4.11Å; V19-Y23 HydrophobicContact CG1-CE2 3.57Å; V19-Y23 WeakPolarHBondContact O-CD2 3.47Å; V19-Y23 PolarHBondContact O-N 2.89Å; L21-Y23 VanDerWaalsContact C-N 3.27Å; L21-Y23 PolarHBondContact O-N 2.8Å
24	H	40.6	Very low	53.8	Low	174 Å²	174	123.5 Å²	123.5	81%	0.806	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	19.7	179.1	-113.9	-73.9	0	0	0	115.2	A26	H24-A26 PolarHBondContact O-N 3.43Å; H24-A26 VanDerWaalsContact O-N 3.13Å
25	K	39.3	Very low	53.9	Low	162 Å²	162	124 Å²	124	70%	0.704	66%	0.663	S	S	*	*			trans	-83.1	88.7	169.3	-97.6	170.6	172.8	-176.3	0	110.4	Y27	K25-Y27 HydrophobicContact CB-CD2 4.02Å; K25-Y27 HydrophobicContact CB-CE2 3.89Å; K25-Y27 HydrophobicContact CD-CE2 3.97Å; K25-Y27 HydrophobicContact CG-CE2 3.88Å; K25-Y27 PolarHBondContact O-N 2.94Å
26	A	43	Very low	54.9	Low	94 Å²	94	117 Å²	117	78%	0.777	64%	0.638	S	S	*	*			trans	-54.4	114.5	158.2	0	0	0	0	0	109.7	H24	H24-A26 PolarHBondContact O-N 3.43Å; H24-A26 VanDerWaalsContact O-N 3.13Å
27	Y	44.4	Very low	56.2	Low	176 Å²	176	112.1 Å²	112.1	69%	0.69	63%	0.626	S	S	*	*			trans	-130.7	70.7	161.7	-77.6	-81.7	0	0	0	108	K25 F29	K25-Y27 HydrophobicContact CB-CD2 4.02Å; K25-Y27 HydrophobicContact CB-CE2 3.89Å; K25-Y27 HydrophobicContact CD-CE2 3.97Å; K25-Y27 HydrophobicContact CG-CE2 3.88Å; K25-Y27 PolarHBondContact O-N 2.94Å; Y27-F29 VanDerWaalsContact C-N 3.25Å; Y27-F29 PolarHBondContact O-N 3.32Å; Y27-F29 VanDerWaalsContact O-N 3.16Å
28	G	40.8	Very low	57.6	Low	80 Å²	80	108.5 Å²	108.5	83%	0.825	61%	0.608	S	S	*	*			trans	-77.2	84.7	157.9	0	0	0	0	0	107.9	S30	G28-S30 PolarHBondContact O-N 3.38Å
29	F	41.6	Very low	59.2	Low	194 Å²	194	107.7 Å²	107.7	85%	0.851	60%	0.603	S	S	*	*			trans	-69.4	86.7	162.3	-120.5	-89.6	0	0	0	106.2	Y27 A31	Y27-F29 VanDerWaalsContact C-N 3.25Å; Y27-F29 PolarHBondContact O-N 3.32Å; Y27-F29 VanDerWaalsContact O-N 3.16Å; F29-A31 PolarHBondContact O-N 3.49Å; F29-A31 VanDerWaalsContact O-N 3.08Å
30	S	43.1	Very low	60.8	Low	97 Å²	97	104.2 Å²	104.2	68%	0.678	58%	0.583	S	S	*	*			trans	-67.9	107.5	163.7	-178.6	0	0	0	0	105.7	G28	G28-S30 PolarHBondContact O-N 3.38Å
31	A	46.5	Very low	62.7	Low	69 Å²	69	103 Å²	103	57%	0.57	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-49.6	141.7	161.5	0	0	0	0	0	108.1	F29 K33	F29-A31 PolarHBondContact O-N 3.49Å; F29-A31 VanDerWaalsContact O-N 3.08Å; A31-K33 PolarHBondContact O-N 2.93Å
32	P	48.1	Very low	64.7	Low	127 Å²	127	98 Å²	98	83%	0.825	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-55.3	116.3	173.3	-18.9	29.6	0	0	0	107.6	D34	P32-D34 PolarHBondContact O-N 3.31Å
33	K	58.1	Low	67	Low	122 Å²	122	102.6 Å²	102.6	53%	0.53	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-57.4	117.4	170.1	-77.1	-178.4	-179.2	172.1	0	106.3	A31 Q35 E123	A31-K33 PolarHBondContact O-N 2.93Å; K33-Q35 PolarHBondContact O-N 2.92Å; K33-E123 PolarHBondContact NZ-O 3.27Å
34	D	67.5	Low	69.4	Low	121 Å²	121	99 Å²	99	65%	0.647	54%	0.535	S	S	*	.			trans	-49.9	108.9	174.3	173	55.5	0	0	0	109	P32 Q36 K51	P32-D34 PolarHBondContact O-N 3.31Å; D34-Q36 PolarHBondContact O-N 2.97Å; D34-K51 PolarHBondContact O-NZ 3.48Å; D34-K51 IonicContact OD2-NZ 2.64Å; D34-K51 PolarHBondContact OD2-NZ 3.48Å; D34-K51 VanDerWaalsContact OD2-NZ 3.14Å
35	Q	75.1	Confident	72.1	Confident	110 Å²	110	95.9 Å²	95.9	51%	0.514	52%	0.521	S	S	.	.			trans	-67.3	101	-174.1	-178.8	172.2	-54.3	0	0	108.2	K33 V37	K33-Q35 PolarHBondContact O-N 2.92Å; Q35-V37 PolarHBondContact O-N 3.3Å
36	Q	90	Very high	74.9	Confident	40 Å²	40	88.4 Å²	88.4	19%	0.187	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	123.4	-179.5	-171.1	175.8	12	0	0	109.8	D34 V38 A49 V126 T127	D34-Q36 PolarHBondContact O-N 2.97Å; Q36-V38 HydrophobicContact CG-CG2 4.32Å; Q36-A49 PolarHBondContact OE1-O 3.26Å; Q36-V126 HydrophobicContact CB-CB 4.32Å; Q36-V126 HydrophobicContact CB-CG2 4.08Å; Q36-V126 HydrophobicContact CG-CG2 3.91Å; Q36-V126 CarbonylContact O-C 3.47Å; Q36-V126 WeakPolarHBondContact O-CA 2.95Å; Q36-T127 PolarHBondContact O-N 3.27Å
37	V	95.7	Very high	77.5	Confident	69 Å²	69	87.2 Å²	87.2	42%	0.418	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123	171.7	-175.7	0	0	0	0	108.1	Q35 T127 E129	Q35-V37 PolarHBondContact O-N 3.3Å; V37-T127 CarbonylContact C-O 3.56Å; V37-T127 WeakPolarHBondContact CA-O 2.9Å; V37-E129 HydrophobicContact CG1-CG 3.84Å
38	V	97.2	Very high	80	Confident	26 Å²	26	78.9 Å²	78.9	16%	0.158	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.5	174.9	175.8	0	0	0	0	107.4	Q36 L48 V126 T127 L128 E129	Q36-V38 HydrophobicContact CG-CG2 4.32Å; V38-L48 HydrophobicContact CB-CD2 4.02Å; V38-L48 HydrophobicContact CG1-CD2 4.17Å; V38-L48 HydrophobicContact CG2-CD2 4.19Å; V38-V126 HydrophobicContact CB-CG2 4.43Å; V38-V126 HydrophobicContact CG2-CG2 3.72Å; V38-T127 PolarHBondContact N-O 2.89Å; V38-L128 HydrophobicContact CG1-CD1 4.3Å; V38-L128 WeakPolarHBondContact O-CA 3.3Å; V38-E129 PolarHBondContact O-N 3.28Å
39	T	97.4	Very high	82.6	Confident	85 Å²	85	76.3 Å²	76.3	52%	0.521	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132	176	53.9	0	0	0	0	110	E129	T39-E129 CarbonylContact C-O 3.5Å; T39-E129 WeakPolarHBondContact CA-O 3.44Å; T39-E129 HydrophobicContact CG2-CB 4.1Å
40	A	98.2	Very high	85	Confident	9 Å²	9	67.7 Å²	67.7	7%	0.074	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143.4	174.1	0	0	0	0	0	110.8	A46 L128 E129 V130 L131	A40-A46 HydrophobicContact CB-CB 3.75Å; A40-L128 HydrophobicContact CB-CD1 4.23Å; A40-E129 PolarHBondContact N-O 2.79Å; A40-V130 CarbonylContact O-C 3.56Å; A40-V130 VanDerWaalsContact O-CA 3.29Å; A40-V130 WeakPolarHBondContact O-CA 3.44Å; A40-L131 PolarHBondContact O-N 3.41Å
41	V	98.3	Very high	87.1	Confident	37 Å²	37	68.1 Å²	68.1	22%	0.224	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	142.2	173.2	176	0	0	0	0	109.5	Y43 Q44 L131 V220	V41-Y43 PolarHBondContact O-N 3.44Å; V41-Q44 HydrophobicContact CB-CG 4.03Å; V41-Q44 HydrophobicContact CG1-CG 4.38Å; V41-Q44 VanDerWaalsContact O-CB 3.32Å; V41-Q44 WeakPolarHBondContact O-CB 3.4Å; V41-Q44 PolarHBondContact O-N 2.99Å; V41-L131 CarbonylContact C-O 3.57Å; V41-L131 WeakPolarHBondContact CA-O 3.41Å; V41-L131 HydrophobicContact CG2-CB 4.42Å; V41-V220 HydrophobicContact CG1-CG1 3.64Å; V41-V220 HydrophobicContact CG2-CG1 4.31Å; V41-V220 HydrophobicContact CG2-CG2 4.44Å
42	E	97.9	Very high	88.7	Confident	22 Å²	22	65.6 Å²	65.6	10%	0.103	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	138	177.3	-163.8	170.9	-124.7	0	0	111.6	Q44 R101 V130 L131 V132	E42-Q44 PolarHBondContact O-N 2.97Å; E42-R101 VanDerWaalsContact CD-NH2 3.27Å; E42-R101 IonicContact OE1-CZ 3.85Å; E42-R101 VanDerWaalsContact OE1-CZ 3.27Å; E42-R101 PolarHBondContact OE1-N 3.05Å; E42-R101 VanDerWaalsContact OE1-N 3.11Å; E42-R101 IonicContact OE1-NE 2.93Å; E42-R101 PolarHBondContact OE1-NE 3.08Å; E42-R101 IonicContact OE1-NH2 2.84Å; E42-R101 PolarHBondContact OE1-NH2 2.65Å; E42-R101 IonicContact OE2-CZ 2.76Å; E42-R101 IonicContact OE2-NH2 3.27Å; E42-R101 PolarHBondContact OE2-NH2 2.83Å; E42-V130 HydrophobicContact CB-CG1 4.1Å; E42-V130 HydrophobicContact CG-CG1 4.45Å; E42-L131 PolarHBondContact N-O 2.89Å; E42-V132 HydrophobicContact CB-CG2 4.27Å
43	Y	97.2	Very high	89.5	Confident	148 Å²	148	63.2 Å²	63.2	58%	0.58	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	3.3	-172.9	-45.7	-66.5	0	0	0	116.3	V41 N98 V99	V41-Y43 PolarHBondContact O-N 3.44Å; Y43-N98 PolarHBondContact O-OD1 3.29Å; Y43-V99 PolarHBondContact N-O 2.85Å
44	Q	97.7	Very high	90	Very high	116 Å²	116	66.8 Å²	66.8	54%	0.542	34%	0.338	S	S	.	.	S	Bend	trans	-91.5	-178.3	168.9	-57.3	-168.5	18.4	0	0	111.4	V41 E42 N98 V99	V41-Q44 HydrophobicContact CB-CG 4.03Å; V41-Q44 HydrophobicContact CG1-CG 4.38Å; V41-Q44 VanDerWaalsContact O-CB 3.32Å; V41-Q44 WeakPolarHBondContact O-CB 3.4Å; V41-Q44 PolarHBondContact O-N 2.99Å; E42-Q44 PolarHBondContact O-N 2.97Å; Q44-N98 PolarHBondContact O-N 2.65Å; Q44-V99 WeakPolarHBondContact O-CG2 3.33Å; Q44-V99 PolarHBondContact O-N 2.81Å
45	E	97.6	Very high	90.1	Very high	110 Å²	110	66.3 Å²	66.3	51%	0.514	33%	0.33	S	S	.	.			trans	-89.9	150.6	174	63.5	174.7	-145.3	0	0	112.5	R95 I96	E45-R95 IonicContact OE2-NE 3.81Å; E45-I96 CarbonylContact C-O 3.59Å; E45-I96 WeakPolarHBondContact CA-O 3.32Å
46	A	98.1	Very high	90.1	Very high	5 Å²	5	64.5 Å²	64.5	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.4	169.4	0	0	0	0	0	109.9	A40 R95 I96 V99 L128	A40-A46 HydrophobicContact CB-CB 3.75Å; A46-R95 CarbonylContact O-C 3.58Å; A46-R95 WeakPolarHBondContact O-CA 3.33Å; A46-I96 PolarHBondContact N-O 3.47Å; A46-I96 PolarHBondContact O-N 3.45Å; A46-V99 HydrophobicContact CB-CG2 3.76Å; A46-L128 HydrophobicContact CB-CD1 3.87Å
47	I	97.7	Very high	89.3	Confident	69 Å²	69	70.1 Å²	70.1	35%	0.354	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.2	173.6	-58.8	175.7	0	0	0	108	N93 I94 R95	I47-N93 HydrophobicContact CG2-CB 4.08Å; I47-I94 WeakPolarHBondContact CA-O 3.42Å; I47-R95 HydrophobicContact CG1-CB 4.14Å; I47-R95 HydrophobicContact CG1-CG 4.06Å
48	L	97.2	Very high	88.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.9	175.3	-51.9	-176.2	0	0	0	108.4	V38 W63 N93 I94 I96 Y107 V126 L128	V38-L48 HydrophobicContact CB-CD2 4.02Å; V38-L48 HydrophobicContact CG1-CD2 4.17Å; V38-L48 HydrophobicContact CG2-CD2 4.19Å; L48-W63 HydrophobicContact CB-CH2 3.81Å; L48-W63 HydrophobicContact CB-CZ3 4.12Å; L48-W63 HydrophobicContact CD1-CZ3 4.46Å; L48-N93 CarbonylContact O-C 3.58Å; L48-N93 WeakPolarHBondContact O-CA 3.38Å; L48-N93 WeakPolarHBondContact O-CB 3.34Å; L48-I94 HydrophobicContact CB-CG2 3.71Å; L48-I94 HydrophobicContact CD1-CG2 4.02Å; L48-I94 HydrophobicContact CG-CG2 4.1Å; L48-I94 PolarHBondContact N-O 3.43Å; L48-I94 PolarHBondContact O-N 3.01Å; L48-I96 HydrophobicContact CD1-CD1 4.06Å; L48-I96 HydrophobicContact CG-CD1 4.47Å; L48-Y107 HydrophobicContact CD1-CD1 4.09Å; L48-Y107 HydrophobicContact CD1-CD2 3.74Å; L48-Y107 HydrophobicContact CD1-CE1 4.44Å; L48-Y107 HydrophobicContact CD1-CE2 4.14Å; L48-Y107 HydrophobicContact CD1-CG 3.72Å; L48-V126 HydrophobicContact CB-CG1 4.01Å; L48-V126 HydrophobicContact CD1-CG1 4.29Å; L48-V126 HydrophobicContact CD2-CG1 4.45Å; L48-V126 HydrophobicContact CD2-CG2 4.2Å; L48-V126 HydrophobicContact CG-CG1 4.48Å; L48-L128 HydrophobicContact CD2-CB 4.14Å; L48-L128 HydrophobicContact CD2-CD1 4.24Å
49	A	94.3	Very high	88.2	Confident	27 Å²	27	70.4 Å²	70.4	22%	0.223	37%	0.37	C	S	.	.			trans	-89.3	144.7	-180	0	0	0	0	0	111.4	Q36 N93	Q36-A49 PolarHBondContact OE1-O 3.26Å; A49-N93 VanDerWaalsContact CA-OD1 3.24Å; A49-N93 WeakPolarHBondContact CA-OD1 3.41Å
50	C	92.1	Very high	87.9	Confident	12 Å²	12	71.6 Å²	71.6	8%	0.081	36%	0.364	C	S	.	.			trans	-105.1	113.4	171.2	-172.9	0	0	0	0	108.6	T52 W63 F92 N93 C109	C50-T52 PolarHBondContact O-N 2.99Å; C50-T52 PolarHBondContact SG-OG1 3.31Å; C50-W63 HydrophobicContact CB-CH2 4.42Å; C50-W63 HydrophobicContact CB-CZ2 3.79Å; C50-F92 HydrophobicContact CB-CB 4.02Å; C50-N93 PolarHBondContact N-OD1 3.11Å; C50-C109 VanDerWaalsContact CA-SG 3.57Å; C50-C109 HydrophobicContact CB-CB 3.73Å; C50-C109 WeakPolarHBondContact CB-SG 3.49Å; C50-C109 WeakPolarHBondContact SG-CB 3.49Å; C50-C109 CovalentContact SG-SG 2.03Å; C50-C109 PolarHBondContact SG-SG 2.91Å
51	K	87.9	Confident	87.6	Confident	107 Å²	107	71.8 Å²	71.8	47%	0.465	36%	0.364	S	S	.	.			trans	-78.4	8.6	-176.1	-60.1	175.1	180	176.8	0	114.1	D34 D124	D34-K51 PolarHBondContact O-NZ 3.48Å; D34-K51 IonicContact OD2-NZ 2.64Å; D34-K51 PolarHBondContact OD2-NZ 3.48Å; D34-K51 VanDerWaalsContact OD2-NZ 3.14Å; K51-D124 WeakPolarHBondContact CB-OD2 3.42Å; K51-D124 VanDerWaalsContact CG-OD2 3.28Å; K51-D124 WeakPolarHBondContact CG-OD2 3.21Å; K51-D124 PolarHBondContact N-OD2 2.99Å
52	T	79.2	Confident	87.5	Confident	16 Å²	16	70.9 Å²	70.9	10%	0.098	36%	0.358	C	S	.	.			trans	-70.4	150.8	-177.8	57.7	0	0	0	0	112.4	C50 V111 E122 D124	C50-T52 PolarHBondContact O-N 2.99Å; C50-T52 PolarHBondContact SG-OG1 3.31Å; T52-V111 HydrophobicContact CG2-CG2 4.49Å; T52-V111 WeakPolarHBondContact OG1-CG2 3.14Å; T52-E122 HydrophobicContact CG2-CB 3.99Å; T52-D124 HydrophobicContact CG2-CB 4.14Å
53	P	65.3	Low	87.5	Confident	77 Å²	77	69.9 Å²	69.9	50%	0.5	35%	0.353	S	S	.	.			trans	-68.4	-179.5	-178.5	24.4	-32.1	0	0	0	115.4	E122	P53-E122 WeakPolarHBondContact CD-OE2 3.4Å; P53-E122 VanDerWaalsContact CG-OE1 3.28Å; P53-E122 WeakPolarHBondContact CG-OE1 3.23Å; P53-E122 WeakPolarHBondContact CG-OE2 3.42Å
54	K	69	Low	87.5	Confident	196 Å²	196	64 Å²	64	85%	0.852	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-54.1	135.8	-156.7	-72.3	-175.3	177.7	-179.8	0	115.1	T56	K54-T56 PolarHBondContact O-N 3.02Å
55	K	68.1	Low	87.5	Confident	112 Å²	112	60.6 Å²	60.6	49%	0.487	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-61.9	128.5	170.3	-147	167.4	173.9	174	0	109.7	F92	K55-F92 HydrophobicContact CB-CE1 3.94Å; K55-F92 HydrophobicContact CB-CE2 3.58Å; K55-F92 HydrophobicContact CB-CZ 3.11Å; K55-F92 HydrophobicContact CD-CE1 3.88Å; K55-F92 HydrophobicContact CD-CE2 4.26Å; K55-F92 HydrophobicContact CD-CZ 3.82Å; K55-F92 HydrophobicContact CG-CE1 3.7Å; K55-F92 HydrophobicContact CG-CE2 4.19Å; K55-F92 HydrophobicContact CG-CZ 3.43Å; K55-F92 VanDerWaalsContact CG-CZ 3.43Å; K55-F92 VanDerWaalsContact N-CZ 3.29Å
56	T	75.2	Confident	87.4	Confident	71 Å²	71	57.2 Å²	57.2	44%	0.436	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-97.7	161	159.4	68.2	0	0	0	0	109.5	K54 S58 S59	K54-T56 PolarHBondContact O-N 3.02Å; T56-S58 PolarHBondContact O-N 3.49Å; T56-S58 VanDerWaalsContact O-N 3.11Å; T56-S59 PolarHBondContact N-OG 2.99Å; T56-S59 VanDerWaalsContact O-CB 3.31Å; T56-S59 WeakPolarHBondContact O-CB 3.33Å; T56-S59 PolarHBondContact O-N 3.34Å; T56-S59 PolarHBondContact O-OG 2.91Å; T56-S59 PolarHBondContact OG1-N 3.29Å; T56-S59 PolarHBondContact OG1-OG 3.46Å
57	V	75	Confident	87.1	Confident	158 Å²	158	59.8 Å²	59.8	96%	0.958	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.7	176.1	179.5	0	0	0	0	111.7
58	S	80.7	Confident	86.9	Confident	83 Å²	83	69.4 Å²	69.4	58%	0.58	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	7	179.2	-50.7	0	0	0	0	114.2	T56 P114	T56-S58 PolarHBondContact O-N 3.49Å; T56-S58 VanDerWaalsContact O-N 3.11Å; S58-P114 WeakPolarHBondContact O-CD 3.3Å
59	S	87.6	Confident	86.8	Confident	18 Å²	18	73.7 Å²	73.7	13%	0.126	39%	0.388	C	S	.	.			trans	-76.1	131.8	177.3	-63.5	0	0	0	0	111.2	T56 S112	T56-S59 PolarHBondContact N-OG 2.99Å; T56-S59 VanDerWaalsContact O-CB 3.31Å; T56-S59 WeakPolarHBondContact O-CB 3.33Å; T56-S59 PolarHBondContact O-N 3.34Å; T56-S59 PolarHBondContact O-OG 2.91Å; T56-S59 PolarHBondContact OG1-N 3.29Å; T56-S59 PolarHBondContact OG1-OG 3.46Å; S59-S112 CarbonylContact C-O 3.58Å; S59-S112 WeakPolarHBondContact CA-O 3.04Å
60	R	91.5	Very high	86.8	Confident	110 Å²	110	76.4 Å²	76.4	42%	0.415	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.9	171.3	167.6	-175.4	179.8	163	2.7	109.2	E62 Y75 V111 S112	R60-E62 HydrophobicContact CG-CG 4.45Å; R60-E62 IonicContact CZ-OE1 3.23Å; R60-E62 IonicContact NE-OE1 3.22Å; R60-E62 PolarHBondContact NE-OE1 3.32Å; R60-E62 IonicContact NH2-OE1 3.84Å; R60-E62 PolarHBondContact NH2-OE1 3.46Å; R60-Y75 VanDerWaalsContact NH2-CZ 3.33Å; R60-Y75 PolarHBondContact NH2-OH 3.44Å; R60-V111 WeakPolarHBondContact O-CA 3.47Å; R60-S112 WeakPolarHBondContact CB-OG 3.43Å; R60-S112 PolarHBondContact N-O 2.81Å; R60-S112 PolarHBondContact O-N 2.67Å; R60-S112 PolarHBondContact O-OG 2.82Å
61	L	92.9	Very high	87	Confident	13 Å²	13	78.4 Å²	78.4	7%	0.068	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.9	177	171.9	65.9	0	0	0	110.3	Y74 M89 F92 C109 E110 V111	L61-Y74 HydrophobicContact CB-CE1 4.44Å; L61-Y74 HydrophobicContact CD2-CE1 4.35Å; L61-Y74 HydrophobicContact CG-CD1 4.31Å; L61-Y74 HydrophobicContact CG-CE1 4.36Å; L61-Y74 WeakPolarHBondContact O-CD1 3.35Å; L61-M89 HydrophobicContact CD2-CE 3.54Å; L61-F92 HydrophobicContact CD1-CD1 4.17Å; L61-F92 HydrophobicContact CD2-CD1 3.99Å; L61-C109 HydrophobicContact CD1-CB 4.41Å; L61-E110 CarbonylContact C-O 3.44Å; L61-E110 WeakPolarHBondContact CA-O 3.39Å; L61-V111 HydrophobicContact CD1-CG2 3.75Å
62	E	95.3	Very high	87.5	Confident	19 Å²	19	77.5 Å²	77.5	9%	0.089	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.1	171	-57.2	-171.9	166.4	0	0	110.5	R60 K64 Y74 Y75 C109 E110	R60-E62 HydrophobicContact CG-CG 4.45Å; R60-E62 IonicContact CZ-OE1 3.23Å; R60-E62 IonicContact NE-OE1 3.22Å; R60-E62 PolarHBondContact NE-OE1 3.32Å; R60-E62 IonicContact NH2-OE1 3.84Å; R60-E62 PolarHBondContact NH2-OE1 3.46Å; E62-K64 VanDerWaalsContact OE2-CE 3.24Å; E62-K64 WeakPolarHBondContact OE2-CE 3.42Å; E62-K64 IonicContact OE2-NZ 3.73Å; E62-K64 PolarHBondContact OE2-NZ 3.47Å; E62-Y74 WeakPolarHBondContact CA-O 3.46Å; E62-Y75 HydrophobicContact CG-CD2 4.25Å; E62-Y75 VanDerWaalsContact OE1-CD2 3.32Å; E62-Y75 WeakPolarHBondContact OE1-CD2 3.32Å; E62-Y75 WeakPolarHBondContact OE1-CE2 3.31Å; E62-C109 CarbonylContact O-C 3.56Å; E62-C109 WeakPolarHBondContact O-CA 3.3Å; E62-E110 HydrophobicContact CB-CB 4.44Å; E62-E110 PolarHBondContact N-O 3.12Å; E62-E110 PolarHBondContact O-N 3.43Å
63	W	97.2	Very high	88.3	Confident	1 Å²	1	76.8 Å²	76.8	0%	0.004	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.4	167.6	-82.3	88.6	0	0	0	109.8	L48 C50 V73 Y74 F92 I94 C109 V126	L48-W63 HydrophobicContact CB-CH2 3.81Å; L48-W63 HydrophobicContact CB-CZ3 4.12Å; L48-W63 HydrophobicContact CD1-CZ3 4.46Å; C50-W63 HydrophobicContact CB-CH2 4.42Å; C50-W63 HydrophobicContact CB-CZ2 3.79Å; W63-V73 HydrophobicContact CB-CB 4.03Å; W63-V73 HydrophobicContact CB-CG1 4.47Å; W63-V73 PolarHBondContact O-N 3.34Å; W63-Y74 PolarHBondContact N-O 3.12Å; W63-Y74 PolarHBondContact O-N 3.01Å; W63-Y74 VanDerWaalsContact O-N 3.1Å; W63-F92 WeakPolarHBondContact CZ2-O 3.38Å; W63-F92 PolarHBondContact NE1-O 2.96Å; W63-I94 HydrophobicContact CD2-CG2 4.03Å; W63-I94 HydrophobicContact CE3-CG2 4.23Å; W63-I94 HydrophobicContact CH2-CG2 4.39Å; W63-I94 HydrophobicContact CZ2-CG2 4.18Å; W63-I94 HydrophobicContact CZ3-CG2 4.41Å; W63-C109 HydrophobicContact CD2-CB 3.79Å; W63-C109 HydrophobicContact CE3-CB 4.03Å; W63-C109 HydrophobicContact CG-CB 4.43Å; W63-C109 HydrophobicContact CH2-CB 3.94Å; W63-C109 HydrophobicContact CZ2-CB 3.7Å; W63-C109 HydrophobicContact CZ3-CB 4.09Å; W63-V126 HydrophobicContact CH2-CG1 3.89Å; W63-V126 HydrophobicContact CZ3-CG1 3.67Å
64	K	97.4	Very high	89.9	Confident	24 Å²	24	74.8 Å²	74.8	10%	0.104	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.3	-179.2	-70.1	166.6	-176.3	161.7	0	109.9	E62 L66 V70 S71 F72 Y107 R108 E110	E62-K64 VanDerWaalsContact OE2-CE 3.24Å; E62-K64 WeakPolarHBondContact OE2-CE 3.42Å; E62-K64 IonicContact OE2-NZ 3.73Å; E62-K64 PolarHBondContact OE2-NZ 3.47Å; K64-L66 HydrophobicContact CB-CD2 4.45Å; K64-V70 HydrophobicContact CB-CG1 3.77Å; K64-V70 HydrophobicContact CD-CG1 4.02Å; K64-V70 HydrophobicContact CG-CG1 4.05Å; K64-S71 CarbonylContact C-O 3.59Å; K64-S71 VanDerWaalsContact CA-O 3.27Å; K64-S71 WeakPolarHBondContact CA-O 3.22Å; K64-F72 HydrophobicContact CD-CE1 4.27Å; K64-F72 HydrophobicContact CG-CD1 3.95Å; K64-F72 HydrophobicContact CG-CE1 4.2Å; K64-Y107 CarbonylContact O-C 3.39Å; K64-Y107 VanDerWaalsContact O-CA 3.29Å; K64-Y107 WeakPolarHBondContact O-CA 3.45Å; K64-R108 PolarHBondContact N-O 3.49Å; K64-R108 PolarHBondContact O-N 3Å; K64-E110 WeakPolarHBondContact CD-OE1 3.45Å; K64-E110 VanDerWaalsContact NZ-CD 3.34Å; K64-E110 IonicContact NZ-OE1 2.75Å; K64-E110 PolarHBondContact NZ-OE1 2.97Å; K64-E110 IonicContact NZ-OE2 2.73Å; K64-E110 PolarHBondContact NZ-OE2 3.5Å
65	K	97.7	Very high	91.2	Very high	44 Å²	44	68.2 Å²	68.2	19%	0.191	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.2	167.1	-167.6	-178.1	-170.6	-151.1	0	108.2	V70 S71 V73 S102 A104 Y107	K65-V70 WeakPolarHBondContact O-CA 3.47Å; K65-S71 PolarHBondContact N-O 3.2Å; K65-S71 PolarHBondContact O-N 3.22Å; K65-S71 VanDerWaalsContact O-N 3.11Å; K65-V73 HydrophobicContact CB-CG2 3.83Å; K65-S102 PolarHBondContact NZ-O 3.17Å; K65-A104 VanDerWaalsContact CE-O 3.29Å; K65-A104 WeakPolarHBondContact CE-O 3.35Å; K65-A104 PolarHBondContact NZ-O 2.84Å; K65-Y107 HydrophobicContact CB-CD1 4Å; K65-Y107 HydrophobicContact CB-CE1 3.74Å; K65-Y107 HydrophobicContact CD-CE1 4.06Å; K65-Y107 WeakPolarHBondContact CE-OH 3.47Å; K65-Y107 HydrophobicContact CG-CD1 4.13Å; K65-Y107 HydrophobicContact CG-CE1 3.68Å; K65-Y107 HydrophobicContact CG-CE2 4.24Å
66	L	96.3	Very high	92.4	Very high	40 Å²	40	69.2 Å²	69.2	21%	0.209	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	127.1	178	-49.4	-170.7	0	0	0	108.7	K64 V70 K106 R108	K64-L66 HydrophobicContact CB-CD2 4.45Å; L66-V70 HydrophobicContact CD2-CG1 4.16Å; L66-V70 HydrophobicContact CD2-CG2 4.21Å; L66-K106 WeakPolarHBondContact CA-O 3.44Å; L66-K106 HydrophobicContact CB-CB 4.27Å; L66-K106 WeakPolarHBondContact CB-O 3.22Å; L66-K106 HydrophobicContact CD1-CB 4.46Å; L66-K106 HydrophobicContact CD1-CD 3.87Å; L66-K106 HydrophobicContact CD1-CG 3.87Å; L66-K106 HydrophobicContact CG-CG 4.42Å; L66-K106 PolarHBondContact N-O 3.1Å; L66-R108 HydrophobicContact CD1-CB 4.15Å; L66-R108 HydrophobicContact CD2-CB 4.03Å; L66-R108 HydrophobicContact CG-CB 4.22Å
67	G	91.8	Very high	93.2	Very high	59 Å²	59	74 Å²	74	61%	0.608	39%	0.385	S	S	*	.	S	Bend	trans	-154.5	-150.2	177.6	0	0	0	0	0	109.8	S69	G67-S69 VanDerWaalsContact C-N 3.26Å; G67-S69 PolarHBondContact O-N 3.4Å
68	R	93	Very high	94.2	Very high	270 Å²	270	69.5 Å²	69.5	100%	1.019	36%	0.357	S	S	*	.	S	Bend	trans	-60.1	-40.5	169.9	-69	-177	-177.5	167.9	0.9	111.6
69	S	94.2	Very high	95	Very high	91 Å²	91	66.6 Å²	66.6	64%	0.636	34%	0.335	S	S	*	.	S	Bend	trans	-118.4	142.3	168.5	54.5	0	0	0	0	108.4	G67	G67-S69 VanDerWaalsContact C-N 3.26Å; G67-S69 PolarHBondContact O-N 3.4Å
70	V	95.8	Very high	95.5	Very high	84 Å²	84	68.6 Å²	68.6	51%	0.509	34%	0.342	S	S	.	.			trans	-78.6	124	173.5	-178.4	0	0	0	0	108.5	K64 K65 L66	K64-V70 HydrophobicContact CB-CG1 3.77Å; K64-V70 HydrophobicContact CD-CG1 4.02Å; K64-V70 HydrophobicContact CG-CG1 4.05Å; K65-V70 WeakPolarHBondContact O-CA 3.47Å; L66-V70 HydrophobicContact CD2-CG1 4.16Å; L66-V70 HydrophobicContact CD2-CG2 4.21Å
71	S	96.1	Very high	95.6	Very high	54 Å²	54	66.4 Å²	66.4	38%	0.378	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	143.1	174.7	59	0	0	0	0	110.9	K64 K65	K64-S71 CarbonylContact C-O 3.59Å; K64-S71 VanDerWaalsContact CA-O 3.27Å; K64-S71 WeakPolarHBondContact CA-O 3.22Å; K65-S71 PolarHBondContact N-O 3.2Å; K65-S71 PolarHBondContact O-N 3.22Å; K65-S71 VanDerWaalsContact O-N 3.11Å
72	F	97.5	Very high	95.7	Very high	88 Å²	88	70 Å²	70	39%	0.386	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	135.5	171.5	-70.3	-78.1	0	0	0	110.1	K64 Y75 Q80	K64-F72 HydrophobicContact CD-CE1 4.27Å; K64-F72 HydrophobicContact CG-CD1 3.95Å; K64-F72 HydrophobicContact CG-CE1 4.2Å; F72-Y75 AromaticContact CD1-CD2 3.6Å; F72-Y75 HydrophobicContact CD1-CD2 3.6Å; F72-Y75 HydrophobicContact CD1-CE2 4.47Å; F72-Y75 AromaticContact CD1-CG 3.85Å; F72-Y75 HydrophobicContact CD1-CG 3.85Å; F72-Y75 AromaticContact CE1-CD2 3.27Å; F72-Y75 HydrophobicContact CE1-CD2 3.27Å; F72-Y75 AromaticContact CE1-CE2 3.76Å; F72-Y75 HydrophobicContact CE1-CE2 3.76Å; F72-Y75 AromaticContact CE1-CG 3.96Å; F72-Y75 HydrophobicContact CE1-CG 3.96Å; F72-Y75 HydrophobicContact CE2-CD2 4.49Å; F72-Y75 HydrophobicContact CG-CD2 4.31Å; F72-Y75 HydrophobicContact CG-CG 4.17Å; F72-Y75 AromaticContact CZ-CD2 3.79Å; F72-Y75 HydrophobicContact CZ-CD2 3.79Å; F72-Y75 AromaticContact CZ-CE2 3.85Å; F72-Y75 HydrophobicContact CZ-CE2 3.85Å; F72-Y75 HydrophobicContact CZ-CG 4.42Å; F72-Q80 HydrophobicContact CB-CB 4.27Å; F72-Q80 HydrophobicContact CB-CG 3.97Å; F72-Q80 WeakPolarHBondContact O-CB 3.36Å
73	V	97.5	Very high	95.7	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-42.9	171.5	179.2	0	0	0	0	109	W63 K65 L79 Q80 F83 I94 Y107	W63-V73 HydrophobicContact CB-CB 4.03Å; W63-V73 HydrophobicContact CB-CG1 4.47Å; W63-V73 PolarHBondContact O-N 3.34Å; K65-V73 HydrophobicContact CB-CG2 3.83Å; V73-L79 WeakPolarHBondContact O-CA 3.32Å; V73-Q80 PolarHBondContact O-N 3.48Å; V73-F83 HydrophobicContact CB-CD2 4.36Å; V73-F83 HydrophobicContact CG1-CB 4.24Å; V73-F83 HydrophobicContact CG1-CD1 4.12Å; V73-F83 HydrophobicContact CG1-CD2 3.81Å; V73-F83 HydrophobicContact CG1-CE1 4.47Å; V73-F83 HydrophobicContact CG1-CE2 4.18Å; V73-F83 HydrophobicContact CG1-CG 3.78Å; V73-F83 HydrophobicContact CG1-CZ 4.5Å; V73-F83 HydrophobicContact CG2-CD2 4.2Å; V73-F83 HydrophobicContact CG2-CE2 3.94Å; V73-F83 HydrophobicContact CG2-CZ 4.46Å; V73-I94 HydrophobicContact CG1-CD1 3.31Å; V73-Y107 HydrophobicContact CG2-CD1 4.06Å; V73-Y107 HydrophobicContact CG2-CE1 3.86Å
74	Y	97.5	Very high	95.6	Very high	35 Å²	35	76 Å²	76	14%	0.137	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	123.6	172.9	-176.4	-103.6	0	0	0	109.6	L61 E62 W63 Q77 T78 L79 M89	L61-Y74 HydrophobicContact CB-CE1 4.44Å; L61-Y74 HydrophobicContact CD2-CE1 4.35Å; L61-Y74 HydrophobicContact CG-CD1 4.31Å; L61-Y74 HydrophobicContact CG-CE1 4.36Å; L61-Y74 WeakPolarHBondContact O-CD1 3.35Å; E62-Y74 WeakPolarHBondContact CA-O 3.46Å; W63-Y74 PolarHBondContact N-O 3.12Å; W63-Y74 PolarHBondContact O-N 3.01Å; W63-Y74 VanDerWaalsContact O-N 3.1Å; Y74-Q77 VanDerWaalsContact CE2-C 3.43Å; Y74-Q77 VanDerWaalsContact CZ-CA 3.5Å; Y74-Q77 VanDerWaalsContact OH-CA 3.27Å; Y74-Q77 WeakPolarHBondContact OH-CA 3.36Å; Y74-T78 WeakPolarHBondContact CA-O 3.38Å; Y74-T78 WeakPolarHBondContact CD2-O 3.16Å; Y74-L79 HydrophobicContact CD2-CD2 4.06Å; Y74-L79 HydrophobicContact CD2-CG 4.16Å; Y74-M89 HydrophobicContact CD1-CE 4.32Å; Y74-M89 HydrophobicContact CD1-SD 4.37Å; Y74-M89 HydrophobicContact CD2-CG 3.58Å; Y74-M89 HydrophobicContact CD2-SD 3.78Å; Y74-M89 HydrophobicContact CE2-CG 3.44Å; Y74-M89 VanDerWaalsContact CE2-CG 3.44Å; Y74-M89 HydrophobicContact CE2-SD 4.21Å; Y74-M89 HydrophobicContact CG-CE 4.38Å; Y74-M89 HydrophobicContact CG-CG 4.19Å; Y74-M89 HydrophobicContact CG-SD 3.84Å
75	Y	96.7	Very high	95.5	Very high	59 Å²	59	81.6 Å²	81.6	23%	0.231	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	141.2	-176.5	-179.9	-106.2	0	0	0	110	R60 E62 F72 Q77 T78 Q80	R60-Y75 VanDerWaalsContact NH2-CZ 3.33Å; R60-Y75 PolarHBondContact NH2-OH 3.44Å; E62-Y75 HydrophobicContact CG-CD2 4.25Å; E62-Y75 VanDerWaalsContact OE1-CD2 3.32Å; E62-Y75 WeakPolarHBondContact OE1-CD2 3.32Å; E62-Y75 WeakPolarHBondContact OE1-CE2 3.31Å; F72-Y75 AromaticContact CD1-CD2 3.6Å; F72-Y75 HydrophobicContact CD1-CD2 3.6Å; F72-Y75 HydrophobicContact CD1-CE2 4.47Å; F72-Y75 AromaticContact CD1-CG 3.85Å; F72-Y75 HydrophobicContact CD1-CG 3.85Å; F72-Y75 AromaticContact CE1-CD2 3.27Å; F72-Y75 HydrophobicContact CE1-CD2 3.27Å; F72-Y75 AromaticContact CE1-CE2 3.76Å; F72-Y75 HydrophobicContact CE1-CE2 3.76Å; F72-Y75 AromaticContact CE1-CG 3.96Å; F72-Y75 HydrophobicContact CE1-CG 3.96Å; F72-Y75 HydrophobicContact CE2-CD2 4.49Å; F72-Y75 HydrophobicContact CG-CD2 4.31Å; F72-Y75 HydrophobicContact CG-CG 4.17Å; F72-Y75 AromaticContact CZ-CD2 3.79Å; F72-Y75 HydrophobicContact CZ-CD2 3.79Å; F72-Y75 AromaticContact CZ-CE2 3.85Å; F72-Y75 HydrophobicContact CZ-CE2 3.85Å; F72-Y75 HydrophobicContact CZ-CG 4.42Å; Y75-Q77 VanDerWaalsContact C-N 3.27Å; Y75-Q77 PolarHBondContact O-N 2.91Å; Y75-T78 PolarHBondContact N-O 2.6Å; Y75-T78 VanDerWaalsContact O-CG2 3.27Å; Y75-T78 WeakPolarHBondContact O-CG2 3.32Å; Y75-T78 PolarHBondContact O-N 2.83Å; Y75-T78 VanDerWaalsContact O-N 3.11Å; Y75-Q80 PolarHBondContact O-NE2 3.28Å
76	Q	93.3	Very high	95.4	Very high	133 Å²	133	82.2 Å²	82.2	62%	0.621	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	45.8	-177.3	-74.1	175.8	-21.5	0	0	113.2	T78	Q76-T78 PolarHBondContact O-N 2.85Å; Q76-T78 VanDerWaalsContact O-N 3.12Å
77	Q	92	Very high	95.5	Very high	172 Å²	172	80.9 Å²	80.9	80%	0.804	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	14.5	178.6	-54.1	174.8	38.6	0	0	115.2	Y74 Y75	Y74-Q77 VanDerWaalsContact CE2-C 3.43Å; Y74-Q77 VanDerWaalsContact CZ-CA 3.5Å; Y74-Q77 VanDerWaalsContact OH-CA 3.27Å; Y74-Q77 WeakPolarHBondContact OH-CA 3.36Å; Y75-Q77 VanDerWaalsContact C-N 3.27Å; Y75-Q77 PolarHBondContact O-N 2.91Å
78	T	96.4	Very high	95.8	Very high	62 Å²	62	81 Å²	81	38%	0.38	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.8	179.2	-175.1	0	0	0	0	111.5	Y74 Y75 Q76 Q80	Y74-T78 WeakPolarHBondContact CA-O 3.38Å; Y74-T78 WeakPolarHBondContact CD2-O 3.16Å; Y75-T78 PolarHBondContact N-O 2.6Å; Y75-T78 VanDerWaalsContact O-CG2 3.27Å; Y75-T78 WeakPolarHBondContact O-CG2 3.32Å; Y75-T78 PolarHBondContact O-N 2.83Å; Y75-T78 VanDerWaalsContact O-N 3.11Å; Q76-T78 PolarHBondContact O-N 2.85Å; Q76-T78 VanDerWaalsContact O-N 3.12Å; T78-Q80 VanDerWaalsContact CG2-NE2 3.31Å
79	L	97.7	Very high	95.9	Very high	23 Å²	23	70.4 Å²	70.4	12%	0.12	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	142.6	172.7	-71.5	163.3	0	0	0	109.9	V73 Y74 K84 A87 M89 I94	V73-L79 WeakPolarHBondContact O-CA 3.32Å; Y74-L79 HydrophobicContact CD2-CD2 4.06Å; Y74-L79 HydrophobicContact CD2-CG 4.16Å; L79-K84 HydrophobicContact CB-CB 4.4Å; L79-A87 VanDerWaalsContact CD1-C 3.47Å; L79-A87 HydrophobicContact CD1-CB 4.09Å; L79-A87 WeakPolarHBondContact CD1-O 3.41Å; L79-A87 HydrophobicContact CD2-CB 4.05Å; L79-M89 HydrophobicContact CD2-SD 4.32Å; L79-I94 HydrophobicContact CD2-CD1 3.88Å
80	Q	97.2	Very high	95.8	Very high	60 Å²	60	68.6 Å²	68.6	28%	0.28	36%	0.356	S	S	.	.			trans	-112.4	155.7	-172.5	-61.6	-64.5	-22.4	0	0	111	F72 V73 Y75 T78 F83	F72-Q80 HydrophobicContact CB-CB 4.27Å; F72-Q80 HydrophobicContact CB-CG 3.97Å; F72-Q80 WeakPolarHBondContact O-CB 3.36Å; V73-Q80 PolarHBondContact O-N 3.48Å; Y75-Q80 PolarHBondContact O-NE2 3.28Å; T78-Q80 VanDerWaalsContact CG2-NE2 3.31Å; Q80-F83 WeakPolarHBondContact O-CB 3.25Å; Q80-F83 PolarHBondContact O-N 3.44Å
81	G	94.7	Very high	95.5	Very high	63 Å²	63	70.6 Å²	70.6	65%	0.649	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	57.4	-140.7	176.5	0	0	0	0	0	113.6	F83 K84	G81-F83 VanDerWaalsContact C-N 3.27Å; G81-F83 PolarHBondContact O-N 2.95Å; G81-K84 WeakPolarHBondContact O-CB 3.14Å; G81-K84 PolarHBondContact O-N 2.95Å
82	D	93.5	Very high	95.3	Very high	88 Å²	88	69.5 Å²	69.5	47%	0.471	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-72.3	-16.6	-179.8	60.9	-28.3	0	0	0	113.9	K84 R86	D82-K84 VanDerWaalsContact C-N 3.25Å; D82-K84 PolarHBondContact O-N 2.84Å; D82-R86 PolarHBondContact O-NE 2.77Å; D82-R86 IonicContact OD1-NH2 3.14Å; D82-R86 IonicContact OD2-CZ 3.03Å; D82-R86 IonicContact OD2-NH2 3.94Å; D82-R86 PolarHBondContact OD2-NH2 2.84Å
83	F	96.2	Very high	95.2	Very high	10 Å²	10	67.4 Å²	67.4	4%	0.044	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-68.5	-22.4	172.8	-65.2	-79	0	0	0	113	V73 Q80 G81 N85 R86 A87 I96 Y107	V73-F83 HydrophobicContact CB-CD2 4.36Å; V73-F83 HydrophobicContact CG1-CB 4.24Å; V73-F83 HydrophobicContact CG1-CD1 4.12Å; V73-F83 HydrophobicContact CG1-CD2 3.81Å; V73-F83 HydrophobicContact CG1-CE1 4.47Å; V73-F83 HydrophobicContact CG1-CE2 4.18Å; V73-F83 HydrophobicContact CG1-CG 3.78Å; V73-F83 HydrophobicContact CG1-CZ 4.5Å; V73-F83 HydrophobicContact CG2-CD2 4.2Å; V73-F83 HydrophobicContact CG2-CE2 3.94Å; V73-F83 HydrophobicContact CG2-CZ 4.46Å; Q80-F83 WeakPolarHBondContact O-CB 3.25Å; Q80-F83 PolarHBondContact O-N 3.44Å; G81-F83 VanDerWaalsContact C-N 3.27Å; G81-F83 PolarHBondContact O-N 2.95Å; F83-N85 PolarHBondContact O-N 3.17Å; F83-N85 VanDerWaalsContact O-N 3.09Å; F83-R86 PolarHBondContact O-N 2.8Å; F83-A87 HydrophobicContact CB-CB 4.05Å; F83-A87 HydrophobicContact CD1-CB 4.22Å; F83-A87 WeakPolarHBondContact O-CB 3.41Å; F83-A87 PolarHBondContact O-N 2.92Å; F83-I96 HydrophobicContact CD1-CD1 4.46Å; F83-I96 HydrophobicContact CD1-CG1 4.35Å; F83-I96 HydrophobicContact CD1-CG2 4.41Å; F83-I96 HydrophobicContact CE1-CD1 3.93Å; F83-I96 HydrophobicContact CE1-CG1 4.29Å; F83-I96 HydrophobicContact CE1-CG2 4.29Å; F83-Y107 HydrophobicContact CZ-CE1 4.24Å
84	K	95.9	Very high	95.1	Very high	136 Å²	136	67.4 Å²	67.4	59%	0.591	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-53.7	-34.2	179.9	-174	177.9	178.1	-178	0	113.6	L79 G81 D82	L79-K84 HydrophobicContact CB-CB 4.4Å; G81-K84 WeakPolarHBondContact O-CB 3.14Å; G81-K84 PolarHBondContact O-N 2.95Å; D82-K84 VanDerWaalsContact C-N 3.25Å; D82-K84 PolarHBondContact O-N 2.84Å
85	N	94.8	Very high	95.1	Very high	143 Å²	143	69 Å²	69	77%	0.765	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-101.1	-6.9	-177.4	-60.5	-29.9	0	0	0	113.3	F83	F83-N85 PolarHBondContact O-N 3.17Å; F83-N85 VanDerWaalsContact O-N 3.09Å
86	R	96.2	Very high	95.2	Very high	56 Å²	56	66.2 Å²	66.2	21%	0.211	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-10.2	-168	-56.4	-174.1	-63.1	112.8	-4.7	113.6	D82 F83 K97 D103	D82-R86 PolarHBondContact O-NE 2.77Å; D82-R86 IonicContact OD1-NH2 3.14Å; D82-R86 IonicContact OD2-CZ 3.03Å; D82-R86 IonicContact OD2-NH2 3.94Å; D82-R86 PolarHBondContact OD2-NH2 2.84Å; F83-R86 PolarHBondContact O-N 2.8Å; R86-K97 WeakPolarHBondContact O-CB 3.05Å; R86-K97 PolarHBondContact O-N 3.37Å; R86-D103 IonicContact CZ-OD1 3.04Å; R86-D103 IonicContact NH1-OD1 2.77Å; R86-D103 IonicContact NH1-OD2 3.89Å; R86-D103 PolarHBondContact NH1-OD2 3.45Å; R86-D103 IonicContact NH2-OD1 2.65Å; R86-D103 PolarHBondContact NH2-OD1 2.87Å; R86-D103 VanDerWaalsContact NH2-OD1 3.17Å
87	A	97.8	Very high	95.4	Very high	13 Å²	13	64 Å²	64	11%	0.107	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	161.7	-179.6	0	0	0	0	0	112.1	L79 F83 I94 R95 I96	L79-A87 VanDerWaalsContact CD1-C 3.47Å; L79-A87 HydrophobicContact CD1-CB 4.09Å; L79-A87 WeakPolarHBondContact CD1-O 3.41Å; L79-A87 HydrophobicContact CD2-CB 4.05Å; F83-A87 HydrophobicContact CB-CB 4.05Å; F83-A87 HydrophobicContact CD1-CB 4.22Å; F83-A87 WeakPolarHBondContact O-CB 3.41Å; F83-A87 PolarHBondContact O-N 2.92Å; A87-I94 HydrophobicContact CB-CD1 3.95Å; A87-I94 HydrophobicContact CB-CG1 4.03Å; A87-R95 CarbonylContact C-O 3.48Å; A87-R95 WeakPolarHBondContact CA-O 3.45Å; A87-R95 WeakPolarHBondContact CB-O 3.31Å; A87-I96 HydrophobicContact CB-CG1 4.33Å
88	E	97.1	Very high	95.7	Very high	61 Å²	61	60.8 Å²	60.8	29%	0.285	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.8	172	63	-169.6	-160.9	0	0	109.9	R95 K97	E88-R95 HydrophobicContact CG-CB 3.91Å; E88-R95 HydrophobicContact CG-CG 4.43Å; E88-R95 PolarHBondContact N-O 2.51Å; E88-R95 PolarHBondContact O-N 2.85Å; E88-R95 WeakPolarHBondContact OE1-CD 3.47Å; E88-R95 IonicContact OE1-CZ 2.65Å; E88-R95 IonicContact OE1-NE 3.37Å; E88-R95 IonicContact OE1-NH1 2.82Å; E88-R95 PolarHBondContact OE1-NH1 3.49Å; E88-K97 IonicContact OE1-NZ 3.86Å; E88-K97 WeakPolarHBondContact OE2-CE 3.18Å; E88-K97 IonicContact OE2-NZ 2.76Å; E88-K97 PolarHBondContact OE2-NZ 2.7Å
89	M	95.3	Very high	95.8	Very high	47 Å²	47	57.9 Å²	57.9	23%	0.232	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	134.2	176.2	-65.4	-56.1	-59.3	0	0	110.2	L61 Y74 L79 N93 I94	L61-M89 HydrophobicContact CD2-CE 3.54Å; Y74-M89 HydrophobicContact CD1-CE 4.32Å; Y74-M89 HydrophobicContact CD1-SD 4.37Å; Y74-M89 HydrophobicContact CD2-CG 3.58Å; Y74-M89 HydrophobicContact CD2-SD 3.78Å; Y74-M89 HydrophobicContact CE2-CG 3.44Å; Y74-M89 VanDerWaalsContact CE2-CG 3.44Å; Y74-M89 HydrophobicContact CE2-SD 4.21Å; Y74-M89 HydrophobicContact CG-CE 4.38Å; Y74-M89 HydrophobicContact CG-CG 4.19Å; Y74-M89 HydrophobicContact CG-SD 3.84Å; L79-M89 HydrophobicContact CD2-SD 4.32Å; M89-N93 WeakPolarHBondContact CE-O 3.3Å; M89-I94 HydrophobicContact SD-CB 4Å; M89-I94 HydrophobicContact SD-CD1 4.37Å; M89-I94 HydrophobicContact SD-CG1 4.1Å
90	I	93.1	Very high	95.7	Very high	53 Å²	53	58.5 Å²	58.5	27%	0.272	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	97.2	172.5	-52.5	175.1	0	0	0	106.7	F92 N93 R95	I90-F92 PolarHBondContact O-N 3.47Å; I90-N93 PolarHBondContact N-O 3.08Å; I90-N93 WeakPolarHBondContact O-CA 3.43Å; I90-N93 WeakPolarHBondContact O-CB 3.36Å; I90-N93 PolarHBondContact O-N 2.96Å; I90-R95 HydrophobicContact CD1-CB 3.81Å; I90-R95 HydrophobicContact CG1-CB 4.41Å
91	D	90	Very high	95.7	Very high	127 Å²	127	61.7 Å²	61.7	68%	0.679	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	-94.4	-171.9	-57.4	-45.7	0	0	0	113.3
92	F	91.2	Very high	95.7	Very high	30 Å²	30	62.2 Å²	62.2	13%	0.132	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-12.7	175.6	-68.3	-73.4	0	0	0	113.7	C50 K55 L61 W63 I90 V111	C50-F92 HydrophobicContact CB-CB 4.02Å; K55-F92 HydrophobicContact CB-CE1 3.94Å; K55-F92 HydrophobicContact CB-CE2 3.58Å; K55-F92 HydrophobicContact CB-CZ 3.11Å; K55-F92 HydrophobicContact CD-CE1 3.88Å; K55-F92 HydrophobicContact CD-CE2 4.26Å; K55-F92 HydrophobicContact CD-CZ 3.82Å; K55-F92 HydrophobicContact CG-CE1 3.7Å; K55-F92 HydrophobicContact CG-CE2 4.19Å; K55-F92 HydrophobicContact CG-CZ 3.43Å; K55-F92 VanDerWaalsContact CG-CZ 3.43Å; K55-F92 VanDerWaalsContact N-CZ 3.29Å; L61-F92 HydrophobicContact CD1-CD1 4.17Å; L61-F92 HydrophobicContact CD2-CD1 3.99Å; W63-F92 WeakPolarHBondContact CZ2-O 3.38Å; W63-F92 PolarHBondContact NE1-O 2.96Å; I90-F92 PolarHBondContact O-N 3.47Å; F92-V111 HydrophobicContact CD1-CG2 4.14Å; F92-V111 HydrophobicContact CE1-CG1 4.28Å; F92-V111 HydrophobicContact CE1-CG2 3.94Å
93	N	94.4	Very high	95.9	Very high	44 Å²	44	58.1 Å²	58.1	24%	0.235	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	153.8	-175.3	-51.3	-28.4	0	0	0	109	I47 L48 A49 C50 M89 I90	I47-N93 HydrophobicContact CG2-CB 4.08Å; L48-N93 CarbonylContact O-C 3.58Å; L48-N93 WeakPolarHBondContact O-CA 3.38Å; L48-N93 WeakPolarHBondContact O-CB 3.34Å; A49-N93 VanDerWaalsContact CA-OD1 3.24Å; A49-N93 WeakPolarHBondContact CA-OD1 3.41Å; C50-N93 PolarHBondContact N-OD1 3.11Å; M89-N93 WeakPolarHBondContact CE-O 3.3Å; I90-N93 PolarHBondContact N-O 3.08Å; I90-N93 WeakPolarHBondContact O-CA 3.43Å; I90-N93 WeakPolarHBondContact O-CB 3.36Å; I90-N93 PolarHBondContact O-N 2.96Å
94	I	96.6	Very high	95.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.2	170.7	-174.4	172.2	0	0	0	109.2	I47 L48 W63 V73 L79 A87 M89 I96	I47-I94 WeakPolarHBondContact CA-O 3.42Å; L48-I94 HydrophobicContact CB-CG2 3.71Å; L48-I94 HydrophobicContact CD1-CG2 4.02Å; L48-I94 HydrophobicContact CG-CG2 4.1Å; L48-I94 PolarHBondContact N-O 3.43Å; L48-I94 PolarHBondContact O-N 3.01Å; W63-I94 HydrophobicContact CD2-CG2 4.03Å; W63-I94 HydrophobicContact CE3-CG2 4.23Å; W63-I94 HydrophobicContact CH2-CG2 4.39Å; W63-I94 HydrophobicContact CZ2-CG2 4.18Å; W63-I94 HydrophobicContact CZ3-CG2 4.41Å; V73-I94 HydrophobicContact CG1-CD1 3.31Å; L79-I94 HydrophobicContact CD2-CD1 3.88Å; A87-I94 HydrophobicContact CB-CD1 3.95Å; A87-I94 HydrophobicContact CB-CG1 4.03Å; M89-I94 HydrophobicContact SD-CB 4Å; M89-I94 HydrophobicContact SD-CD1 4.37Å; M89-I94 HydrophobicContact SD-CG1 4.1Å; I94-I96 HydrophobicContact CD1-CG1 4.41Å; I94-I96 HydrophobicContact CG1-CG1 4.2Å
95	R	98.1	Very high	96	Very high	69 Å²	69	54.1 Å²	54.1	26%	0.26	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.4	168.7	178.8	-173.6	-72.6	162.1	-11.2	108.2	E45 A46 I47 A87 E88 I90	E45-R95 IonicContact OE2-NE 3.81Å; A46-R95 CarbonylContact O-C 3.58Å; A46-R95 WeakPolarHBondContact O-CA 3.33Å; I47-R95 HydrophobicContact CG1-CB 4.14Å; I47-R95 HydrophobicContact CG1-CG 4.06Å; A87-R95 CarbonylContact C-O 3.48Å; A87-R95 WeakPolarHBondContact CA-O 3.45Å; A87-R95 WeakPolarHBondContact CB-O 3.31Å; E88-R95 HydrophobicContact CG-CB 3.91Å; E88-R95 HydrophobicContact CG-CG 4.43Å; E88-R95 PolarHBondContact N-O 2.51Å; E88-R95 PolarHBondContact O-N 2.85Å; E88-R95 WeakPolarHBondContact OE1-CD 3.47Å; E88-R95 IonicContact OE1-CZ 2.65Å; E88-R95 IonicContact OE1-NE 3.37Å; E88-R95 IonicContact OE1-NH1 2.82Å; E88-R95 PolarHBondContact OE1-NH1 3.49Å; I90-R95 HydrophobicContact CD1-CB 3.81Å; I90-R95 HydrophobicContact CG1-CB 4.41Å
96	I	98.3	Very high	96.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.1	176	-54.6	165.4	0	0	0	107.3	E45 A46 L48 F83 A87 I94 V99 L128	E45-I96 CarbonylContact C-O 3.59Å; E45-I96 WeakPolarHBondContact CA-O 3.32Å; A46-I96 PolarHBondContact N-O 3.47Å; A46-I96 PolarHBondContact O-N 3.45Å; L48-I96 HydrophobicContact CD1-CD1 4.06Å; L48-I96 HydrophobicContact CG-CD1 4.47Å; F83-I96 HydrophobicContact CD1-CD1 4.46Å; F83-I96 HydrophobicContact CD1-CG1 4.35Å; F83-I96 HydrophobicContact CD1-CG2 4.41Å; F83-I96 HydrophobicContact CE1-CD1 3.93Å; F83-I96 HydrophobicContact CE1-CG1 4.29Å; F83-I96 HydrophobicContact CE1-CG2 4.29Å; A87-I96 HydrophobicContact CB-CG1 4.33Å; I94-I96 HydrophobicContact CD1-CG1 4.41Å; I94-I96 HydrophobicContact CG1-CG1 4.2Å; I96-V99 HydrophobicContact CB-CG2 4.06Å; I96-V99 HydrophobicContact CG2-CG2 3.86Å; I96-L128 HydrophobicContact CD1-CD2 4.36Å
97	K	97.8	Very high	96.2	Very high	88 Å²	88	48.1 Å²	48.1	38%	0.383	25%	0.25	S	C	.	.	S	Bend	trans	-93.4	149	175.7	-59.2	175.9	-175	167.4	0	109.4	R86 E88 V99	R86-K97 WeakPolarHBondContact O-CB 3.05Å; R86-K97 PolarHBondContact O-N 3.37Å; E88-K97 IonicContact OE1-NZ 3.86Å; E88-K97 WeakPolarHBondContact OE2-CE 3.18Å; E88-K97 IonicContact OE2-NZ 2.76Å; E88-K97 PolarHBondContact OE2-NZ 2.7Å; K97-V99 PolarHBondContact O-N 2.79Å
98	N	97.3	Very high	96.1	Very high	104 Å²	104	50.1 Å²	50.1	56%	0.556	26%	0.255	S	S	*	.	S	Bend	trans	50.2	57.5	179.5	-62	-19	0	0	0	112	Y43 Q44	Y43-N98 PolarHBondContact O-OD1 3.29Å; Q44-N98 PolarHBondContact O-N 2.65Å
99	V	98.1	Very high	96	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.241	C	C	.	.			trans	-61.5	135.8	-179.7	173.8	0	0	0	0	110.4	Y43 Q44 A46 I96 K97 D103 L128 V130	Y43-V99 PolarHBondContact N-O 2.85Å; Q44-V99 WeakPolarHBondContact O-CG2 3.33Å; Q44-V99 PolarHBondContact O-N 2.81Å; A46-V99 HydrophobicContact CB-CG2 3.76Å; I96-V99 HydrophobicContact CB-CG2 4.06Å; I96-V99 HydrophobicContact CG2-CG2 3.86Å; K97-V99 PolarHBondContact O-N 2.79Å; V99-D103 HydrophobicContact CG1-CB 4.18Å; V99-L128 HydrophobicContact CG1-CD2 4.24Å; V99-V130 HydrophobicContact CG1-CB 4.36Å; V99-V130 HydrophobicContact CG1-CG1 4.01Å; V99-V130 HydrophobicContact CG1-CG2 3.41Å; V99-V130 VanDerWaalsContact CG1-CG2 3.41Å
100	T	96.9	Very high	95.9	Very high	36 Å²	36	46 Å²	46	22%	0.221	24%	0.235	C	C	.	.			trans	-114.5	161.8	177.2	67.8	0	0	0	0	110.6	S102 D103	T100-S102 PolarHBondContact O-N 3.03Å; T100-S102 PolarHBondContact OG1-N 3.4Å; T100-S102 PolarHBondContact OG1-OG 3.39Å; T100-D103 PolarHBondContact N-OD2 2.88Å; T100-D103 WeakPolarHBondContact O-CB 3.33Å; T100-D103 PolarHBondContact O-N 2.92Å; T100-D103 PolarHBondContact OG1-OD2 3.4Å
101	R	95.9	Very high	95.8	Very high	128 Å²	128	43.8 Å²	43.8	48%	0.483	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-54.3	-25.3	172.5	72.2	-164.9	69.9	115.6	4.1	114.3	E42 D103 A104 V132	E42-R101 VanDerWaalsContact CD-NH2 3.27Å; E42-R101 IonicContact OE1-CZ 3.85Å; E42-R101 VanDerWaalsContact OE1-CZ 3.27Å; E42-R101 PolarHBondContact OE1-N 3.05Å; E42-R101 VanDerWaalsContact OE1-N 3.11Å; E42-R101 IonicContact OE1-NE 2.93Å; E42-R101 PolarHBondContact OE1-NE 3.08Å; E42-R101 IonicContact OE1-NH2 2.84Å; E42-R101 PolarHBondContact OE1-NH2 2.65Å; E42-R101 IonicContact OE2-CZ 2.76Å; E42-R101 IonicContact OE2-NH2 3.27Å; E42-R101 PolarHBondContact OE2-NH2 2.83Å; R101-D103 VanDerWaalsContact C-N 3.29Å; R101-D103 PolarHBondContact O-N 2.99Å; R101-A104 VanDerWaalsContact O-CB 3.3Å; R101-A104 WeakPolarHBondContact O-CB 3.42Å; R101-A104 PolarHBondContact O-N 3.4Å; R101-V132 HydrophobicContact CB-CG2 4.47Å
102	S	95.6	Very high	95.9	Very high	74 Å²	74	38.9 Å²	38.9	52%	0.517	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-72.9	-22.1	177	76.9	0	0	0	0	113.2	K65 T100 A104	K65-S102 PolarHBondContact NZ-O 3.17Å; T100-S102 PolarHBondContact O-N 3.03Å; T100-S102 PolarHBondContact OG1-N 3.4Å; T100-S102 PolarHBondContact OG1-OG 3.39Å; S102-A104 VanDerWaalsContact C-N 3.29Å
103	D	97	Very high	95.7	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.011	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-78.1	-16	175.9	-59.6	-56.1	0	0	0	111.5	R86 V99 T100 R101 Y107 L128	R86-D103 IonicContact CZ-OD1 3.04Å; R86-D103 IonicContact NH1-OD1 2.77Å; R86-D103 IonicContact NH1-OD2 3.89Å; R86-D103 PolarHBondContact NH1-OD2 3.45Å; R86-D103 IonicContact NH2-OD1 2.65Å; R86-D103 PolarHBondContact NH2-OD1 2.87Å; R86-D103 VanDerWaalsContact NH2-OD1 3.17Å; V99-D103 HydrophobicContact CG1-CB 4.18Å; T100-D103 PolarHBondContact N-OD2 2.88Å; T100-D103 WeakPolarHBondContact O-CB 3.33Å; T100-D103 PolarHBondContact O-N 2.92Å; T100-D103 PolarHBondContact OG1-OD2 3.4Å; R101-D103 VanDerWaalsContact C-N 3.29Å; R101-D103 PolarHBondContact O-N 2.99Å; D103-Y107 VanDerWaalsContact O-CE2 3.3Å; D103-Y107 WeakPolarHBondContact O-CE2 3.38Å; D103-Y107 PolarHBondContact O-OH 3.46Å; D103-L128 HydrophobicContact CB-CD2 4.35Å
104	A	97.4	Very high	95.2	Very high	36 Å²	36	40.4 Å²	40.4	30%	0.298	22%	0.216	S	C	.	.			trans	-56.9	148.7	175.4	0	0	0	0	0	112.1	K65 R101 S102 L128 V130	K65-A104 VanDerWaalsContact CE-O 3.29Å; K65-A104 WeakPolarHBondContact CE-O 3.35Å; K65-A104 PolarHBondContact NZ-O 2.84Å; R101-A104 VanDerWaalsContact O-CB 3.3Å; R101-A104 WeakPolarHBondContact O-CB 3.42Å; R101-A104 PolarHBondContact O-N 3.4Å; S102-A104 VanDerWaalsContact C-N 3.29Å; A104-L128 WeakPolarHBondContact CA-O 3.2Å; A104-V130 HydrophobicContact CB-CB 4.26Å; A104-V130 HydrophobicContact CB-CG2 3.84Å
105	G	96.9	Very high	94.6	Very high	25 Å²	25	43.1 Å²	43.1	26%	0.258	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	135.1	-172.7	177.4	0	0	0	0	0	113.8	Y107 L128	G105-Y107 WeakPolarHBondContact O-CD2 3.11Å; G105-L128 PolarHBondContact N-O 3.49Å; G105-L128 PolarHBondContact O-N 3.37Å
106	K	97.6	Very high	93.8	Very high	73 Å²	73	48.6 Å²	48.6	32%	0.317	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.2	-180	-174	173.6	-84.2	-170.9	0	110.2	L66 V126	L66-K106 WeakPolarHBondContact CA-O 3.44Å; L66-K106 HydrophobicContact CB-CB 4.27Å; L66-K106 WeakPolarHBondContact CB-O 3.22Å; L66-K106 HydrophobicContact CD1-CB 4.46Å; L66-K106 HydrophobicContact CD1-CD 3.87Å; L66-K106 HydrophobicContact CD1-CG 3.87Å; L66-K106 HydrophobicContact CG-CG 4.42Å; L66-K106 PolarHBondContact N-O 3.1Å; K106-V126 CarbonylContact C-O 3.59Å; K106-V126 WeakPolarHBondContact CA-O 3.39Å
107	Y	97.2	Very high	93	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	150.7	174.4	-67.9	-101.8	0	0	0	109	L48 K64 K65 V73 F83 D103 G105 T125 V126 L128	L48-Y107 HydrophobicContact CD1-CD1 4.09Å; L48-Y107 HydrophobicContact CD1-CD2 3.74Å; L48-Y107 HydrophobicContact CD1-CE1 4.44Å; L48-Y107 HydrophobicContact CD1-CE2 4.14Å; L48-Y107 HydrophobicContact CD1-CG 3.72Å; K64-Y107 CarbonylContact O-C 3.39Å; K64-Y107 VanDerWaalsContact O-CA 3.29Å; K64-Y107 WeakPolarHBondContact O-CA 3.45Å; K65-Y107 HydrophobicContact CB-CD1 4Å; K65-Y107 HydrophobicContact CB-CE1 3.74Å; K65-Y107 HydrophobicContact CD-CE1 4.06Å; K65-Y107 WeakPolarHBondContact CE-OH 3.47Å; K65-Y107 HydrophobicContact CG-CD1 4.13Å; K65-Y107 HydrophobicContact CG-CE1 3.68Å; K65-Y107 HydrophobicContact CG-CE2 4.24Å; V73-Y107 HydrophobicContact CG2-CD1 4.06Å; V73-Y107 HydrophobicContact CG2-CE1 3.86Å; F83-Y107 HydrophobicContact CZ-CE1 4.24Å; D103-Y107 VanDerWaalsContact O-CE2 3.3Å; D103-Y107 WeakPolarHBondContact O-CE2 3.38Å; D103-Y107 PolarHBondContact O-OH 3.46Å; G105-Y107 WeakPolarHBondContact O-CD2 3.11Å; Y107-T125 VanDerWaalsContact O-CA 3.29Å; Y107-T125 WeakPolarHBondContact O-CA 3.43Å; Y107-V126 PolarHBondContact N-O 3.32Å; Y107-V126 PolarHBondContact O-N 3.16Å; Y107-L128 HydrophobicContact CD2-CB 4.27Å; Y107-L128 HydrophobicContact CE2-CB 3.97Å; Y107-L128 HydrophobicContact CE2-CD2 4.27Å
108	R	95.7	Very high	92.1	Very high	56 Å²	56	53.8 Å²	53.8	21%	0.211	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.4	174.3	-171.8	170	65.4	-136.1	2.5	109.4	K64 L66 E110 E123 D124 T125	K64-R108 PolarHBondContact N-O 3.49Å; K64-R108 PolarHBondContact O-N 3Å; L66-R108 HydrophobicContact CD1-CB 4.15Å; L66-R108 HydrophobicContact CD2-CB 4.03Å; L66-R108 HydrophobicContact CG-CB 4.22Å; R108-E110 HydrophobicContact CG-CG 4.23Å; R108-E110 IonicContact CZ-OE1 3.17Å; R108-E110 VanDerWaalsContact CZ-OE1 3.22Å; R108-E110 IonicContact NE-OE1 3.54Å; R108-E110 PolarHBondContact NE-OE1 3.38Å; R108-E110 IonicContact NH2-OE1 3.63Å; R108-E110 PolarHBondContact NH2-OE1 2.77Å; R108-E123 WeakPolarHBondContact CD-OE2 3.14Å; R108-E123 HydrophobicContact CG-CB 4.31Å; R108-E123 IonicContact NE-OE2 3.93Å; R108-D124 VanDerWaalsContact CA-O 3.31Å; R108-D124 WeakPolarHBondContact CA-O 3.45Å; R108-D124 WeakPolarHBondContact CG-O 3.37Å; R108-T125 HydrophobicContact CB-CG2 4.2Å; R108-T125 HydrophobicContact CG-CG2 3.96Å
109	C	95.1	Very high	91.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.3	165.1	66.6	0	0	0	0	109.1	C50 L61 E62 W63 E123 D124	C50-C109 VanDerWaalsContact CA-SG 3.57Å; C50-C109 HydrophobicContact CB-CB 3.73Å; C50-C109 WeakPolarHBondContact CB-SG 3.49Å; C50-C109 WeakPolarHBondContact SG-CB 3.49Å; C50-C109 CovalentContact SG-SG 2.03Å; C50-C109 PolarHBondContact SG-SG 2.91Å; L61-C109 HydrophobicContact CD1-CB 4.41Å; E62-C109 CarbonylContact O-C 3.56Å; E62-C109 WeakPolarHBondContact O-CA 3.3Å; W63-C109 HydrophobicContact CD2-CB 3.79Å; W63-C109 HydrophobicContact CE3-CB 4.03Å; W63-C109 HydrophobicContact CG-CB 4.43Å; W63-C109 HydrophobicContact CH2-CB 3.94Å; W63-C109 HydrophobicContact CZ2-CB 3.7Å; W63-C109 HydrophobicContact CZ3-CB 4.09Å; C109-E123 WeakPolarHBondContact O-CA 3.19Å; C109-E123 WeakPolarHBondContact O-CB 3.44Å; C109-D124 PolarHBondContact N-O 3.26Å; C109-D124 PolarHBondContact O-N 2.88Å
110	E	93.4	Very high	90.8	Very high	22 Å²	22	60.2 Å²	60.2	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.7	178	-71.5	172.7	-153.6	0	0	108.1	L61 E62 K64 R108 L121 E122 E123	L61-E110 CarbonylContact C-O 3.44Å; L61-E110 WeakPolarHBondContact CA-O 3.39Å; E62-E110 HydrophobicContact CB-CB 4.44Å; E62-E110 PolarHBondContact N-O 3.12Å; E62-E110 PolarHBondContact O-N 3.43Å; K64-E110 WeakPolarHBondContact CD-OE1 3.45Å; K64-E110 VanDerWaalsContact NZ-CD 3.34Å; K64-E110 IonicContact NZ-OE1 2.75Å; K64-E110 PolarHBondContact NZ-OE1 2.97Å; K64-E110 IonicContact NZ-OE2 2.73Å; K64-E110 PolarHBondContact NZ-OE2 3.5Å; R108-E110 HydrophobicContact CG-CG 4.23Å; R108-E110 IonicContact CZ-OE1 3.17Å; R108-E110 VanDerWaalsContact CZ-OE1 3.22Å; R108-E110 IonicContact NE-OE1 3.54Å; R108-E110 PolarHBondContact NE-OE1 3.38Å; R108-E110 IonicContact NH2-OE1 3.63Å; R108-E110 PolarHBondContact NH2-OE1 2.77Å; E110-L121 HydrophobicContact CB-CD1 4.08Å; E110-E122 CarbonylContact C-O 3.55Å; E110-E122 WeakPolarHBondContact CA-O 3.47Å; E110-E123 HydrophobicContact CG-CB 4.11Å
111	V	92.1	Very high	90.3	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.03	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.1	176.4	-177.6	0	0	0	0	108.2	T52 R60 L61 F92 E122	T52-V111 HydrophobicContact CG2-CG2 4.49Å; T52-V111 WeakPolarHBondContact OG1-CG2 3.14Å; R60-V111 WeakPolarHBondContact O-CA 3.47Å; L61-V111 HydrophobicContact CD1-CG2 3.75Å; F92-V111 HydrophobicContact CD1-CG2 4.14Å; F92-V111 HydrophobicContact CE1-CG1 4.28Å; F92-V111 HydrophobicContact CE1-CG2 3.94Å; V111-E122 PolarHBondContact N-O 3.49Å; V111-E122 PolarHBondContact O-N 3.04Å
112	S	90.5	Very high	90	Very high	25 Å²	25	59.9 Å²	59.9	18%	0.175	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.1	175.4	63.4	0	0	0	0	110.2	S59 R60 N120	S59-S112 CarbonylContact C-O 3.58Å; S59-S112 WeakPolarHBondContact CA-O 3.04Å; R60-S112 WeakPolarHBondContact CB-OG 3.43Å; R60-S112 PolarHBondContact N-O 2.81Å; R60-S112 PolarHBondContact O-N 2.67Å; R60-S112 PolarHBondContact O-OG 2.82Å; S112-N120 CarbonylContact C-O 3.52Å; S112-N120 VanDerWaalsContact CA-O 3.28Å; S112-N120 WeakPolarHBondContact CA-O 3.32Å
113	A	88	Confident	89.8	Confident	16 Å²	16	60.3 Å²	60.3	13%	0.132	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.4	176.3	0	0	0	0	0	110.8	S115 N120	A113-S115 PolarHBondContact O-N 2.82Å; A113-N120 PolarHBondContact N-O 2.94Å; A113-N120 PolarHBondContact O-N 3.46Å
114	P	84.7	Confident	89.6	Confident	90 Å²	90	60.6 Å²	60.6	58%	0.584	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.4	136.1	168.4	-19.9	31.7	0	0	0	110.5	S58	S58-P114 WeakPolarHBondContact O-CD 3.3Å
115	S	82.9	Confident	89.5	Confident	56 Å²	56	60.6 Å²	60.6	39%	0.392	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	160.4	174.4	-178	0	0	0	0	109.4	A113 Q117 G118	A113-S115 PolarHBondContact O-N 2.82Å; S115-Q117 PolarHBondContact O-N 2.81Å; S115-Q117 VanDerWaalsContact O-N 3.13Å; S115-Q117 PolarHBondContact OG-OE1 3.18Å; S115-G118 PolarHBondContact N-O 3.28Å; S115-G118 PolarHBondContact O-N 3.03Å
116	E	80.9	Confident	89.5	Confident	184 Å²	184	59.4 Å²	59.4	86%	0.86	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.7	175	-66.5	-177.3	172.8	0	0	112.2
117	Q	81.2	Confident	89.4	Confident	156 Å²	156	57 Å²	57	73%	0.729	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	9.9	179.3	-61.2	76.3	26	0	0	113.9	S115	S115-Q117 PolarHBondContact O-N 2.81Å; S115-Q117 VanDerWaalsContact O-N 3.13Å; S115-Q117 PolarHBondContact OG-OE1 3.18Å
118	G	79.6	Confident	89.5	Confident	41 Å²	41	57.1 Å²	57.1	42%	0.423	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	127.9	-118	178.4	0	0	0	0	0	113.3	S115	S115-G118 PolarHBondContact N-O 3.28Å; S115-G118 PolarHBondContact O-N 3.03Å
119	Q	81.1	Confident	89.6	Confident	165 Å²	165	58.7 Å²	58.7	77%	0.771	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.5	174.8	-68.1	-172.6	-2.3	0	0	109.8
120	N	86.3	Confident	89.8	Confident	74 Å²	74	58.9 Å²	58.9	40%	0.396	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.7	165.5	-173.7	31.6	0	0	0	108.2	S112 A113 E122	S112-N120 CarbonylContact C-O 3.52Å; S112-N120 VanDerWaalsContact CA-O 3.28Å; S112-N120 WeakPolarHBondContact CA-O 3.32Å; A113-N120 PolarHBondContact N-O 2.94Å; A113-N120 PolarHBondContact O-N 3.46Å; N120-E122 PolarHBondContact ND2-OE1 3.34Å; N120-E122 VanDerWaalsContact ND2-OE1 3.15Å
121	L	88.1	Confident	90	Very high	98 Å²	98	59.2 Å²	59.2	51%	0.513	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.3	175.6	175.9	66.5	0	0	0	108.8	E110	E110-L121 HydrophobicContact CB-CD1 4.08Å
122	E	89.5	Confident	90.3	Very high	59 Å²	59	59.5 Å²	59.5	28%	0.276	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140.9	172.9	-67.8	168.5	171.2	0	0	109.1	T52 P53 E110 V111 N120	T52-E122 HydrophobicContact CG2-CB 3.99Å; P53-E122 WeakPolarHBondContact CD-OE2 3.4Å; P53-E122 VanDerWaalsContact CG-OE1 3.28Å; P53-E122 WeakPolarHBondContact CG-OE1 3.23Å; P53-E122 WeakPolarHBondContact CG-OE2 3.42Å; E110-E122 CarbonylContact C-O 3.55Å; E110-E122 WeakPolarHBondContact CA-O 3.47Å; V111-E122 PolarHBondContact N-O 3.49Å; V111-E122 PolarHBondContact O-N 3.04Å; N120-E122 PolarHBondContact ND2-OE1 3.34Å; N120-E122 VanDerWaalsContact ND2-OE1 3.15Å
123	E	91.4	Very high	90.6	Very high	83 Å²	83	60 Å²	60	39%	0.388	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.8	-179.2	59.2	173.7	-147.9	0	0	110.9	K33 R108 C109 E110	K33-E123 PolarHBondContact NZ-O 3.27Å; R108-E123 WeakPolarHBondContact CD-OE2 3.14Å; R108-E123 HydrophobicContact CG-CB 4.31Å; R108-E123 IonicContact NE-OE2 3.93Å; C109-E123 WeakPolarHBondContact O-CA 3.19Å; C109-E123 WeakPolarHBondContact O-CB 3.44Å; E110-E123 HydrophobicContact CG-CB 4.11Å
124	D	92.7	Very high	91.1	Very high	9 Å²	9	59.4 Å²	59.4	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.3	170.2	-173.3	30.3	0	0	0	109.7	K51 T52 R108 C109	K51-D124 WeakPolarHBondContact CB-OD2 3.42Å; K51-D124 VanDerWaalsContact CG-OD2 3.28Å; K51-D124 WeakPolarHBondContact CG-OD2 3.21Å; K51-D124 PolarHBondContact N-OD2 2.99Å; T52-D124 HydrophobicContact CG2-CB 4.14Å; R108-D124 VanDerWaalsContact CA-O 3.31Å; R108-D124 WeakPolarHBondContact CA-O 3.45Å; R108-D124 WeakPolarHBondContact CG-O 3.37Å; C109-D124 PolarHBondContact N-O 3.26Å; C109-D124 PolarHBondContact O-N 2.88Å
125	T	94.2	Very high	91.7	Very high	35 Å²	35	56.9 Å²	56.9	22%	0.215	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133	-177.7	62.5	0	0	0	0	111.3	Y107 R108	Y107-T125 VanDerWaalsContact O-CA 3.29Å; Y107-T125 WeakPolarHBondContact O-CA 3.43Å; R108-T125 HydrophobicContact CB-CG2 4.2Å; R108-T125 HydrophobicContact CG-CG2 3.96Å
126	V	96.2	Very high	92.4	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.5	179.1	59.4	0	0	0	0	109.6	Q36 V38 L48 W63 K106 Y107	Q36-V126 HydrophobicContact CB-CB 4.32Å; Q36-V126 HydrophobicContact CB-CG2 4.08Å; Q36-V126 HydrophobicContact CG-CG2 3.91Å; Q36-V126 CarbonylContact O-C 3.47Å; Q36-V126 WeakPolarHBondContact O-CA 2.95Å; V38-V126 HydrophobicContact CB-CG2 4.43Å; V38-V126 HydrophobicContact CG2-CG2 3.72Å; L48-V126 HydrophobicContact CB-CG1 4.01Å; L48-V126 HydrophobicContact CD1-CG1 4.29Å; L48-V126 HydrophobicContact CD2-CG1 4.45Å; L48-V126 HydrophobicContact CD2-CG2 4.2Å; L48-V126 HydrophobicContact CG-CG1 4.48Å; W63-V126 HydrophobicContact CH2-CG1 3.89Å; W63-V126 HydrophobicContact CZ3-CG1 3.67Å; K106-V126 CarbonylContact C-O 3.59Å; K106-V126 WeakPolarHBondContact CA-O 3.39Å; Y107-V126 PolarHBondContact N-O 3.32Å; Y107-V126 PolarHBondContact O-N 3.16Å
127	T	97.2	Very high	93.3	Very high	23 Å²	23	50 Å²	50	14%	0.141	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.9	176	-53.2	0	0	0	0	108.9	Q36 V37 V38	Q36-T127 PolarHBondContact O-N 3.27Å; V37-T127 CarbonylContact C-O 3.56Å; V37-T127 WeakPolarHBondContact CA-O 2.9Å; V38-T127 PolarHBondContact N-O 2.89Å
128	L	98.1	Very high	94.1	Very high	2 Å²	2	46 Å²	46	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.4	172.3	177.3	57.7	0	0	0	109.2	V38 A40 A46 L48 I96 V99 D103 A104 G105 Y107 V130	V38-L128 HydrophobicContact CG1-CD1 4.3Å; V38-L128 WeakPolarHBondContact O-CA 3.3Å; A40-L128 HydrophobicContact CB-CD1 4.23Å; A46-L128 HydrophobicContact CB-CD1 3.87Å; L48-L128 HydrophobicContact CD2-CB 4.14Å; L48-L128 HydrophobicContact CD2-CD1 4.24Å; I96-L128 HydrophobicContact CD1-CD2 4.36Å; V99-L128 HydrophobicContact CG1-CD2 4.24Å; D103-L128 HydrophobicContact CB-CD2 4.35Å; A104-L128 WeakPolarHBondContact CA-O 3.2Å; G105-L128 PolarHBondContact N-O 3.49Å; G105-L128 PolarHBondContact O-N 3.37Å; Y107-L128 HydrophobicContact CD2-CB 4.27Å; Y107-L128 HydrophobicContact CE2-CB 3.97Å; Y107-L128 HydrophobicContact CE2-CD2 4.27Å; L128-V130 HydrophobicContact CD2-CG2 4.39Å; L128-V130 HydrophobicContact CG-CG2 4.08Å
129	E	97.9	Very high	95	Very high	89 Å²	89	44.2 Å²	44.2	42%	0.416	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.5	170.1	-69.3	-176.7	178.4	0	0	109.4	V37 V38 T39 A40	V37-E129 HydrophobicContact CG1-CG 3.84Å; V38-E129 PolarHBondContact O-N 3.28Å; T39-E129 CarbonylContact C-O 3.5Å; T39-E129 WeakPolarHBondContact CA-O 3.44Å; T39-E129 HydrophobicContact CG2-CB 4.1Å; A40-E129 PolarHBondContact N-O 2.79Å
130	V	98.6	Very high	95.8	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112	-178.8	-177.6	0	0	0	0	109.4	A40 E42 V99 A104 L128 N161	A40-V130 CarbonylContact O-C 3.56Å; A40-V130 VanDerWaalsContact O-CA 3.29Å; A40-V130 WeakPolarHBondContact O-CA 3.44Å; E42-V130 HydrophobicContact CB-CG1 4.1Å; E42-V130 HydrophobicContact CG-CG1 4.45Å; V99-V130 HydrophobicContact CG1-CB 4.36Å; V99-V130 HydrophobicContact CG1-CG1 4.01Å; V99-V130 HydrophobicContact CG1-CG2 3.41Å; V99-V130 VanDerWaalsContact CG1-CG2 3.41Å; A104-V130 HydrophobicContact CB-CB 4.26Å; A104-V130 HydrophobicContact CB-CG2 3.84Å; L128-V130 HydrophobicContact CD2-CG2 4.39Å; L128-V130 HydrophobicContact CG-CG2 4.08Å; V130-N161 PolarHBondContact O-ND2 2.66Å
131	L	98.6	Very high	96.4	Very high	29 Å²	29	38.7 Å²	38.7	15%	0.152	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.4	179.8	-45.3	-179.1	0	0	0	109.8	A40 V41 E42 N161 P162 V220	A40-L131 PolarHBondContact O-N 3.41Å; V41-L131 CarbonylContact C-O 3.57Å; V41-L131 WeakPolarHBondContact CA-O 3.41Å; V41-L131 HydrophobicContact CG2-CB 4.42Å; E42-L131 PolarHBondContact N-O 2.89Å; L131-N161 CarbonylContact C-O 3.58Å; L131-N161 VanDerWaalsContact CA-O 3.25Å; L131-N161 WeakPolarHBondContact CA-O 3.44Å; L131-P162 HydrophobicContact CD2-CG 4.41Å; L131-V220 HydrophobicContact CB-CG2 3.4Å; L131-V220 VanDerWaalsContact CB-CG2 3.4Å; L131-V220 HydrophobicContact CD1-CG2 4.41Å
132	V	98.4	Very high	96.8	Very high	10 Å²	10	36.1 Å²	36.1	6%	0.061	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-126	130.5	-175.4	-174.5	0	0	0	0	108.4	E42 R101 E159 G160 N161 N218	E42-V132 HydrophobicContact CB-CG2 4.27Å; R101-V132 HydrophobicContact CB-CG2 4.47Å; V132-E159 WeakPolarHBondContact CG1-O 3.41Å; V132-G160 WeakPolarHBondContact O-CA 3.46Å; V132-N161 HydrophobicContact CB-CB 4.21Å; V132-N161 HydrophobicContact CG2-CB 4.32Å; V132-N161 PolarHBondContact N-O 2.87Å; V132-N161 PolarHBondContact O-N 2.97Å; V132-N161 VanDerWaalsContact O-O 3.1Å; V132-N218 PolarHBondContact O-ND2 3.16Å
133	A	97.8	Very high	97.2	Very high	35 Å²	35	37.8 Å²	37.8	29%	0.289	23%	0.226	S	C	.	.			trans	-67.6	149.1	173.8	0	0	0	0	0	110.7	V220	A133-V220 HydrophobicContact CB-CB 4.14Å; A133-V220 HydrophobicContact CB-CG1 3.84Å
134	P	98.3	Very high	97.5	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.026	23%	0.231	C	C	.	.			trans	-59.3	144.8	177	-22.9	35.9	0	0	0	111.1	D157 P164 A216 N218 G221 R223	P134-D157 WeakPolarHBondContact CA-OD2 3.26Å; P134-D157 HydrophobicContact CB-CB 4.48Å; P134-D157 WeakPolarHBondContact CB-OD2 3.48Å; P134-P164 HydrophobicContact CB-CB 4.48Å; P134-P164 HydrophobicContact CG-CB 3.91Å; P134-P164 HydrophobicContact CG-CG 4.39Å; P134-A216 HydrophobicContact CB-CB 3.93Å; P134-A216 HydrophobicContact CG-CB 4.45Å; P134-N218 WeakPolarHBondContact CD-OD1 3.18Å; P134-N218 HydrophobicContact CG-CB 4.4Å; P134-G221 WeakPolarHBondContact CD-O 3.32Å; P134-R223 WeakPolarHBondContact O-CG 3.37Å
135	A	96.9	Very high	97.6	Very high	37 Å²	37	37.6 Å²	37.6	31%	0.306	24%	0.235	S	C	.	.			trans	-78.9	178.9	165.7	0	0	0	0	0	110	P137 D157 E159 R223	A135-P137 VanDerWaalsContact O-CD 3.23Å; A135-P137 WeakPolarHBondContact O-CD 3.23Å; A135-P137 VanDerWaalsContact O-N 3.12Å; A135-D157 PolarHBondContact N-OD1 3.44Å; A135-E159 HydrophobicContact CB-CB 3.91Å; A135-E159 HydrophobicContact CB-CG 3.76Å; A135-R223 VanDerWaalsContact O-CB 3.26Å; A135-R223 WeakPolarHBondContact O-CB 3.44Å
136	V	98.3	Very high	97.7	Very high	91 Å²	91	39.1 Å²	39.1	55%	0.552	24%	0.241	S	C	*	.			trans	-61.6	115.9	171.1	179.8	0	0	0	0	108.1	C225	V136-C225 HydrophobicContact CG1-CB 4.44Å
137	P	98.3	Very high	97.6	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.032	25%	0.251	C	S	.	.			trans	-68.8	150.6	-176.4	27.1	-32.8	0	0	0	111.1	A135 C139 Q156 D157 A216 C225	A135-P137 VanDerWaalsContact O-CD 3.23Å; A135-P137 WeakPolarHBondContact O-CD 3.23Å; A135-P137 VanDerWaalsContact O-N 3.12Å; P137-C139 PolarHBondContact O-N 2.92Å; P137-Q156 CarbonylContact C-O 3.53Å; P137-Q156 WeakPolarHBondContact CA-O 3.42Å; P137-D157 HydrophobicContact CB-CB 4.25Å; P137-A216 HydrophobicContact CB-CB 4.12Å; P137-A216 HydrophobicContact CG-CB 4.01Å; P137-C225 HydrophobicContact CG-CB 4.17Å; P137-C225 VanDerWaalsContact O-CB 3.25Å; P137-C225 WeakPolarHBondContact O-CB 3.45Å
138	S	98.2	Very high	97.4	Very high	71 Å²	71	41.9 Å²	41.9	50%	0.497	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	120.7	168.4	-177.5	0	0	0	0	109.2	C155 Q156	S138-C155 VanDerWaalsContact O-CA 3.3Å; S138-C155 WeakPolarHBondContact O-CA 3.34Å; S138-Q156 PolarHBondContact N-O 2.85Å; S138-Q156 PolarHBondContact O-N 2.93Å
139	C	98.1	Very high	97.2	Very high	4 Å²	4	44.3 Å²	44.3	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.9	177.2	-70.6	0	0	0	0	110.7	P137 R154 W168 C225 K228	P137-C139 PolarHBondContact O-N 2.92Å; C139-R154 CarbonylContact C-O 3.59Å; C139-R154 WeakPolarHBondContact CA-O 3.27Å; C139-W168 HydrophobicContact CB-CH2 4.49Å; C139-C225 HydrophobicContact CB-CB 3.84Å; C139-C225 WeakPolarHBondContact CB-SG 2.95Å; C139-C225 WeakPolarHBondContact SG-CB 3.21Å; C139-C225 CovalentContact SG-SG 2.02Å; C139-C225 PolarHBondContact SG-SG 3.46Å; C139-K228 WeakPolarHBondContact O-CD 3.46Å; C139-K228 WeakPolarHBondContact O-CE 3.25Å; C139-K228 PolarHBondContact O-NZ 2.97Å
140	E	98.3	Very high	97.1	Very high	104 Å²	104	44.6 Å²	44.6	49%	0.486	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	108.9	173.2	-61.6	177.2	-174.4	0	0	108.2	L153 R154	E140-L153 VanDerWaalsContact O-CA 3.3Å; E140-L153 WeakPolarHBondContact O-CA 3.35Å; E140-R154 HydrophobicContact CB-CB 4.12Å; E140-R154 PolarHBondContact N-O 3.09Å; E140-R154 PolarHBondContact O-N 2.03Å
141	V	98.4	Very high	97	Very high	20 Å²	20	45 Å²	45	12%	0.121	30%	0.295	C	S	.	.			trans	-131.4	125.4	178.6	-180	0	0	0	0	106.6	L153 W168 Y212 K228 M230	V141-L153 HydrophobicContact CB-CD2 4.47Å; V141-L153 HydrophobicContact CB-CG 4.39Å; V141-L153 HydrophobicContact CG1-CD2 4.01Å; V141-L153 HydrophobicContact CG1-CG 4.18Å; V141-L153 HydrophobicContact CG2-CD2 3.91Å; V141-L153 HydrophobicContact CG2-CG 4.07Å; V141-W168 HydrophobicContact CG2-CH2 4.06Å; V141-W168 HydrophobicContact CG2-CZ3 3.89Å; V141-Y212 HydrophobicContact CG1-CD2 4.4Å; V141-K228 HydrophobicContact CB-CB 3.74Å; V141-K228 HydrophobicContact CB-CD 4.21Å; V141-K228 HydrophobicContact CG1-CB 4.23Å; V141-K228 HydrophobicContact CG2-CB 3.98Å; V141-K228 HydrophobicContact CG2-CD 4.38Å; V141-M230 HydrophobicContact CG1-CB 3.87Å
142	P	98	Very high	96.9	Very high	44 Å²	44	47.2 Å²	47.2	29%	0.286	31%	0.305	S	S	.	.			trans	-66.4	140	177.8	27.1	-32	0	0	0	110.1	S144 V151 M230	P142-S144 VanDerWaalsContact C-N 3.28Å; P142-S144 PolarHBondContact O-N 2.78Å; P142-V151 HydrophobicContact CG-CG1 3.57Å; P142-M230 HydrophobicContact CG-CG 4.35Å; P142-M230 HydrophobicContact CG-SD 3.93Å; P142-M230 WeakPolarHBondContact O-CA 3.33Å; P142-M230 WeakPolarHBondContact O-CB 3.14Å; P142-M230 WeakPolarHBondContact O-CG 2.98Å
143	S	97.9	Very high	96.9	Very high	94 Å²	94	46.7 Å²	46.7	66%	0.657	30%	0.302	S	S	*	.	S	Bend	trans	-68.1	-31.2	177.5	53.3	0	0	0	0	112.3	Q231	S143-Q231 PolarHBondContact O-N 3.06Å
144	S	96.7	Very high	97	Very high	71 Å²	71	51.1 Å²	51.1	50%	0.497	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	151	178.3	58	0	0	0	0	112.2	P142 Q231	P142-S144 VanDerWaalsContact C-N 3.28Å; P142-S144 PolarHBondContact O-N 2.78Å; S144-Q231 CarbonylContact C-O 3.55Å; S144-Q231 WeakPolarHBondContact CA-O 3.35Å
145	A	96.1	Very high	97	Very high	16 Å²	16	51 Å²	51	13%	0.132	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.7	172.5	0	0	0	0	0	110.5	V151 V204 Q231 V232 D233	A145-V151 HydrophobicContact CB-CG2 3.61Å; A145-V204 HydrophobicContact CB-CG1 4.24Å; A145-Q231 PolarHBondContact N-O 2.97Å; A145-V232 HydrophobicContact CB-CG2 4.42Å; A145-V232 WeakPolarHBondContact O-CA 3.38Å; A145-D233 PolarHBondContact O-N 2.87Å
146	L	95	Very high	97	Very high	67 Å²	67	54.6 Å²	54.6	35%	0.351	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.3	176.9	-173.7	72.9	0	0	0	109.6	G148 T149 V204 D233 L235	L146-G148 PolarHBondContact O-N 3.15Å; L146-T149 HydrophobicContact CB-CG2 3.9Å; L146-T149 HydrophobicContact CD2-CG2 4.36Å; L146-T149 HydrophobicContact CG-CG2 4.49Å; L146-T149 WeakPolarHBondContact O-CG2 3.42Å; L146-T149 PolarHBondContact O-N 3.21Å; L146-T149 VanDerWaalsContact O-N 3.17Å; L146-T149 PolarHBondContact O-OG1 2.86Å; L146-V204 WeakPolarHBondContact O-CG1 3.24Å; L146-D233 WeakPolarHBondContact CA-O 3.42Å; L146-L235 HydrophobicContact CD1-CB 3.93Å; L146-L235 HydrophobicContact CD1-CD1 4.11Å; L146-L235 HydrophobicContact CD2-CB 4.46Å; L146-L235 HydrophobicContact CD2-CD1 4.28Å
147	S	94.4	Very high	97	Very high	29 Å²	29	50.9 Å²	50.9	20%	0.203	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	135	173.5	-70.9	0	0	0	0	111.5	V204 K206 D233 D234	S147-V204 CarbonylContact C-O 3.57Å; S147-V204 WeakPolarHBondContact CA-O 3.31Å; S147-K206 PolarHBondContact OG-N 2.95Å; S147-D233 PolarHBondContact N-O 3.33Å; S147-D233 PolarHBondContact OG-O 3.39Å; S147-D234 VanDerWaalsContact CB-OD1 3.22Å; S147-D234 WeakPolarHBondContact CB-OD1 3.48Å; S147-D234 PolarHBondContact OG-OD1 2.03Å
148	G	92.4	Very high	96.9	Very high	53 Å²	53	58.9 Å²	58.9	55%	0.546	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	-3.8	-179	0	0	0	0	0	115.2	L146 V204	L146-G148 PolarHBondContact O-N 3.15Å; G148-V204 PolarHBondContact N-O 2.83Å
149	T	94.6	Very high	96.8	Very high	53 Å²	53	60.1 Å²	60.1	33%	0.325	33%	0.33	S	S	.	.	S	Bend	trans	-89.7	163.9	176	69.5	0	0	0	0	112.9	L146 V204	L146-T149 HydrophobicContact CB-CG2 3.9Å; L146-T149 HydrophobicContact CD2-CG2 4.36Å; L146-T149 HydrophobicContact CG-CG2 4.49Å; L146-T149 WeakPolarHBondContact O-CG2 3.42Å; L146-T149 PolarHBondContact O-N 3.21Å; L146-T149 VanDerWaalsContact O-N 3.17Å; L146-T149 PolarHBondContact O-OG1 2.86Å; T149-V204 PolarHBondContact O-N 2.02Å
150	V	95.6	Very high	96.8	Very high	96 Å²	96	60.5 Å²	60.5	58%	0.582	34%	0.335	S	S	*	.			trans	-82.4	131.3	169.4	-179.2	0	0	0	0	108.5	Q200 F201 N202	V150-Q200 HydrophobicContact CG1-CG 4.14Å; V150-F201 WeakPolarHBondContact CA-O 3.2Å; V150-F201 WeakPolarHBondContact CG1-O 3.44Å; V150-N202 VanDerWaalsContact CG2-O 3.32Å; V150-N202 WeakPolarHBondContact CG2-O 3.41Å
151	V	97	Very high	96.8	Very high	12 Å²	12	59 Å²	59	7%	0.073	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133	179.7	179.1	0	0	0	0	109.7	P142 A145 L153 Q200 F201 V204 M230	P142-V151 HydrophobicContact CG-CG1 3.57Å; A145-V151 HydrophobicContact CB-CG2 3.61Å; V151-L153 HydrophobicContact CG1-CD1 3.82Å; V151-Q200 CarbonylContact O-C 3.58Å; V151-Q200 WeakPolarHBondContact O-CA 3.29Å; V151-F201 HydrophobicContact CB-CB 4.46Å; V151-F201 PolarHBondContact N-O 3.41Å; V151-F201 VanDerWaalsContact N-O 3.11Å; V151-F201 PolarHBondContact O-N 3.19Å; V151-V204 HydrophobicContact CG2-CB 4.11Å; V151-V204 HydrophobicContact CG2-CG1 3.87Å; V151-M230 HydrophobicContact CG1-SD 3.93Å
152	E	97.3	Very high	96.7	Very high	75 Å²	75	60.6 Å²	60.6	35%	0.35	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.6	177.4	-172.5	179	106	0	0	110.6	R154	E152-R154 HydrophobicContact CG-CG 4.4Å; E152-R154 IonicContact OE1-CZ 3.06Å; E152-R154 IonicContact OE1-NE 2.65Å; E152-R154 PolarHBondContact OE1-NE 3.02Å; E152-R154 IonicContact OE1-NH2 2.7Å; E152-R154 PolarHBondContact OE1-NH2 2.78Å
153	L	98.3	Very high	96.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	140.9	171.9	-72.1	63.3	0	0	0	107.8	E140 V141 V151 W168 T198 L199 F201 Y212 M230	E140-L153 VanDerWaalsContact O-CA 3.3Å; E140-L153 WeakPolarHBondContact O-CA 3.35Å; V141-L153 HydrophobicContact CB-CD2 4.47Å; V141-L153 HydrophobicContact CB-CG 4.39Å; V141-L153 HydrophobicContact CG1-CD2 4.01Å; V141-L153 HydrophobicContact CG1-CG 4.18Å; V141-L153 HydrophobicContact CG2-CD2 3.91Å; V141-L153 HydrophobicContact CG2-CG 4.07Å; V151-L153 HydrophobicContact CG1-CD1 3.82Å; L153-W168 HydrophobicContact CB-CH2 3.69Å; L153-W168 HydrophobicContact CB-CZ2 3.74Å; L153-W168 HydrophobicContact CB-CZ3 4.21Å; L153-W168 HydrophobicContact CD2-CE3 4.27Å; L153-W168 HydrophobicContact CD2-CH2 4.33Å; L153-W168 HydrophobicContact CD2-CZ3 4.01Å; L153-T198 WeakPolarHBondContact O-CA 3.44Å; L153-L199 HydrophobicContact CB-CB 4.27Å; L153-L199 HydrophobicContact CD2-CD2 4.21Å; L153-L199 PolarHBondContact N-O 2.99Å; L153-L199 PolarHBondContact O-N 2.75Å; L153-F201 HydrophobicContact CD1-CD2 4.07Å; L153-F201 HydrophobicContact CD1-CE2 3.89Å; L153-F201 HydrophobicContact CD2-CE2 4.5Å; L153-Y212 HydrophobicContact CD2-CD1 3.58Å; L153-Y212 HydrophobicContact CD2-CD2 4.35Å; L153-Y212 HydrophobicContact CD2-CE1 4.17Å; L153-Y212 HydrophobicContact CD2-CG 3.67Å; L153-M230 HydrophobicContact CD1-SD 4.21Å
154	R	98.5	Very high	96.7	Very high	128 Å²	128	58.6 Å²	58.6	48%	0.483	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.9	-179.7	-56.8	-177.1	172.5	139.8	3.5	111.6	C139 E140 E152 W168 T198	C139-R154 CarbonylContact C-O 3.59Å; C139-R154 WeakPolarHBondContact CA-O 3.27Å; E140-R154 HydrophobicContact CB-CB 4.12Å; E140-R154 PolarHBondContact N-O 3.09Å; E140-R154 PolarHBondContact O-N 2.03Å; E152-R154 HydrophobicContact CG-CG 4.4Å; E152-R154 IonicContact OE1-CZ 3.06Å; E152-R154 IonicContact OE1-NE 2.65Å; E152-R154 PolarHBondContact OE1-NE 3.02Å; E152-R154 IonicContact OE1-NH2 2.7Å; E152-R154 PolarHBondContact OE1-NH2 2.78Å; R154-W168 VanDerWaalsContact C-CZ2 3.49Å; R154-W168 WeakPolarHBondContact O-CH2 3.25Å; R154-T198 HydrophobicContact CG-CG2 4.42Å
155	C	98.4	Very high	96.8	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	126.3	178.7	-177.2	0	0	0	0	109.1	S138 Y166 W168 G197 C214	S138-C155 VanDerWaalsContact O-CA 3.3Å; S138-C155 WeakPolarHBondContact O-CA 3.34Å; C155-Y166 HydrophobicContact CB-CD1 4.07Å; C155-Y166 WeakPolarHBondContact SG-CD1 3.41Å; C155-W168 HydrophobicContact CB-CH2 4.1Å; C155-W168 HydrophobicContact CB-CZ2 3.54Å; C155-G197 PolarHBondContact N-O 2.84Å; C155-G197 VanDerWaalsContact N-O 3.12Å; C155-C214 HydrophobicContact CB-CB 3.54Å; C155-C214 WeakPolarHBondContact CB-SG 3.42Å; C155-C214 WeakPolarHBondContact SG-CB 3.48Å; C155-C214 CovalentContact SG-SG 2.03Å; C155-C214 PolarHBondContact SG-SG 2.81Å
156	Q	97.8	Very high	96.9	Very high	112 Å²	112	59.6 Å²	59.6	52%	0.523	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	128.4	-178.2	-169.2	176.5	9.7	0	0	111.9	P137 S138	P137-Q156 CarbonylContact C-O 3.53Å; P137-Q156 WeakPolarHBondContact CA-O 3.42Å; S138-Q156 PolarHBondContact N-O 2.85Å; S138-Q156 PolarHBondContact O-N 2.93Å
157	D	98	Very high	97	Very high	13 Å²	13	57.4 Å²	57.4	7%	0.07	32%	0.316	C	S	.	.			trans	-104.7	145	163	171.3	55.7	0	0	0	109.5	P134 A135 P137 E159 G160 P164 Y166 A216	P134-D157 WeakPolarHBondContact CA-OD2 3.26Å; P134-D157 HydrophobicContact CB-CB 4.48Å; P134-D157 WeakPolarHBondContact CB-OD2 3.48Å; A135-D157 PolarHBondContact N-OD1 3.44Å; P137-D157 HydrophobicContact CB-CB 4.25Å; D157-E159 PolarHBondContact OD1-N 2.75Å; D157-G160 VanDerWaalsContact OD2-CA 3.26Å; D157-G160 WeakPolarHBondContact OD2-CA 3.17Å; D157-G160 PolarHBondContact OD2-N 3Å; D157-P164 HydrophobicContact CB-CG 3.92Å; D157-Y166 HydrophobicContact CB-CE1 4.38Å; D157-Y166 PolarHBondContact N-OH 2.91Å; D157-A216 HydrophobicContact CB-CB 4.02Å
158	K	95.8	Very high	97.1	Very high	173 Å²	173	56 Å²	56	75%	0.752	31%	0.306	S	S	*	.	S	Bend	trans	-114.9	-9.4	-179.1	-65.8	-176	-179.2	178.1	0	113.2
159	E	96	Very high	97.3	Very high	97 Å²	97	54.4 Å²	54.4	45%	0.453	28%	0.284	S	S	.	.	S	Bend	trans	-103.7	-29.1	-170.1	-60.2	-63	157.4	0	0	112.8	V132 A135 D157 N161	V132-E159 WeakPolarHBondContact CG1-O 3.41Å; A135-E159 HydrophobicContact CB-CB 3.91Å; A135-E159 HydrophobicContact CB-CG 3.76Å; D157-E159 PolarHBondContact OD1-N 2.75Å; E159-N161 PolarHBondContact O-N 3.27Å
160	G	97.7	Very high	97.4	Very high	13 Å²	13	52.7 Å²	52.7	13%	0.134	27%	0.272	C	S	.	.			trans	-65.1	128.3	-175	0	0	0	0	0	113.2	V132 D157 P162	V132-G160 WeakPolarHBondContact O-CA 3.46Å; D157-G160 VanDerWaalsContact OD2-CA 3.26Å; D157-G160 WeakPolarHBondContact OD2-CA 3.17Å; D157-G160 PolarHBondContact OD2-N 3Å; G160-P162 CarbonylContact C-O 3.51Å; G160-P162 CarbonylContact O-C 3.57Å
161	N	98.1	Very high	97.4	Very high	71 Å²	71	52.1 Å²	52.1	38%	0.38	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-130	119	171.4	-176.1	44.4	0	0	0	109.9	V130 L131 V132 E159	V130-N161 PolarHBondContact O-ND2 2.66Å; L131-N161 CarbonylContact C-O 3.58Å; L131-N161 VanDerWaalsContact CA-O 3.25Å; L131-N161 WeakPolarHBondContact CA-O 3.44Å; V132-N161 HydrophobicContact CB-CB 4.21Å; V132-N161 HydrophobicContact CG2-CB 4.32Å; V132-N161 PolarHBondContact N-O 2.87Å; V132-N161 PolarHBondContact O-N 2.97Å; V132-N161 VanDerWaalsContact O-O 3.1Å; E159-N161 PolarHBondContact O-N 3.27Å
162	P	97.7	Very high	97.2	Very high	55 Å²	55	54.4 Å²	54.4	36%	0.357	29%	0.292	S	S	.	.	S	Bend	cis	-65.1	163.4	1.2	-19.1	34.3	0	0	0	112.4	L131 G160 N218	L131-P162 HydrophobicContact CD2-CG 4.41Å; G160-P162 CarbonylContact C-O 3.51Å; G160-P162 CarbonylContact O-C 3.57Å; P162-N218 WeakPolarHBondContact O-CB 3.33Å; P162-N218 PolarHBondContact O-ND2 2.6Å
163	A	97.5	Very high	97.1	Very high	87 Å²	87	55.8 Å²	55.8	72%	0.719	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-51.8	128.5	177.4	0	0	0	0	0	110.4
164	P	98.4	Very high	96.8	Very high	8 Å²	8	62.9 Å²	62.9	5%	0.052	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-75.5	158.4	-174.1	28	-32.7	0	0	0	113	P134 D157 Y166 A216 R217 N218	P134-P164 HydrophobicContact CB-CB 4.48Å; P134-P164 HydrophobicContact CG-CB 3.91Å; P134-P164 HydrophobicContact CG-CG 4.39Å; D157-P164 HydrophobicContact CB-CG 3.92Å; P164-Y166 HydrophobicContact CG-CE1 4.36Å; P164-A216 HydrophobicContact CB-CB 4.01Å; P164-A216 HydrophobicContact CG-CB 4.09Å; P164-R217 CarbonylContact C-O 3.56Å; P164-R217 WeakPolarHBondContact CA-O 3.37Å; P164-R217 WeakPolarHBondContact CB-O 3.04Å; P164-N218 HydrophobicContact CB-CB 4.39Å
165	E	98.2	Very high	96.6	Very high	97 Å²	97	56.8 Å²	56.8	45%	0.453	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	150.8	163	-62.5	-178.1	167.3	0	0	110.2	T194 K195 A216 R217	E165-T194 CarbonylContact C-O 3.59Å; E165-T194 VanDerWaalsContact CA-O 3.31Å; E165-T194 WeakPolarHBondContact CA-O 3.48Å; E165-K195 HydrophobicContact CG-CD 4.24Å; E165-K195 IonicContact OE1-NZ 2.6Å; E165-K195 PolarHBondContact OE1-NZ 2.79Å; E165-A216 CarbonylContact O-C 3.59Å; E165-A216 WeakPolarHBondContact O-CA 3.26Å; E165-R217 PolarHBondContact N-O 2.97Å; E165-R217 PolarHBondContact O-N 3.06Å
166	Y	98.3	Very high	96.2	Very high	12 Å²	12	59.8 Å²	59.8	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.7	-173.2	-60.2	-79.5	0	0	0	111.5	C155 D157 P164 T194 K195 G197 E215 A216	C155-Y166 HydrophobicContact CB-CD1 4.07Å; C155-Y166 WeakPolarHBondContact SG-CD1 3.41Å; D157-Y166 HydrophobicContact CB-CE1 4.38Å; D157-Y166 PolarHBondContact N-OH 2.91Å; P164-Y166 HydrophobicContact CG-CE1 4.36Å; Y166-T194 WeakPolarHBondContact CD2-O 3.47Å; Y166-T194 PolarHBondContact N-O 2.61Å; Y166-K195 WeakPolarHBondContact CE2-O 3.41Å; Y166-G197 VanDerWaalsContact CD2-CA 3.43Å; Y166-G197 VanDerWaalsContact CD2-N 3.35Å; Y166-E215 CarbonylContact C-O 3.51Å; Y166-E215 VanDerWaalsContact CA-O 3.27Å; Y166-E215 WeakPolarHBondContact CA-O 3.03Å; Y166-A216 HydrophobicContact CD1-CB 3.93Å; Y166-A216 HydrophobicContact CE1-CB 3.73Å
167	T	97.2	Very high	95.7	Very high	20 Å²	20	59.5 Å²	59.5	12%	0.123	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	129	175	-66.5	0	0	0	0	109.5	F169 R174 C214 E215	T167-F169 HydrophobicContact CG2-CD2 4.42Å; T167-F169 HydrophobicContact CG2-CE2 3.66Å; T167-F169 HydrophobicContact CG2-CZ 3.85Å; T167-F169 WeakPolarHBondContact O-CD2 3.47Å; T167-F169 WeakPolarHBondContact O-CE2 3.29Å; T167-R174 HydrophobicContact CG2-CG 3.6Å; T167-R174 VanDerWaalsContact CG2-NE 3.25Å; T167-C214 CarbonylContact O-C 3.58Å; T167-C214 WeakPolarHBondContact O-CA 3.3Å; T167-E215 PolarHBondContact N-O 2.94Å; T167-E215 PolarHBondContact O-N 2.99Å
168	W	97.3	Very high	94.9	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	149.6	177.6	-74.1	92.8	0	0	0	112.8	C139 V141 L153 R154 C155 L175 M192 G197 L199 S213 C214	C139-W168 HydrophobicContact CB-CH2 4.49Å; V141-W168 HydrophobicContact CG2-CH2 4.06Å; V141-W168 HydrophobicContact CG2-CZ3 3.89Å; L153-W168 HydrophobicContact CB-CH2 3.69Å; L153-W168 HydrophobicContact CB-CZ2 3.74Å; L153-W168 HydrophobicContact CB-CZ3 4.21Å; L153-W168 HydrophobicContact CD2-CE3 4.27Å; L153-W168 HydrophobicContact CD2-CH2 4.33Å; L153-W168 HydrophobicContact CD2-CZ3 4.01Å; R154-W168 VanDerWaalsContact C-CZ2 3.49Å; R154-W168 WeakPolarHBondContact O-CH2 3.25Å; C155-W168 HydrophobicContact CB-CH2 4.1Å; C155-W168 HydrophobicContact CB-CZ2 3.54Å; W168-L175 HydrophobicContact CB-CB 4.49Å; W168-L175 HydrophobicContact CB-CD1 4.1Å; W168-L175 PolarHBondContact O-N 2.93Å; W168-M192 HydrophobicContact CB-CE 3.89Å; W168-M192 HydrophobicContact CG-CE 4.46Å; W168-G197 WeakPolarHBondContact CZ2-O 3.38Å; W168-G197 PolarHBondContact NE1-O 3.44Å; W168-L199 HydrophobicContact CB-CD2 3.83Å; W168-L199 HydrophobicContact CD2-CB 4.14Å; W168-L199 HydrophobicContact CD2-CD2 4.04Å; W168-L199 HydrophobicContact CG-CB 3.91Å; W168-L199 HydrophobicContact CG-CD2 3.74Å; W168-L199 HydrophobicContact CG-CG 4.42Å; W168-S213 CarbonylContact C-O 3.57Å; W168-C214 HydrophobicContact CD2-CB 3.78Å; W168-C214 HydrophobicContact CE3-CB 3.71Å; W168-C214 HydrophobicContact CG-CB 4.45Å; W168-C214 HydrophobicContact CH2-CB 3.98Å; W168-C214 HydrophobicContact CZ2-CB 4.07Å; W168-C214 HydrophobicContact CZ3-CB 3.8Å
169	F	96.4	Very high	93.7	Very high	20 Å²	20	57.4 Å²	57.4	9%	0.088	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.8	177.7	-61.2	-101.9	0	0	0	108.8	T167 I173 R174 Y212 S213 E215	T167-F169 HydrophobicContact CG2-CD2 4.42Å; T167-F169 HydrophobicContact CG2-CE2 3.66Å; T167-F169 HydrophobicContact CG2-CZ 3.85Å; T167-F169 WeakPolarHBondContact O-CD2 3.47Å; T167-F169 WeakPolarHBondContact O-CE2 3.29Å; F169-I173 CarbonylContact C-O 3.45Å; F169-I173 WeakPolarHBondContact CA-O 3.44Å; F169-R174 HydrophobicContact CD1-CB 3.91Å; F169-R174 HydrophobicContact CE1-CB 3.66Å; F169-R174 HydrophobicContact CE1-CG 4.08Å; F169-R174 HydrophobicContact CZ-CB 4.36Å; F169-R174 HydrophobicContact CZ-CG 4.29Å; F169-Y212 VanDerWaalsContact O-CA 3.3Å; F169-Y212 WeakPolarHBondContact O-CA 3.44Å; F169-S213 PolarHBondContact N-O 2.77Å; F169-S213 PolarHBondContact O-N 2.76Å; F169-E215 HydrophobicContact CE2-CB 3.76Å
170	K	95.6	Very high	92.4	Very high	17 Å²	17	63.8 Å²	63.8	7%	0.074	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.3	171.2	179.1	-172.9	-174.5	-69.6	0	108	G172 I173 L175 T186 L207 D208 T209 E211 Y212	K170-G172 PolarHBondContact O-N 3.46Å; K170-G172 VanDerWaalsContact O-N 3.15Å; K170-I173 PolarHBondContact N-O 2.77Å; K170-I173 WeakPolarHBondContact O-CB 3.47Å; K170-I173 PolarHBondContact O-N 3.07Å; K170-L175 HydrophobicContact CB-CD1 4.42Å; K170-L175 HydrophobicContact CB-CD2 4.07Å; K170-L175 HydrophobicContact CB-CG 4.36Å; K170-T186 HydrophobicContact CD-CG2 4.11Å; K170-L207 PolarHBondContact NZ-O 2.82Å; K170-D208 WeakPolarHBondContact CE-O 3.42Å; K170-T209 WeakPolarHBondContact CE-O 3.4Å; K170-T209 PolarHBondContact NZ-O 2.81Å; K170-E211 CarbonylContact C-O 3.6Å; K170-E211 WeakPolarHBondContact CA-O 3.42Å; K170-Y212 HydrophobicContact CB-CD1 4.24Å; K170-Y212 HydrophobicContact CB-CE1 3.88Å; K170-Y212 HydrophobicContact CD-CE1 4.24Å; K170-Y212 WeakPolarHBondContact CD-OH 3.17Å; K170-Y212 WeakPolarHBondContact CE-OH 3.28Å; K170-Y212 HydrophobicContact CG-CE1 4Å; K170-Y212 HydrophobicContact CG-CE2 4.28Å
171	D	95.4	Very high	90.7	Very high	83 Å²	83	70.3 Å²	70.3	44%	0.444	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	37.3	179.8	-51	-48.2	0	0	0	112.1	I173 G210 E211	D171-I173 VanDerWaalsContact C-N 3.26Å; D171-I173 PolarHBondContact O-N 2.75Å; D171-G210 VanDerWaalsContact OD1-CA 3.3Å; D171-G210 WeakPolarHBondContact OD1-CA 3.44Å; D171-E211 PolarHBondContact N-O 2.82Å; D171-E211 PolarHBondContact OD1-N 2.88Å
172	G	94.1	Very high	88.5	Confident	61 Å²	61	69.7 Å²	69.7	63%	0.629	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	-8.2	-176.3	0	0	0	0	0	115.7	K170	K170-G172 PolarHBondContact O-N 3.46Å; K170-G172 VanDerWaalsContact O-N 3.15Å
173	I	93.7	Very high	86.4	Confident	104 Å²	104	68.1 Å²	68.1	53%	0.533	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.2	179.7	-57	174.6	0	0	0	109.8	F169 K170 D171 L175	F169-I173 CarbonylContact C-O 3.45Å; F169-I173 WeakPolarHBondContact CA-O 3.44Å; K170-I173 PolarHBondContact N-O 2.77Å; K170-I173 WeakPolarHBondContact O-CB 3.47Å; K170-I173 PolarHBondContact O-N 3.07Å; D171-I173 VanDerWaalsContact C-N 3.26Å; D171-I173 PolarHBondContact O-N 2.75Å; I173-L175 PolarHBondContact O-N 2.9Å
174	R	93.3	Very high	84.7	Confident	148 Å²	148	73.2 Å²	73.2	56%	0.558	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	126.9	177.5	-175.3	178.6	-179.6	-166.8	5	110.8	T167 F169	T167-R174 HydrophobicContact CG2-CG 3.6Å; T167-R174 VanDerWaalsContact CG2-NE 3.25Å; F169-R174 HydrophobicContact CD1-CB 3.91Å; F169-R174 HydrophobicContact CE1-CB 3.66Å; F169-R174 HydrophobicContact CE1-CG 4.08Å; F169-R174 HydrophobicContact CZ-CB 4.36Å; F169-R174 HydrophobicContact CZ-CG 4.29Å
175	L	93.7	Very high	83.1	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-79.1	137.2	169.2	-60.5	-178.9	0	0	0	109.5	W168 K170 I173 S185 T186 Y190 M192 L199 Y212	W168-L175 HydrophobicContact CB-CB 4.49Å; W168-L175 HydrophobicContact CB-CD1 4.1Å; W168-L175 PolarHBondContact O-N 2.93Å; K170-L175 HydrophobicContact CB-CD1 4.42Å; K170-L175 HydrophobicContact CB-CD2 4.07Å; K170-L175 HydrophobicContact CB-CG 4.36Å; I173-L175 PolarHBondContact O-N 2.9Å; L175-S185 WeakPolarHBondContact CD2-OG 3.39Å; L175-T186 HydrophobicContact CD2-CG2 3.96Å; L175-Y190 HydrophobicContact CB-CE2 4.41Å; L175-M192 HydrophobicContact CB-CE 3.71Å; L175-L199 HydrophobicContact CD1-CD1 4.49Å; L175-L199 HydrophobicContact CD1-CD2 3.51Å; L175-Y212 HydrophobicContact CD1-CE1 4.22Å
176	L	90.2	Very high	81.5	Confident	64 Å²	64	70.1 Å²	70.1	34%	0.335	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-84.2	140.8	-179.2	-61.8	178.3	0	0	0	109.7	N178 Y190	L176-N178 PolarHBondContact O-N 3.15Å; L176-Y190 PolarHBondContact N-OH 2.77Å; L176-Y190 VanDerWaalsContact N-OH 3.16Å; L176-Y190 WeakPolarHBondContact O-CE2 3.27Å; L176-Y190 PolarHBondContact O-OH 3.45Å
177	E	86.6	Confident	80.1	Confident	106 Å²	106	75.7 Å²	75.7	50%	0.495	40%	0.398	S	S	.	.	S	Bend	trans	-56.9	-39.7	177.7	-175.2	169.3	-151.2	0	0	112	P179 T194	E177-P179 WeakPolarHBondContact O-CD 3.36Å; E177-T194 HydrophobicContact CB-CG2 4.49Å; E177-T194 HydrophobicContact CG-CG2 4.07Å; E177-T194 VanDerWaalsContact OE1-CG2 3.24Å; E177-T194 WeakPolarHBondContact OE1-CG2 3.5Å; E177-T194 PolarHBondContact OE1-OG1 2.9Å
178	N	80.8	Confident	79.1	Confident	110 Å²	110	75.2 Å²	75.2	59%	0.588	40%	0.396	S	S	*	.	S	Bend	trans	-108	102.4	171.9	-81.7	-19.6	0	0	0	111	L176 R180 L181	L176-N178 PolarHBondContact O-N 3.15Å; N178-R180 PolarHBondContact O-N 3.42Å; N178-L181 WeakPolarHBondContact O-CB 3.45Å; N178-L181 PolarHBondContact O-N 3.35Å; N178-L181 VanDerWaalsContact O-N 3.09Å
179	P	71.4	Confident	78.6	Confident	32 Å²	32	77.5 Å²	77.5	21%	0.208	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-62.4	-25.8	179.1	17.4	-27.2	0	0	0	113.5	E177 L181 G182 S183 Y190	E177-P179 WeakPolarHBondContact O-CD 3.36Å; P179-L181 PolarHBondContact O-N 2.82Å; P179-G182 PolarHBondContact O-N 2.66Å; P179-S183 PolarHBondContact O-N 3.02Å; P179-Y190 HydrophobicContact CB-CD1 4.28Å; P179-Y190 HydrophobicContact CB-CE1 3.74Å; P179-Y190 HydrophobicContact CB-CE2 4.36Å; P179-Y190 HydrophobicContact CG-CD1 4.37Å; P179-Y190 HydrophobicContact CG-CD2 4.34Å; P179-Y190 HydrophobicContact CG-CE1 4.21Å; P179-Y190 HydrophobicContact CG-CE2 4.2Å; P179-Y190 HydrophobicContact CG-CG 4.44Å; P179-Y190 WeakPolarHBondContact CG-O 3.29Å
180	R	68.7	Low	78.4	Confident	231 Å²	231	76.7 Å²	76.7	87%	0.872	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-55.7	-20.7	174.5	-59.9	-67.9	-165.7	-146.2	-0.9	113.4	N178	N178-R180 PolarHBondContact O-N 3.42Å
181	L	61.7	Low	78.3	Confident	149 Å²	149	79.9 Å²	79.9	78%	0.78	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-89.4	3.8	-173.8	-137.7	78.2	0	0	0	114.4	N178 P179	N178-L181 WeakPolarHBondContact O-CB 3.45Å; N178-L181 PolarHBondContact O-N 3.35Å; N178-L181 VanDerWaalsContact O-N 3.09Å; P179-L181 PolarHBondContact O-N 2.82Å
182	G	53	Low	78.2	Confident	59 Å²	59	76.7 Å²	76.7	61%	0.608	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.1	27.1	170.3	0	0	0	0	0	116.7	P179 Q184	P179-G182 PolarHBondContact O-N 2.66Å; G182-Q184 PolarHBondContact O-N 3.5Å
183	S	53.5	Low	78.3	Confident	21 Å²	21	77 Å²	77	15%	0.147	40%	0.398	C	S	.	.			trans	-82.2	103.1	176.4	-177.4	0	0	0	0	110.4	P179 S185 Y190	P179-S183 PolarHBondContact O-N 3.02Å; S183-S185 PolarHBondContact OG-OG 3.11Å; S183-Y190 PolarHBondContact OG-OH 3.11Å
184	Q	61.2	Low	78.4	Confident	194 Å²	194	73 Å²	73	91%	0.907	38%	0.38	S	S	*	.			trans	-81	1.1	168	-69.6	-159.9	64.7	0	0	113.1	G182 T186	G182-Q184 PolarHBondContact O-N 3.5Å; Q184-T186 VanDerWaalsContact C-N 3.3Å; Q184-T186 PolarHBondContact O-N 2.84Å
185	S	65.5	Low	78.6	Confident	29 Å²	29	72.2 Å²	72.2	20%	0.203	38%	0.38	C	S	.	.	S	Bend	trans	-77.6	-15	-173.5	52.8	0	0	0	0	114	L175 S183	L175-S185 WeakPolarHBondContact CD2-OG 3.39Å; S183-S185 PolarHBondContact OG-OG 3.11Å
186	T	64.4	Low	78.7	Confident	12 Å²	12	75.9 Å²	75.9	7%	0.074	40%	0.403	C	S	.	.			trans	-140	140.3	176.5	62.4	0	0	0	0	108.9	K170 L175 Q184 S188 Y190 F201 D208	K170-T186 HydrophobicContact CD-CG2 4.11Å; L175-T186 HydrophobicContact CD2-CG2 3.96Å; Q184-T186 VanDerWaalsContact C-N 3.3Å; Q184-T186 PolarHBondContact O-N 2.84Å; T186-S188 VanDerWaalsContact C-N 3.31Å; T186-S188 PolarHBondContact OG1-O 2.93Å; T186-Y190 HydrophobicContact CG2-CD1 4.4Å; T186-Y190 HydrophobicContact CG2-CE1 4.23Å; T186-Y190 WeakPolarHBondContact OG1-CD1 3.33Å; T186-Y190 WeakPolarHBondContact OG1-CE1 3.44Å; T186-F201 HydrophobicContact CG2-CE1 4.16Å; T186-D208 VanDerWaalsContact CB-OD1 3.31Å; T186-D208 WeakPolarHBondContact CB-OD1 3.38Å
187	N	69.4	Low	79.1	Confident	129 Å²	129	72.9 Å²	72.9	69%	0.69	39%	0.387	S	S	*	.	S	Bend	trans	-84.7	-12.2	171.9	-89.2	-11.8	0	0	0	112.8	L207	N187-L207 HydrophobicContact CB-CD1 4.44Å; N187-L207 WeakPolarHBondContact ND2-CD1 3.3Å
188	S	75.8	Confident	79.6	Confident	10 Å²	10	69.5 Å²	69.5	7%	0.07	37%	0.373	C	S	.	.	S	Bend	trans	-91.5	146	-176.1	-63.1	0	0	0	0	112.1	T186 Y190 T203 S205 D208	T186-S188 VanDerWaalsContact C-N 3.31Å; T186-S188 PolarHBondContact OG1-O 2.93Å; S188-Y190 PolarHBondContact O-N 3.29Å; S188-T203 WeakPolarHBondContact CB-O 3.32Å; S188-T203 PolarHBondContact OG-O 2.76Å; S188-S205 PolarHBondContact OG-N 3.03Å; S188-S205 PolarHBondContact OG-OG 2.79Å; S188-D208 VanDerWaalsContact CB-OD2 3.25Å; S188-D208 WeakPolarHBondContact CB-OD2 3.48Å; S188-D208 PolarHBondContact OG-OD2 2.9Å
189	S	86.9	Confident	80.4	Confident	48 Å²	48	64.2 Å²	64.2	34%	0.336	35%	0.345	S	S	.	.			trans	-70.8	121.5	167.5	-177.1	0	0	0	0	109.1	N202	S189-N202 PolarHBondContact O-N 3.29Å; S189-N202 VanDerWaalsContact O-N 3.08Å
190	Y	92	Very high	81.5	Confident	3 Å²	3	66 Å²	66	1%	0.012	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	159	171.8	64.4	-94.1	0	0	0	111.5	L175 L176 P179 S183 T186 S188 M192 L199 Q200 F201	L175-Y190 HydrophobicContact CB-CE2 4.41Å; L176-Y190 PolarHBondContact N-OH 2.77Å; L176-Y190 VanDerWaalsContact N-OH 3.16Å; L176-Y190 WeakPolarHBondContact O-CE2 3.27Å; L176-Y190 PolarHBondContact O-OH 3.45Å; P179-Y190 HydrophobicContact CB-CD1 4.28Å; P179-Y190 HydrophobicContact CB-CE1 3.74Å; P179-Y190 HydrophobicContact CB-CE2 4.36Å; P179-Y190 HydrophobicContact CG-CD1 4.37Å; P179-Y190 HydrophobicContact CG-CD2 4.34Å; P179-Y190 HydrophobicContact CG-CE1 4.21Å; P179-Y190 HydrophobicContact CG-CE2 4.2Å; P179-Y190 HydrophobicContact CG-CG 4.44Å; P179-Y190 WeakPolarHBondContact CG-O 3.29Å; S183-Y190 PolarHBondContact OG-OH 3.11Å; T186-Y190 HydrophobicContact CG2-CD1 4.4Å; T186-Y190 HydrophobicContact CG2-CE1 4.23Å; T186-Y190 WeakPolarHBondContact OG1-CD1 3.33Å; T186-Y190 WeakPolarHBondContact OG1-CE1 3.44Å; S188-Y190 PolarHBondContact O-N 3.29Å; Y190-M192 HydrophobicContact CE2-CE 4.25Å; Y190-L199 HydrophobicContact CD2-CD1 3.36Å; Y190-L199 HydrophobicContact CE2-CD1 4.06Å; Y190-L199 HydrophobicContact CG-CD1 3.84Å; Y190-Q200 CarbonylContact C-O 3.58Å; Y190-Q200 WeakPolarHBondContact CA-O 3.41Å; Y190-Q200 WeakPolarHBondContact CB-O 3.24Å; Y190-F201 HydrophobicContact CD1-CE1 4.43Å
191	T	92.8	Very high	82.8	Confident	84 Å²	84	55 Å²	55	52%	0.515	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.1	170.1	-57.9	0	0	0	0	108.3	Q200	T191-Q200 PolarHBondContact N-O 3.38Å; T191-Q200 PolarHBondContact O-N 2.98Å
192	M	94	Very high	84.1	Confident	15 Å²	15	51 Å²	51	7%	0.074	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.1	177.8	-169.7	-176.3	-56.9	0	0	109.5	W168 L175 Y190 T194 T198 L199	W168-M192 HydrophobicContact CB-CE 3.89Å; W168-M192 HydrophobicContact CG-CE 4.46Å; L175-M192 HydrophobicContact CB-CE 3.71Å; Y190-M192 HydrophobicContact CE2-CE 4.25Å; M192-T194 HydrophobicContact SD-CG2 4.26Å; M192-T198 WeakPolarHBondContact CA-O 3.36Å; M192-L199 HydrophobicContact CB-CD1 4.33Å; M192-L199 HydrophobicContact CE-CD1 4.17Å
193	N	95.8	Very high	85.9	Confident	67 Å²	67	52 Å²	52	36%	0.358	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	106.3	167.7	-177.2	-33	0	0	0	108.5	K195 T196 G197 T198	N193-K195 PolarHBondContact O-N 2.92Å; N193-K195 WeakPolarHBondContact OD1-CB 3.43Å; N193-K195 PolarHBondContact OD1-N 2.83Å; N193-T196 VanDerWaalsContact CB-OG1 3.23Å; N193-T196 WeakPolarHBondContact CB-OG1 3.38Å; N193-T196 PolarHBondContact ND2-OG1 2.85Å; N193-T196 PolarHBondContact O-N 3.31Å; N193-T196 PolarHBondContact OD1-N 2.76Å; N193-T196 PolarHBondContact OD1-OG1 2.84Å; N193-G197 WeakPolarHBondContact O-CA 3.29Å; N193-G197 PolarHBondContact O-N 3.33Å; N193-T198 WeakPolarHBondContact CB-OG1 3.34Å; N193-T198 PolarHBondContact N-O 2.83Å; N193-T198 PolarHBondContact O-N 3.17Å
194	T	96.6	Very high	87.9	Confident	22 Å²	22	51.1 Å²	51.1	14%	0.135	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.5	-177.2	51.1	0	0	0	0	113.1	E165 Y166 E177 M192	E165-T194 CarbonylContact C-O 3.59Å; E165-T194 VanDerWaalsContact CA-O 3.31Å; E165-T194 WeakPolarHBondContact CA-O 3.48Å; Y166-T194 WeakPolarHBondContact CD2-O 3.47Å; Y166-T194 PolarHBondContact N-O 2.61Å; E177-T194 HydrophobicContact CB-CG2 4.49Å; E177-T194 HydrophobicContact CG-CG2 4.07Å; E177-T194 VanDerWaalsContact OE1-CG2 3.24Å; E177-T194 WeakPolarHBondContact OE1-CG2 3.5Å; E177-T194 PolarHBondContact OE1-OG1 2.9Å; M192-T194 HydrophobicContact SD-CG2 4.26Å
195	K	96.5	Very high	89.3	Confident	131 Å²	131	43.2 Å²	43.2	57%	0.57	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-37.8	177.6	-58.8	-58.6	-172.4	179	0	113	E165 Y166 N193	E165-K195 HydrophobicContact CG-CD 4.24Å; E165-K195 IonicContact OE1-NZ 2.6Å; E165-K195 PolarHBondContact OE1-NZ 2.79Å; Y166-K195 WeakPolarHBondContact CE2-O 3.41Å; N193-K195 PolarHBondContact O-N 2.92Å; N193-K195 WeakPolarHBondContact OD1-CB 3.43Å; N193-K195 PolarHBondContact OD1-N 2.83Å
196	T	96.6	Very high	90.6	Very high	78 Å²	78	47.8 Å²	47.8	48%	0.479	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-14.2	178.6	60	0	0	0	0	113	N193 T198	N193-T196 VanDerWaalsContact CB-OG1 3.23Å; N193-T196 WeakPolarHBondContact CB-OG1 3.38Å; N193-T196 PolarHBondContact ND2-OG1 2.85Å; N193-T196 PolarHBondContact O-N 3.31Å; N193-T196 PolarHBondContact OD1-N 2.76Å; N193-T196 PolarHBondContact OD1-OG1 2.84Å; T196-T198 VanDerWaalsContact C-N 3.29Å; T196-T198 PolarHBondContact O-N 2.64Å; T196-T198 PolarHBondContact OG1-OG1 3.23Å
197	G	97.6	Very high	91.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	15.8	-177.6	0	0	0	0	0	114.2	C155 Y166 W168 N193	C155-G197 PolarHBondContact N-O 2.84Å; C155-G197 VanDerWaalsContact N-O 3.12Å; Y166-G197 VanDerWaalsContact CD2-CA 3.43Å; Y166-G197 VanDerWaalsContact CD2-N 3.35Å; W168-G197 WeakPolarHBondContact CZ2-O 3.38Å; W168-G197 PolarHBondContact NE1-O 3.44Å; N193-G197 WeakPolarHBondContact O-CA 3.29Å; N193-G197 PolarHBondContact O-N 3.33Å
198	T	97.7	Very high	93	Very high	35 Å²	35	46.4 Å²	46.4	22%	0.215	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.7	-179.1	57.7	0	0	0	0	111.4	L153 R154 M192 N193 T196	L153-T198 WeakPolarHBondContact O-CA 3.44Å; R154-T198 HydrophobicContact CG-CG2 4.42Å; M192-T198 WeakPolarHBondContact CA-O 3.36Å; N193-T198 WeakPolarHBondContact CB-OG1 3.34Å; N193-T198 PolarHBondContact N-O 2.83Å; N193-T198 PolarHBondContact O-N 3.17Å; T196-T198 VanDerWaalsContact C-N 3.29Å; T196-T198 PolarHBondContact O-N 2.64Å; T196-T198 PolarHBondContact OG1-OG1 3.23Å
199	L	96.8	Very high	94	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	113.5	169.2	169.9	65.7	0	0	0	108.5	L153 W168 L175 Y190 M192 F201 Y212	L153-L199 HydrophobicContact CB-CB 4.27Å; L153-L199 HydrophobicContact CD2-CD2 4.21Å; L153-L199 PolarHBondContact N-O 2.99Å; L153-L199 PolarHBondContact O-N 2.75Å; W168-L199 HydrophobicContact CB-CD2 3.83Å; W168-L199 HydrophobicContact CD2-CB 4.14Å; W168-L199 HydrophobicContact CD2-CD2 4.04Å; W168-L199 HydrophobicContact CG-CB 3.91Å; W168-L199 HydrophobicContact CG-CD2 3.74Å; W168-L199 HydrophobicContact CG-CG 4.42Å; L175-L199 HydrophobicContact CD1-CD1 4.49Å; L175-L199 HydrophobicContact CD1-CD2 3.51Å; Y190-L199 HydrophobicContact CD2-CD1 3.36Å; Y190-L199 HydrophobicContact CE2-CD1 4.06Å; Y190-L199 HydrophobicContact CG-CD1 3.84Å; M192-L199 HydrophobicContact CB-CD1 4.33Å; M192-L199 HydrophobicContact CE-CD1 4.17Å; L199-F201 HydrophobicContact CD2-CE2 4.05Å; L199-F201 HydrophobicContact CD2-CZ 4.19Å; L199-F201 HydrophobicContact CG-CE2 4.09Å; L199-F201 HydrophobicContact CG-CZ 4.46Å; L199-Y212 HydrophobicContact CD2-CD1 4.43Å; L199-Y212 HydrophobicContact CD2-CE1 4.41Å
200	Q	95.6	Very high	94.4	Very high	68 Å²	68	45.4 Å²	45.4	32%	0.318	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122	-175.3	-175.2	-178.7	-16.6	0	0	110.8	V150 V151 Y190 T191	V150-Q200 HydrophobicContact CG1-CG 4.14Å; V151-Q200 CarbonylContact O-C 3.58Å; V151-Q200 WeakPolarHBondContact O-CA 3.29Å; Y190-Q200 CarbonylContact C-O 3.58Å; Y190-Q200 WeakPolarHBondContact CA-O 3.41Å; Y190-Q200 WeakPolarHBondContact CB-O 3.24Å; T191-Q200 PolarHBondContact N-O 3.38Å; T191-Q200 PolarHBondContact O-N 2.98Å
201	F	94.4	Very high	94.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	124.8	168.8	-64.6	-89	0	0	0	109.2	V150 V151 L153 T186 Y190 L199 V204 D208 Y212 M230	V150-F201 WeakPolarHBondContact CA-O 3.2Å; V150-F201 WeakPolarHBondContact CG1-O 3.44Å; V151-F201 HydrophobicContact CB-CB 4.46Å; V151-F201 PolarHBondContact N-O 3.41Å; V151-F201 VanDerWaalsContact N-O 3.11Å; V151-F201 PolarHBondContact O-N 3.19Å; L153-F201 HydrophobicContact CD1-CD2 4.07Å; L153-F201 HydrophobicContact CD1-CE2 3.89Å; L153-F201 HydrophobicContact CD2-CE2 4.5Å; T186-F201 HydrophobicContact CG2-CE1 4.16Å; Y190-F201 HydrophobicContact CD1-CE1 4.43Å; L199-F201 HydrophobicContact CD2-CE2 4.05Å; L199-F201 HydrophobicContact CD2-CZ 4.19Å; L199-F201 HydrophobicContact CG-CE2 4.09Å; L199-F201 HydrophobicContact CG-CZ 4.46Å; F201-V204 HydrophobicContact CB-CB 4.32Å; F201-D208 HydrophobicContact CE1-CB 4.37Å; F201-Y212 HydrophobicContact CE2-CE1 4.26Å; F201-Y212 AromaticContact CZ-CE1 3.88Å; F201-Y212 HydrophobicContact CZ-CE1 3.88Å; F201-M230 HydrophobicContact CE2-CE 4.3Å
202	N	90.7	Very high	94.9	Very high	66 Å²	66	46.1 Å²	46.1	35%	0.353	24%	0.241	S	C	.	.	S	Bend	trans	-74.1	-39.2	177.6	-69.6	-21.5	0	0	0	111.7	V150 S189	V150-N202 VanDerWaalsContact CG2-O 3.32Å; V150-N202 WeakPolarHBondContact CG2-O 3.41Å; S189-N202 PolarHBondContact O-N 3.29Å; S189-N202 VanDerWaalsContact O-N 3.08Å
203	T	90.8	Very high	95.1	Very high	79 Å²	79	46.1 Å²	46.1	49%	0.485	24%	0.243	S	C	.	.	S	Bend	trans	-141.9	104.5	174	51.4	0	0	0	0	107.3	S188	S188-T203 WeakPolarHBondContact CB-O 3.32Å; S188-T203 PolarHBondContact OG-O 2.76Å
204	V	93.9	Very high	95.2	Very high	3 Å²	3	43 Å²	43	2%	0.018	23%	0.226	C	C	.	.			trans	-75.3	149.5	178.9	74.9	0	0	0	0	110.9	A145 L146 S147 G148 T149 V151 F201 D208 M230 V232	A145-V204 HydrophobicContact CB-CG1 4.24Å; L146-V204 WeakPolarHBondContact O-CG1 3.24Å; S147-V204 CarbonylContact C-O 3.57Å; S147-V204 WeakPolarHBondContact CA-O 3.31Å; G148-V204 PolarHBondContact N-O 2.83Å; T149-V204 PolarHBondContact O-N 2.02Å; V151-V204 HydrophobicContact CG2-CB 4.11Å; V151-V204 HydrophobicContact CG2-CG1 3.87Å; F201-V204 HydrophobicContact CB-CB 4.32Å; V204-D208 HydrophobicContact CG2-CB 3.84Å; V204-M230 HydrophobicContact CG2-CE 4.16Å; V204-V232 HydrophobicContact CB-CG1 4.48Å; V204-V232 HydrophobicContact CG1-CG1 3.84Å; V204-V232 HydrophobicContact CG2-CB 4.43Å; V204-V232 HydrophobicContact CG2-CG1 4.01Å; V204-V232 HydrophobicContact CG2-CG2 3.57Å
205	S	92.2	Very high	95.3	Very high	29 Å²	29	42.5 Å²	42.5	20%	0.203	22%	0.222	C	C	.	.			trans	-128.4	161.2	177.8	74.7	0	0	0	0	111.1	S188 L207 D208 V232	S188-S205 PolarHBondContact OG-N 3.03Å; S188-S205 PolarHBondContact OG-OG 2.79Å; S205-L207 PolarHBondContact O-N 2.84Å; S205-D208 PolarHBondContact N-OD2 2.76Å; S205-D208 WeakPolarHBondContact O-CB 3.48Å; S205-D208 PolarHBondContact O-N 2.65Å; S205-D208 PolarHBondContact OG-OD2 2.92Å; S205-V232 VanDerWaalsContact C-CG1 3.49Å; S205-V232 WeakPolarHBondContact O-CB 3.41Å; S205-V232 WeakPolarHBondContact O-CG1 3.33Å
206	K	92.5	Very high	95.4	Very high	124 Å²	124	36.3 Å²	36.3	54%	0.539	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-50.7	-33	176.7	-173.3	166.9	-176.3	174.5	0	114.2	S147 D208 T209 D234	S147-K206 PolarHBondContact OG-N 2.95Å; K206-D208 VanDerWaalsContact C-N 3.26Å; K206-D208 PolarHBondContact O-N 2.82Å; K206-T209 WeakPolarHBondContact O-CB 3.27Å; K206-T209 PolarHBondContact O-N 2.86Å; K206-T209 PolarHBondContact O-OG1 3.1Å; K206-D234 WeakPolarHBondContact CD-OD2 3.49Å
207	L	91.2	Very high	95.5	Very high	112 Å²	112	37.8 Å²	37.8	59%	0.586	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-72.7	-16.8	179.4	-66.7	169.6	0	0	0	113.5	K170 N187 S205 T209	K170-L207 PolarHBondContact NZ-O 2.82Å; N187-L207 HydrophobicContact CB-CD1 4.44Å; N187-L207 WeakPolarHBondContact ND2-CD1 3.3Å; S205-L207 PolarHBondContact O-N 2.84Å; L207-T209 PolarHBondContact O-N 2.84Å
208	D	93.1	Very high	95.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-79.2	-2.3	172.7	-52.8	-53.1	0	0	0	112	K170 T186 S188 F201 V204 S205 K206 G210 Y212 M230 V232	K170-D208 WeakPolarHBondContact CE-O 3.42Å; T186-D208 VanDerWaalsContact CB-OD1 3.31Å; T186-D208 WeakPolarHBondContact CB-OD1 3.38Å; S188-D208 VanDerWaalsContact CB-OD2 3.25Å; S188-D208 WeakPolarHBondContact CB-OD2 3.48Å; S188-D208 PolarHBondContact OG-OD2 2.9Å; F201-D208 HydrophobicContact CE1-CB 4.37Å; V204-D208 HydrophobicContact CG2-CB 3.84Å; S205-D208 PolarHBondContact N-OD2 2.76Å; S205-D208 WeakPolarHBondContact O-CB 3.48Å; S205-D208 PolarHBondContact O-N 2.65Å; S205-D208 PolarHBondContact OG-OD2 2.92Å; K206-D208 VanDerWaalsContact C-N 3.26Å; K206-D208 PolarHBondContact O-N 2.82Å; D208-G210 PolarHBondContact O-N 3.01Å; D208-Y212 WeakPolarHBondContact O-CE2 3.42Å; D208-Y212 PolarHBondContact O-OH 3.37Å; D208-M230 HydrophobicContact CB-CE 4.41Å; D208-V232 HydrophobicContact CB-CG2 4.49Å
209	T	95.5	Very high	95.5	Very high	33 Å²	33	41.7 Å²	41.7	20%	0.202	22%	0.219	C	C	.	.			trans	-55.7	132	165.6	-63.9	0	0	0	0	109.9	K170 K206 L207 M230 V232	K170-T209 WeakPolarHBondContact CE-O 3.4Å; K170-T209 PolarHBondContact NZ-O 2.81Å; K206-T209 WeakPolarHBondContact O-CB 3.27Å; K206-T209 PolarHBondContact O-N 2.86Å; K206-T209 PolarHBondContact O-OG1 3.1Å; L207-T209 PolarHBondContact O-N 2.84Å; T209-M230 WeakPolarHBondContact CA-O 3.49Å; T209-V232 PolarHBondContact OG1-N 3.04Å
210	G	95.6	Very high	95.5	Very high	5 Å²	5	43.8 Å²	43.8	5%	0.052	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.5	-179.8	-178.9	0	0	0	0	0	113.2	D171 D208 R229 M230	D171-G210 VanDerWaalsContact OD1-CA 3.3Å; D171-G210 WeakPolarHBondContact OD1-CA 3.44Å; D208-G210 PolarHBondContact O-N 3.01Å; G210-R229 WeakPolarHBondContact O-CA 3.49Å; G210-M230 PolarHBondContact N-O 3.46Å; G210-M230 VanDerWaalsContact N-O 3.08Å; G210-M230 PolarHBondContact O-N 2.96Å
211	E	97.8	Very high	95.7	Very high	101 Å²	101	41.4 Å²	41.4	47%	0.472	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.7	173.7	-173.5	175.6	-149.1	0	0	110.5	K170 D171 G227	K170-E211 CarbonylContact C-O 3.6Å; K170-E211 WeakPolarHBondContact CA-O 3.42Å; D171-E211 PolarHBondContact N-O 2.82Å; D171-E211 PolarHBondContact OD1-N 2.88Å; E211-G227 WeakPolarHBondContact OE1-CA 3.27Å
212	Y	97.9	Very high	95.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.4	-179	-70.8	-95.4	0	0	0	111.1	V141 L153 F169 K170 L175 L199 F201 D208 G227 K228 M230	V141-Y212 HydrophobicContact CG1-CD2 4.4Å; L153-Y212 HydrophobicContact CD2-CD1 3.58Å; L153-Y212 HydrophobicContact CD2-CD2 4.35Å; L153-Y212 HydrophobicContact CD2-CE1 4.17Å; L153-Y212 HydrophobicContact CD2-CG 3.67Å; F169-Y212 VanDerWaalsContact O-CA 3.3Å; F169-Y212 WeakPolarHBondContact O-CA 3.44Å; K170-Y212 HydrophobicContact CB-CD1 4.24Å; K170-Y212 HydrophobicContact CB-CE1 3.88Å; K170-Y212 HydrophobicContact CD-CE1 4.24Å; K170-Y212 WeakPolarHBondContact CD-OH 3.17Å; K170-Y212 WeakPolarHBondContact CE-OH 3.28Å; K170-Y212 HydrophobicContact CG-CE1 4Å; K170-Y212 HydrophobicContact CG-CE2 4.28Å; L175-Y212 HydrophobicContact CD1-CE1 4.22Å; L199-Y212 HydrophobicContact CD2-CD1 4.43Å; L199-Y212 HydrophobicContact CD2-CE1 4.41Å; F201-Y212 HydrophobicContact CE2-CE1 4.26Å; F201-Y212 AromaticContact CZ-CE1 3.88Å; F201-Y212 HydrophobicContact CZ-CE1 3.88Å; D208-Y212 WeakPolarHBondContact O-CE2 3.42Å; D208-Y212 PolarHBondContact O-OH 3.37Å; Y212-G227 CarbonylContact O-C 3.43Å; Y212-G227 WeakPolarHBondContact O-CA 3.31Å; Y212-K228 PolarHBondContact N-O 2.79Å; Y212-K228 PolarHBondContact O-N 3.14Å; Y212-M230 HydrophobicContact CD2-CB 3.99Å; Y212-M230 HydrophobicContact CD2-CE 4.46Å; Y212-M230 HydrophobicContact CE2-CB 4.02Å; Y212-M230 HydrophobicContact CE2-CE 3.63Å
213	S	98.2	Very high	96.2	Very high	16 Å²	16	50.1 Å²	50.1	11%	0.112	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	155	169.6	58.3	0	0	0	0	109.9	W168 F169	W168-S213 CarbonylContact C-O 3.57Å; F169-S213 PolarHBondContact N-O 2.77Å; F169-S213 PolarHBondContact O-N 2.76Å
214	C	98.4	Very high	96.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.6	176.1	162.6	0	0	0	0	110.1	C155 T167 W168 R224 C225	C155-C214 HydrophobicContact CB-CB 3.54Å; C155-C214 WeakPolarHBondContact CB-SG 3.42Å; C155-C214 WeakPolarHBondContact SG-CB 3.48Å; C155-C214 CovalentContact SG-SG 2.03Å; C155-C214 PolarHBondContact SG-SG 2.81Å; T167-C214 CarbonylContact O-C 3.58Å; T167-C214 WeakPolarHBondContact O-CA 3.3Å; W168-C214 HydrophobicContact CD2-CB 3.78Å; W168-C214 HydrophobicContact CE3-CB 3.71Å; W168-C214 HydrophobicContact CG-CB 4.45Å; W168-C214 HydrophobicContact CH2-CB 3.98Å; W168-C214 HydrophobicContact CZ2-CB 4.07Å; W168-C214 HydrophobicContact CZ3-CB 3.8Å; C214-R224 WeakPolarHBondContact O-CA 3.21Å; C214-R224 WeakPolarHBondContact O-CG 3.45Å; C214-C225 PolarHBondContact N-SG 2.93Å; C214-C225 PolarHBondContact O-N 3.48Å
215	E	98.5	Very high	96.8	Very high	13 Å²	13	51.8 Å²	51.8	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.3	172	-179.6	177	115.7	0	0	109.9	Y166 T167 F169 R217 Y222 R223 R224	Y166-E215 CarbonylContact C-O 3.51Å; Y166-E215 VanDerWaalsContact CA-O 3.27Å; Y166-E215 WeakPolarHBondContact CA-O 3.03Å; T167-E215 PolarHBondContact N-O 2.94Å; T167-E215 PolarHBondContact O-N 2.99Å; F169-E215 HydrophobicContact CE2-CB 3.76Å; E215-R217 IonicContact OE1-CZ 3.3Å; E215-R217 VanDerWaalsContact OE1-CZ 3.3Å; E215-R217 IonicContact OE1-NE 2.99Å; E215-R217 PolarHBondContact OE1-NE 3.09Å; E215-R217 IonicContact OE1-NH2 2.92Å; E215-R217 PolarHBondContact OE1-NH2 3.35Å; E215-Y222 HydrophobicContact CG-CD2 4.06Å; E215-R223 CarbonylContact C-O 3.59Å; E215-R223 WeakPolarHBondContact CA-O 3.37Å; E215-R224 HydrophobicContact CB-CB 4.42Å; E215-R224 HydrophobicContact CB-CG 4.48Å; E215-R224 IonicContact OE2-CZ 3.48Å; E215-R224 IonicContact OE2-NE 3.71Å; E215-R224 IonicContact OE2-NH2 2.66Å; E215-R224 PolarHBondContact OE2-NH2 2.65Å
216	A	98.7	Very high	97	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.7	165.8	0	0	0	0	0	109	P134 P137 D157 P164 E165 Y166 Y222 R223	P134-A216 HydrophobicContact CB-CB 3.93Å; P134-A216 HydrophobicContact CG-CB 4.45Å; P137-A216 HydrophobicContact CB-CB 4.12Å; P137-A216 HydrophobicContact CG-CB 4.01Å; D157-A216 HydrophobicContact CB-CB 4.02Å; P164-A216 HydrophobicContact CB-CB 4.01Å; P164-A216 HydrophobicContact CG-CB 4.09Å; E165-A216 CarbonylContact O-C 3.59Å; E165-A216 WeakPolarHBondContact O-CA 3.26Å; Y166-A216 HydrophobicContact CD1-CB 3.93Å; Y166-A216 HydrophobicContact CE1-CB 3.73Å; A216-Y222 CarbonylContact O-C 3.58Å; A216-Y222 WeakPolarHBondContact O-CA 3.01Å; A216-Y222 WeakPolarHBondContact O-CB 3.33Å; A216-R223 PolarHBondContact N-O 2.97Å; A216-R223 PolarHBondContact O-N 3.42Å
217	R	98.4	Very high	97.3	Very high	110 Å²	110	50.6 Å²	50.6	42%	0.415	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.1	-175.7	173.9	176.3	-66.7	-84	-2.5	111.9	P164 E165 E215 G221 Y222	P164-R217 CarbonylContact C-O 3.56Å; P164-R217 WeakPolarHBondContact CA-O 3.37Å; P164-R217 WeakPolarHBondContact CB-O 3.04Å; E165-R217 PolarHBondContact N-O 2.97Å; E165-R217 PolarHBondContact O-N 3.06Å; E215-R217 IonicContact OE1-CZ 3.3Å; E215-R217 VanDerWaalsContact OE1-CZ 3.3Å; E215-R217 IonicContact OE1-NE 2.99Å; E215-R217 PolarHBondContact OE1-NE 3.09Å; E215-R217 IonicContact OE1-NH2 2.92Å; E215-R217 PolarHBondContact OE1-NH2 3.35Å; R217-G221 WeakPolarHBondContact CA-O 3.46Å; R217-Y222 VanDerWaalsContact NH2-CD1 3.26Å
218	N	98.2	Very high	97.6	Very high	22 Å²	22	49.6 Å²	49.6	12%	0.118	25%	0.252	C	S	.	.			trans	-134.1	-168.7	166.7	72.5	10.5	0	0	0	111	V132 P134 P162 P164 V220 G221	V132-N218 PolarHBondContact O-ND2 3.16Å; P134-N218 WeakPolarHBondContact CD-OD1 3.18Å; P134-N218 HydrophobicContact CG-CB 4.4Å; P162-N218 WeakPolarHBondContact O-CB 3.33Å; P162-N218 PolarHBondContact O-ND2 2.6Å; P164-N218 HydrophobicContact CB-CB 4.39Å; N218-V220 PolarHBondContact O-N 2.94Å; N218-V220 WeakPolarHBondContact OD1-CB 3.21Å; N218-V220 PolarHBondContact OD1-N 3.08Å; N218-G221 PolarHBondContact N-O 3.13Å; N218-G221 PolarHBondContact OD1-N 2.99Å; N218-G221 VanDerWaalsContact OD1-N 3.15Å; N218-G221 PolarHBondContact OD1-O 3.04Å
219	S	97.2	Very high	97.9	Very high	94 Å²	94	57.9 Å²	57.9	66%	0.657	28%	0.284	S	S	*	.	S	Bend	trans	-65.4	-19.9	-179.3	53.4	0	0	0	0	114.6
220	V	97.7	Very high	98	Very high	45 Å²	45	56.3 Å²	56.3	27%	0.273	27%	0.274	S	S	.	.	S	Bend	trans	-90.6	-38.2	-179.1	-171.7	0	0	0	0	111.2	V41 L131 A133 N218	V41-V220 HydrophobicContact CG1-CG1 3.64Å; V41-V220 HydrophobicContact CG2-CG1 4.31Å; V41-V220 HydrophobicContact CG2-CG2 4.44Å; L131-V220 HydrophobicContact CB-CG2 3.4Å; L131-V220 VanDerWaalsContact CB-CG2 3.4Å; L131-V220 HydrophobicContact CD1-CG2 4.41Å; A133-V220 HydrophobicContact CB-CB 4.14Å; A133-V220 HydrophobicContact CB-CG1 3.84Å; N218-V220 PolarHBondContact O-N 2.94Å; N218-V220 WeakPolarHBondContact OD1-CB 3.21Å; N218-V220 PolarHBondContact OD1-N 3.08Å
221	G	98	Very high	98.1	Very high	17 Å²	17	60.3 Å²	60.3	18%	0.175	29%	0.292	C	S	.	.			trans	177.5	-165.2	-177.9	0	0	0	0	0	113.9	P134 R217 N218	P134-G221 WeakPolarHBondContact CD-O 3.32Å; R217-G221 WeakPolarHBondContact CA-O 3.46Å; N218-G221 PolarHBondContact N-O 3.13Å; N218-G221 PolarHBondContact OD1-N 2.99Å; N218-G221 VanDerWaalsContact OD1-N 3.15Å; N218-G221 PolarHBondContact OD1-O 3.04Å
222	Y	98.3	Very high	98	Very high	122 Å²	122	55.6 Å²	55.6	48%	0.478	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.4	-179.4	68.1	-82.4	0	0	0	111.8	E215 A216 R217	E215-Y222 HydrophobicContact CG-CD2 4.06Å; A216-Y222 CarbonylContact O-C 3.58Å; A216-Y222 WeakPolarHBondContact O-CA 3.01Å; A216-Y222 WeakPolarHBondContact O-CB 3.33Å; R217-Y222 VanDerWaalsContact NH2-CD1 3.26Å
223	R	98.4	Very high	97.8	Very high	127 Å²	127	59 Å²	59	48%	0.479	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.2	172.2	-71.9	-62.3	-177.2	-86.2	-0.5	109.8	P134 A135 E215 A216	P134-R223 WeakPolarHBondContact O-CG 3.37Å; A135-R223 VanDerWaalsContact O-CB 3.26Å; A135-R223 WeakPolarHBondContact O-CB 3.44Å; E215-R223 CarbonylContact C-O 3.59Å; E215-R223 WeakPolarHBondContact CA-O 3.37Å; A216-R223 PolarHBondContact N-O 2.97Å; A216-R223 PolarHBondContact O-N 3.42Å
224	R	98.1	Very high	97.5	Very high	110 Å²	110	62.7 Å²	62.7	42%	0.415	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.3	-179.2	-172.1	175.1	-67.5	149	2.8	110.2	C214 E215	C214-R224 WeakPolarHBondContact O-CA 3.21Å; C214-R224 WeakPolarHBondContact O-CG 3.45Å; E215-R224 HydrophobicContact CB-CB 4.42Å; E215-R224 HydrophobicContact CB-CG 4.48Å; E215-R224 IonicContact OE2-CZ 3.48Å; E215-R224 IonicContact OE2-NE 3.71Å; E215-R224 IonicContact OE2-NH2 2.66Å; E215-R224 PolarHBondContact OE2-NH2 2.65Å
225	C	98.3	Very high	97	Very high	7 Å²	7	67.1 Å²	67.1	5%	0.047	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-73.6	155.9	173.2	68	0	0	0	0	111.6	V136 P137 C139 C214	V136-C225 HydrophobicContact CG1-CB 4.44Å; P137-C225 HydrophobicContact CG-CB 4.17Å; P137-C225 VanDerWaalsContact O-CB 3.25Å; P137-C225 WeakPolarHBondContact O-CB 3.45Å; C139-C225 HydrophobicContact CB-CB 3.84Å; C139-C225 WeakPolarHBondContact CB-SG 2.95Å; C139-C225 WeakPolarHBondContact SG-CB 3.21Å; C139-C225 CovalentContact SG-SG 2.02Å; C139-C225 PolarHBondContact SG-SG 3.46Å; C214-C225 PolarHBondContact N-SG 2.93Å; C214-C225 PolarHBondContact O-N 3.48Å
226	P	97.9	Very high	96.5	Very high	98 Å²	98	71.7 Å²	71.7	64%	0.636	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-55.3	146.5	168.5	-22.6	33.5	0	0	0	111.1
227	G	97.9	Very high	96.1	Very high	30 Å²	30	76.7 Å²	76.7	31%	0.309	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-61.6	137.8	174.8	0	0	0	0	0	111.7	E211 Y212	E211-G227 WeakPolarHBondContact OE1-CA 3.27Å; Y212-G227 CarbonylContact O-C 3.43Å; Y212-G227 WeakPolarHBondContact O-CA 3.31Å
228	K	98.4	Very high	95.6	Very high	92 Å²	92	75.9 Å²	75.9	40%	0.4	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.4	174.3	-70.4	-168.9	174.6	-169.9	0	109.2	C139 V141 Y212	C139-K228 WeakPolarHBondContact O-CD 3.46Å; C139-K228 WeakPolarHBondContact O-CE 3.25Å; C139-K228 PolarHBondContact O-NZ 2.97Å; V141-K228 HydrophobicContact CB-CB 3.74Å; V141-K228 HydrophobicContact CB-CD 4.21Å; V141-K228 HydrophobicContact CG1-CB 4.23Å; V141-K228 HydrophobicContact CG2-CB 3.98Å; V141-K228 HydrophobicContact CG2-CD 4.38Å; Y212-K228 PolarHBondContact N-O 2.79Å; Y212-K228 PolarHBondContact O-N 3.14Å
229	R	98	Very high	95.3	Very high	173 Å²	173	76.3 Å²	76.3	65%	0.653	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	127.5	-179.1	-170.6	156.6	-172.8	-161.8	-1.8	111.4	G210	G210-R229 WeakPolarHBondContact O-CA 3.49Å
230	M	97.6	Very high	95.1	Very high	0 Å²	0	76 Å²	76	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.2	168	-177.5	174.6	77.3	0	0	108.5	V141 P142 V151 L153 F201 V204 D208 T209 G210 Y212 V232	V141-M230 HydrophobicContact CG1-CB 3.87Å; P142-M230 HydrophobicContact CG-CG 4.35Å; P142-M230 HydrophobicContact CG-SD 3.93Å; P142-M230 WeakPolarHBondContact O-CA 3.33Å; P142-M230 WeakPolarHBondContact O-CB 3.14Å; P142-M230 WeakPolarHBondContact O-CG 2.98Å; V151-M230 HydrophobicContact CG1-SD 3.93Å; L153-M230 HydrophobicContact CD1-SD 4.21Å; F201-M230 HydrophobicContact CE2-CE 4.3Å; V204-M230 HydrophobicContact CG2-CE 4.16Å; D208-M230 HydrophobicContact CB-CE 4.41Å; T209-M230 WeakPolarHBondContact CA-O 3.49Å; G210-M230 PolarHBondContact N-O 3.46Å; G210-M230 VanDerWaalsContact N-O 3.08Å; G210-M230 PolarHBondContact O-N 2.96Å; Y212-M230 HydrophobicContact CD2-CB 3.99Å; Y212-M230 HydrophobicContact CD2-CE 4.46Å; Y212-M230 HydrophobicContact CE2-CB 4.02Å; Y212-M230 HydrophobicContact CE2-CE 3.63Å; M230-V232 HydrophobicContact CE-CG2 3.99Å; M230-V232 HydrophobicContact CG-CG2 4.36Å
231	Q	97.6	Very high	95	Very high	90 Å²	90	78.6 Å²	78.6	42%	0.421	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.4	172.8	-179.5	171	-23.4	0	0	110.2	S143 S144 A145 D233	S143-Q231 PolarHBondContact O-N 3.06Å; S144-Q231 CarbonylContact C-O 3.55Å; S144-Q231 WeakPolarHBondContact CA-O 3.35Å; A145-Q231 PolarHBondContact N-O 2.97Å; Q231-D233 PolarHBondContact NE2-OD1 2.86Å; Q231-D233 PolarHBondContact NE2-OD2 2.86Å
232	V	95.9	Very high	94.9	Very high	1 Å²	1	80.3 Å²	80.3	1%	0.006	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	114.9	177.9	-172.8	0	0	0	0	108.5	A145 V204 S205 D208 T209 M230	A145-V232 HydrophobicContact CB-CG2 4.42Å; A145-V232 WeakPolarHBondContact O-CA 3.38Å; V204-V232 HydrophobicContact CB-CG1 4.48Å; V204-V232 HydrophobicContact CG1-CG1 3.84Å; V204-V232 HydrophobicContact CG2-CB 4.43Å; V204-V232 HydrophobicContact CG2-CG1 4.01Å; V204-V232 HydrophobicContact CG2-CG2 3.57Å; S205-V232 VanDerWaalsContact C-CG1 3.49Å; S205-V232 WeakPolarHBondContact O-CB 3.41Å; S205-V232 WeakPolarHBondContact O-CG1 3.33Å; D208-V232 HydrophobicContact CB-CG2 4.49Å; T209-V232 PolarHBondContact OG1-N 3.04Å; M230-V232 HydrophobicContact CE-CG2 3.99Å; M230-V232 HydrophobicContact CG-CG2 4.36Å
233	D	94.6	Very high	94.8	Very high	72 Å²	72	77.1 Å²	77.1	39%	0.385	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	144.3	-178.2	-64.1	-47.7	0	0	0	110.7	A145 L146 S147 Q231	A145-D233 PolarHBondContact O-N 2.87Å; L146-D233 WeakPolarHBondContact CA-O 3.42Å; S147-D233 PolarHBondContact N-O 3.33Å; S147-D233 PolarHBondContact OG-O 3.39Å; Q231-D233 PolarHBondContact NE2-OD1 2.86Å; Q231-D233 PolarHBondContact NE2-OD2 2.86Å
234	D	91.8	Very high	94.8	Very high	93 Å²	93	75.6 Å²	75.6	50%	0.497	42%	0.418	S	S	.	.			trans	-80.3	144.7	172.9	-61.8	-45	0	0	0	110.4	S147 K206 N236	S147-D234 VanDerWaalsContact CB-OD1 3.22Å; S147-D234 WeakPolarHBondContact CB-OD1 3.48Å; S147-D234 PolarHBondContact OG-OD1 2.03Å; K206-D234 WeakPolarHBondContact CD-OD2 3.49Å; D234-N236 PolarHBondContact O-N 3.03Å
235	L	87.6	Confident	94.8	Very high	94 Å²	94	74 Å²	74	49%	0.492	42%	0.42	S	S	.	.			trans	-66.3	122.7	173	-169.6	62.5	0	0	0	109.7	L146 I237 I240	L146-L235 HydrophobicContact CD1-CB 3.93Å; L146-L235 HydrophobicContact CD1-CD1 4.11Å; L146-L235 HydrophobicContact CD2-CB 4.46Å; L146-L235 HydrophobicContact CD2-CD1 4.28Å; L235-I237 HydrophobicContact CB-CG1 4.5Å; L235-I237 HydrophobicContact CD2-CG1 4.42Å; L235-I237 HydrophobicContact CG-CG1 4.41Å; L235-I237 PolarHBondContact O-N 2.65Å; L235-I240 HydrophobicContact CD1-CD1 3.88Å; L235-I240 HydrophobicContact CD2-CD1 4.27Å; L235-I240 HydrophobicContact CG-CD1 3.96Å
236	N	89	Confident	94.7	Very high	108 Å²	108	77.9 Å²	77.9	58%	0.578	44%	0.443	S	S	*	.			trans	-75.4	73.5	177.4	-175.2	15.1	0	0	0	111.7	D234 S238 G239 I240	D234-N236 PolarHBondContact O-N 3.03Å; N236-S238 VanDerWaalsContact C-N 3.29Å; N236-S238 PolarHBondContact O-N 2.9Å; N236-G239 PolarHBondContact O-N 3.23Å; N236-G239 PolarHBondContact OD1-N 2.96Å; N236-G239 VanDerWaalsContact OD1-N 3.12Å; N236-I240 WeakPolarHBondContact O-CG1 3.3Å; N236-I240 PolarHBondContact O-N 2.86Å; N236-I240 VanDerWaalsContact O-N 3.1Å
237	I	88.7	Confident	94.7	Very high	106 Å²	106	77.2 Å²	77.2	54%	0.544	44%	0.438	S	S	.	.	H	α-helix	trans	-56.2	-44.1	-178.4	-64.5	171.9	0	0	0	110.9	L235 G239 I240 I241	L235-I237 HydrophobicContact CB-CG1 4.5Å; L235-I237 HydrophobicContact CD2-CG1 4.42Å; L235-I237 HydrophobicContact CG-CG1 4.41Å; L235-I237 PolarHBondContact O-N 2.65Å; I237-G239 VanDerWaalsContact C-N 3.35Å; I237-G239 PolarHBondContact O-N 2.77Å; I237-I240 PolarHBondContact O-N 2.83Å; I237-I241 HydrophobicContact CG2-CD1 3.65Å; I237-I241 HydrophobicContact CG2-CG1 4.26Å; I237-I241 VanDerWaalsContact O-CG1 3.32Å; I237-I241 WeakPolarHBondContact O-CG1 2.98Å; I237-I241 PolarHBondContact O-N 3.31Å
238	S	89.7	Confident	94.7	Very high	92 Å²	92	78.5 Å²	78.5	64%	0.643	45%	0.445	S	S	*	.	H	α-helix	trans	-61.3	-41.2	179.9	-55.1	0	0	0	0	112.6	N236 I241 A242	N236-S238 VanDerWaalsContact C-N 3.29Å; N236-S238 PolarHBondContact O-N 2.9Å; S238-I241 PolarHBondContact O-N 3.3Å; S238-A242 WeakPolarHBondContact O-CB 2.96Å; S238-A242 PolarHBondContact O-N 3.11Å
239	G	91.8	Very high	94.7	Very high	31 Å²	31	79.2 Å²	79.2	32%	0.32	45%	0.453	S	S	.	.	H	α-helix	trans	-65.5	-40.3	176	0	0	0	0	0	112.8	N236 I237 A242 A243	N236-G239 PolarHBondContact O-N 3.23Å; N236-G239 PolarHBondContact OD1-N 2.96Å; N236-G239 VanDerWaalsContact OD1-N 3.12Å; I237-G239 VanDerWaalsContact C-N 3.35Å; I237-G239 PolarHBondContact O-N 2.77Å; G239-A242 PolarHBondContact O-N 2.95Å; G239-A243 WeakPolarHBondContact O-CB 3.45Å; G239-A243 PolarHBondContact O-N 2.87Å
240	I	93.1	Very high	94.6	Very high	88 Å²	88	74.9 Å²	74.9	45%	0.451	45%	0.445	S	S	.	.	H	α-helix	trans	-63.3	-47.8	175.6	-64.2	167.2	0	0	0	110.1	L235 N236 I237 A242 A243 V244	L235-I240 HydrophobicContact CD1-CD1 3.88Å; L235-I240 HydrophobicContact CD2-CD1 4.27Å; L235-I240 HydrophobicContact CG-CD1 3.96Å; N236-I240 WeakPolarHBondContact O-CG1 3.3Å; N236-I240 PolarHBondContact O-N 2.86Å; N236-I240 VanDerWaalsContact O-N 3.1Å; I237-I240 PolarHBondContact O-N 2.83Å; I240-A242 PolarHBondContact O-N 2.88Å; I240-A243 PolarHBondContact O-N 2.94Å; I240-V244 VanDerWaalsContact O-CG2 3.31Å; I240-V244 WeakPolarHBondContact O-CG2 3.39Å; I240-V244 PolarHBondContact O-N 3.32Å
241	I	95.1	Very high	94.6	Very high	99 Å²	99	80.2 Å²	80.2	51%	0.508	47%	0.473	S	S	.	.	H	α-helix	trans	-59.7	-46.9	178.3	-66.9	169.2	0	0	0	110.6	I237 S238 A243 V244 V245	I237-I241 HydrophobicContact CG2-CD1 3.65Å; I237-I241 HydrophobicContact CG2-CG1 4.26Å; I237-I241 VanDerWaalsContact O-CG1 3.32Å; I237-I241 WeakPolarHBondContact O-CG1 2.98Å; I237-I241 PolarHBondContact O-N 3.31Å; S238-I241 PolarHBondContact O-N 3.3Å; I241-A243 PolarHBondContact O-N 3.12Å; I241-V244 PolarHBondContact O-N 2.95Å; I241-V245 HydrophobicContact CG2-CG2 4.46Å; I241-V245 WeakPolarHBondContact O-CG2 3.35Å; I241-V245 PolarHBondContact O-N 3.38Å
242	A	96	Very high	94.5	Very high	54 Å²	54	79 Å²	79	45%	0.446	47%	0.474	S	S	.	.	H	α-helix	trans	-60.2	-44.1	178.8	0	0	0	0	0	112.3	S238 G239 I240 V244 V245 V246	S238-A242 WeakPolarHBondContact O-CB 2.96Å; S238-A242 PolarHBondContact O-N 3.11Å; G239-A242 PolarHBondContact O-N 2.95Å; I240-A242 PolarHBondContact O-N 2.88Å; A242-V244 PolarHBondContact O-N 3.37Å; A242-V245 PolarHBondContact O-N 2.85Å; A242-V246 WeakPolarHBondContact O-CG2 3.28Å; A242-V246 PolarHBondContact O-N 3.42Å
243	A	96.6	Very high	94.5	Very high	55 Å²	55	83.8 Å²	83.8	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-43	177.4	0	0	0	0	0	112.1	G239 I240 I241 V245 V246 V247	G239-A243 WeakPolarHBondContact O-CB 3.45Å; G239-A243 PolarHBondContact O-N 2.87Å; I240-A243 PolarHBondContact O-N 2.94Å; I241-A243 PolarHBondContact O-N 3.12Å; A243-V245 PolarHBondContact O-N 2.91Å; A243-V246 PolarHBondContact O-N 2.73Å; A243-V247 WeakPolarHBondContact O-CG2 3.43Å; A243-V247 PolarHBondContact O-N 3.22Å
244	V	97.2	Very high	94.6	Very high	95 Å²	95	84 Å²	84	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-61.7	-43.4	176.6	171.8	0	0	0	0	111.1	I240 I241 A242 V247 A248	I240-V244 VanDerWaalsContact O-CG2 3.31Å; I240-V244 WeakPolarHBondContact O-CG2 3.39Å; I240-V244 PolarHBondContact O-N 3.32Å; I241-V244 PolarHBondContact O-N 2.95Å; A242-V244 PolarHBondContact O-N 3.37Å; V244-V247 PolarHBondContact O-N 2.87Å; V244-A248 WeakPolarHBondContact O-CB 3.24Å; V244-A248 PolarHBondContact O-N 2.91Å
245	V	97.5	Very high	94.7	Very high	76 Å²	76	81.2 Å²	81.2	46%	0.461	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-45.5	177.1	172.2	0	0	0	0	111.2	I241 A242 A243 V247 A248 L249	I241-V245 HydrophobicContact CG2-CG2 4.46Å; I241-V245 WeakPolarHBondContact O-CG2 3.35Å; I241-V245 PolarHBondContact O-N 3.38Å; A242-V245 PolarHBondContact O-N 2.85Å; A243-V245 PolarHBondContact O-N 2.91Å; V245-V247 PolarHBondContact O-N 3.21Å; V245-A248 PolarHBondContact O-N 3.49Å; V245-L249 HydrophobicContact CG1-CD1 4.13Å; V245-L249 HydrophobicContact CG1-CG 4.47Å; V245-L249 VanDerWaalsContact O-CG 3.32Å; V245-L249 WeakPolarHBondContact O-CG 3.39Å; V245-L249 PolarHBondContact O-N 2.89Å
246	V	97.9	Very high	95	Very high	88 Å²	88	82.3 Å²	82.3	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-45.7	178.4	171.3	0	0	0	0	111.3	A242 A243 A248 L249 V250	A242-V246 WeakPolarHBondContact O-CG2 3.28Å; A242-V246 PolarHBondContact O-N 3.42Å; A243-V246 PolarHBondContact O-N 2.73Å; V246-A248 PolarHBondContact O-N 2.82Å; V246-L249 PolarHBondContact O-N 3.16Å; V246-V250 WeakPolarHBondContact O-CG2 3.5Å; V246-V250 PolarHBondContact O-N 3.22Å
247	V	97.9	Very high	95.3	Very high	85 Å²	85	79 Å²	79	52%	0.515	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-42.9	178	172.2	0	0	0	0	111.3	A243 V244 V245 L249 V250 I251	A243-V247 WeakPolarHBondContact O-CG2 3.43Å; A243-V247 PolarHBondContact O-N 3.22Å; V244-V247 PolarHBondContact O-N 2.87Å; V245-V247 PolarHBondContact O-N 3.21Å; V247-L249 VanDerWaalsContact C-N 3.33Å; V247-L249 PolarHBondContact O-N 2.93Å; V247-V250 PolarHBondContact O-N 3.21Å; V247-I251 HydrophobicContact CG1-CD1 3.8Å; V247-I251 HydrophobicContact CG1-CG1 4.4Å; V247-I251 WeakPolarHBondContact O-CG1 3.38Å; V247-I251 PolarHBondContact O-N 2.86Å
248	A	97.2	Very high	95.4	Very high	56 Å²	56	77.3 Å²	77.3	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-40.1	177	0	0	0	0	0	112.3	V244 V245 V246 I251 S252	V244-A248 WeakPolarHBondContact O-CB 3.24Å; V244-A248 PolarHBondContact O-N 2.91Å; V245-A248 PolarHBondContact O-N 3.49Å; V246-A248 PolarHBondContact O-N 2.82Å; A248-I251 PolarHBondContact O-N 2.82Å; A248-S252 WeakPolarHBondContact O-CB 3.27Å; A248-S252 PolarHBondContact O-N 2.75Å
249	L	97.2	Very high	95.5	Very high	108 Å²	108	76.3 Å²	76.3	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-64.6	-43.4	175	-69.6	174.5	0	0	0	111.7	V245 V246 V247 S252 V253	V245-L249 HydrophobicContact CG1-CD1 4.13Å; V245-L249 HydrophobicContact CG1-CG 4.47Å; V245-L249 VanDerWaalsContact O-CG 3.32Å; V245-L249 WeakPolarHBondContact O-CG 3.39Å; V245-L249 PolarHBondContact O-N 2.89Å; V246-L249 PolarHBondContact O-N 3.16Å; V247-L249 VanDerWaalsContact C-N 3.33Å; V247-L249 PolarHBondContact O-N 2.93Å; L249-S252 PolarHBondContact O-N 3.34Å; L249-V253 VanDerWaalsContact O-CG2 3.28Å; L249-V253 WeakPolarHBondContact O-CG2 3.4Å; L249-V253 PolarHBondContact O-N 3.09Å
250	V	97.3	Very high	95.6	Very high	81 Å²	81	81.6 Å²	81.6	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-46.5	176.5	172.4	0	0	0	0	111.1	V246 V247 S252 V253 C254	V246-V250 WeakPolarHBondContact O-CG2 3.5Å; V246-V250 PolarHBondContact O-N 3.22Å; V247-V250 PolarHBondContact O-N 3.21Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 3.42Å; V250-V253 PolarHBondContact O-N 3.38Å; V250-C254 WeakPolarHBondContact O-CB 3.45Å; V250-C254 PolarHBondContact O-N 3.02Å; V250-C254 PolarHBondContact O-SG 3.5Å
251	I	96.8	Very high	95.4	Very high	112 Å²	112	78.2 Å²	78.2	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-60.7	-43.3	177.1	-68.5	169	0	0	0	110.9	V247 A248 C254 G255	V247-I251 HydrophobicContact CG1-CD1 3.8Å; V247-I251 HydrophobicContact CG1-CG1 4.4Å; V247-I251 WeakPolarHBondContact O-CG1 3.38Å; V247-I251 PolarHBondContact O-N 2.86Å; A248-I251 PolarHBondContact O-N 2.82Å; I251-C254 PolarHBondContact O-N 2.9Å; I251-G255 PolarHBondContact O-N 3.46Å
252	S	96.2	Very high	95.1	Very high	66 Å²	66	79.3 Å²	79.3	46%	0.462	49%	0.486	S	S	.	.	H	α-helix	trans	-59.8	-47.7	176.5	-177.9	0	0	0	0	111.4	A248 L249 V250 C254 G255 L256	A248-S252 WeakPolarHBondContact O-CB 3.27Å; A248-S252 PolarHBondContact O-N 2.75Å; L249-S252 PolarHBondContact O-N 3.34Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 3.42Å; S252-C254 PolarHBondContact O-N 3.09Å; S252-G255 PolarHBondContact O-N 2.96Å; S252-L256 WeakPolarHBondContact O-CB 3.32Å; S252-L256 VanDerWaalsContact O-CG 3.28Å; S252-L256 WeakPolarHBondContact O-CG 3.37Å; S252-L256 PolarHBondContact O-N 3.29Å
253	V	96.5	Very high	94.6	Very high	100 Å²	100	87.8 Å²	87.8	61%	0.606	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-44.6	177.5	171.6	0	0	0	0	111.5	L249 V250 L256 G257	L249-V253 VanDerWaalsContact O-CG2 3.28Å; L249-V253 WeakPolarHBondContact O-CG2 3.4Å; L249-V253 PolarHBondContact O-N 3.09Å; V250-V253 PolarHBondContact O-N 3.38Å; V253-L256 PolarHBondContact O-N 3.04Å; V253-G257 PolarHBondContact O-N 3.17Å
254	C	95	Very high	94.1	Very high	77 Å²	77	91.5 Å²	91.5	52%	0.52	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-43.6	175.6	-70	0	0	0	0	112.1	V250 I251 S252 G257 V258	V250-C254 WeakPolarHBondContact O-CB 3.45Å; V250-C254 PolarHBondContact O-N 3.02Å; V250-C254 PolarHBondContact O-SG 3.5Å; I251-C254 PolarHBondContact O-N 2.9Å; S252-C254 PolarHBondContact O-N 3.09Å; C254-G257 WeakPolarHBondContact O-CA 3.43Å; C254-G257 PolarHBondContact O-N 3.42Å; C254-G257 VanDerWaalsContact O-N 3.13Å; C254-V258 WeakPolarHBondContact O-CG2 3.37Å; C254-V258 PolarHBondContact O-N 2.91Å
255	G	94.8	Very high	93.3	Very high	34 Å²	34	88.6 Å²	88.6	35%	0.351	50%	0.501	S	S	.	.	H	α-helix	trans	-61.6	-44.4	177.1	0	0	0	0	0	112.1	I251 S252 G257 V258 C259	I251-G255 PolarHBondContact O-N 3.46Å; S252-G255 PolarHBondContact O-N 2.96Å; G255-G257 VanDerWaalsContact C-N 3.3Å; G255-G257 PolarHBondContact O-N 3.06Å; G255-V258 PolarHBondContact O-N 3.45Å; G255-C259 WeakPolarHBondContact O-CB 3.22Å; G255-C259 PolarHBondContact O-N 3.29Å; G255-C259 PolarHBondContact O-SG 2.85Å; G255-C259 VanDerWaalsContact O-SG 3.36Å
256	L	94.8	Very high	92.3	Very high	118 Å²	118	93.2 Å²	93.2	62%	0.618	51%	0.512	S	S	*	.	H	α-helix	trans	-60	-40.9	171.7	-70.2	173.9	0	0	0	111.6	S252 V253 C259 Y260	S252-L256 WeakPolarHBondContact O-CB 3.32Å; S252-L256 VanDerWaalsContact O-CG 3.28Å; S252-L256 WeakPolarHBondContact O-CG 3.37Å; S252-L256 PolarHBondContact O-N 3.29Å; V253-L256 PolarHBondContact O-N 3.04Å; L256-C259 PolarHBondContact O-N 2.93Å; L256-Y260 VanDerWaalsContact O-CB 3.28Å; L256-Y260 WeakPolarHBondContact O-CB 3.22Å; L256-Y260 PolarHBondContact O-N 3.44Å
257	G	93.4	Very high	90.8	Very high	39 Å²	39	95.9 Å²	95.9	40%	0.402	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-44.3	175.5	0	0	0	0	0	113.5	V253 C254 G255 Y260 A261	V253-G257 PolarHBondContact O-N 3.17Å; C254-G257 WeakPolarHBondContact O-CA 3.43Å; C254-G257 PolarHBondContact O-N 3.42Å; C254-G257 VanDerWaalsContact O-N 3.13Å; G255-G257 VanDerWaalsContact C-N 3.3Å; G255-G257 PolarHBondContact O-N 3.06Å; G257-Y260 PolarHBondContact O-N 2.97Å; G257-A261 WeakPolarHBondContact O-CB 3.48Å; G257-A261 PolarHBondContact O-N 3.46Å
258	V	92.3	Very high	89.3	Confident	70 Å²	70	96.2 Å²	96.2	42%	0.424	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-46.6	176.3	174.1	0	0	0	0	111.1	C254 G255 Y260 A261 Q262	C254-V258 WeakPolarHBondContact O-CG2 3.37Å; C254-V258 PolarHBondContact O-N 2.91Å; G255-V258 PolarHBondContact O-N 3.45Å; V258-Y260 PolarHBondContact O-N 3.45Å; V258-A261 PolarHBondContact O-N 3.27Å; V258-A261 VanDerWaalsContact O-N 3.11Å; V258-Q262 HydrophobicContact CG1-CG 4.32Å; V258-Q262 WeakPolarHBondContact O-CB 3.3Å; V258-Q262 WeakPolarHBondContact O-CG 3.03Å; V258-Q262 PolarHBondContact O-N 2.98Å
259	C	91.7	Very high	87.3	Confident	70 Å²	70	102.4 Å²	102.4	47%	0.473	54%	0.539	S	S	.	.	H	α-helix	trans	-56.3	-41.9	174.7	-76.8	0	0	0	0	111.5	G255 L256 R263	G255-C259 WeakPolarHBondContact O-CB 3.22Å; G255-C259 PolarHBondContact O-N 3.29Å; G255-C259 PolarHBondContact O-SG 2.85Å; G255-C259 VanDerWaalsContact O-SG 3.36Å; L256-C259 PolarHBondContact O-N 2.93Å; C259-R263 WeakPolarHBondContact O-CB 3.28Å; C259-R263 WeakPolarHBondContact O-CG 3.33Å; C259-R263 PolarHBondContact O-N 3.15Å
260	Y	92.9	Very high	85.1	Confident	142 Å²	142	106.2 Å²	106.2	56%	0.557	55%	0.554	S	S	*	*	H	α-helix	trans	-63.1	-46.9	174.6	178.3	-96.7	0	0	0	111.8	L256 G257 V258 Q262 R263 K264	L256-Y260 VanDerWaalsContact O-CB 3.28Å; L256-Y260 WeakPolarHBondContact O-CB 3.22Å; L256-Y260 PolarHBondContact O-N 3.44Å; G257-Y260 PolarHBondContact O-N 2.97Å; V258-Y260 PolarHBondContact O-N 3.45Å; Y260-Q262 PolarHBondContact O-N 3.13Å; Y260-R263 PolarHBondContact O-N 2.82Å; Y260-K264 HydrophobicContact CE1-CG 4.11Å; Y260-K264 HydrophobicContact CE2-CG 4.28Å; Y260-K264 PolarHBondContact O-N 3.47Å; Y260-K264 WeakPolarHBondContact OH-CE 3.31Å
261	A	90.1	Very high	82.5	Confident	18 Å²	18	108.4 Å²	108.4	15%	0.149	57%	0.568	C	S	.	*	H	α-helix	trans	-64.4	-38.6	179.1	0	0	0	0	0	113	G257 V258 K264 G265 Y266 F267	G257-A261 WeakPolarHBondContact O-CB 3.48Å; G257-A261 PolarHBondContact O-N 3.46Å; V258-A261 PolarHBondContact O-N 3.27Å; V258-A261 VanDerWaalsContact O-N 3.11Å; A261-K264 CarbonylContact O-C 3.58Å; A261-K264 PolarHBondContact O-N 2.79Å; A261-G265 PolarHBondContact O-N 3.34Å; A261-Y266 HydrophobicContact CB-CD2 4.21Å; A261-Y266 PolarHBondContact O-N 3.11Å; A261-Y266 VanDerWaalsContact O-N 3.09Å; A261-F267 HydrophobicContact CB-CD2 4.14Å; A261-F267 HydrophobicContact CB-CE2 3.77Å
262	Q	88	Confident	79.7	Confident	121 Å²	121	107.5 Å²	107.5	57%	0.565	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-47	172.4	-74.2	-179.8	-32.5	0	0	111.4	V258 Y260 K264 G265 F267	V258-Q262 HydrophobicContact CG1-CG 4.32Å; V258-Q262 WeakPolarHBondContact O-CB 3.3Å; V258-Q262 WeakPolarHBondContact O-CG 3.03Å; V258-Q262 PolarHBondContact O-N 2.98Å; Y260-Q262 PolarHBondContact O-N 3.13Å; Q262-K264 PolarHBondContact O-N 2.93Å; Q262-G265 PolarHBondContact O-N 3.34Å; Q262-F267 HydrophobicContact CG-CD2 4.29Å
263	R	85.7	Confident	77.2	Confident	233 Å²	233	112.6 Å²	112.6	88%	0.879	59%	0.585	S	S	*	*	H	α-helix	trans	-58.9	-32.3	175	-82.3	-172.9	173.4	-166.9	-0.6	112.9	C259 Y260	C259-R263 WeakPolarHBondContact O-CB 3.28Å; C259-R263 WeakPolarHBondContact O-CG 3.33Å; C259-R263 PolarHBondContact O-N 3.15Å; Y260-R263 PolarHBondContact O-N 2.82Å
264	K	86.7	Confident	74.5	Confident	133 Å²	133	115.8 Å²	115.8	58%	0.578	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-4.4	177	-76	-74.2	-173.1	175.6	0	114.2	Y260 A261 Q262 Y266	Y260-K264 HydrophobicContact CE1-CG 4.11Å; Y260-K264 HydrophobicContact CE2-CG 4.28Å; Y260-K264 PolarHBondContact O-N 3.47Å; Y260-K264 WeakPolarHBondContact OH-CE 3.31Å; A261-K264 CarbonylContact O-C 3.58Å; A261-K264 PolarHBondContact O-N 2.79Å; Q262-K264 PolarHBondContact O-N 2.93Å; K264-Y266 HydrophobicContact CB-CD2 3.62Å; K264-Y266 HydrophobicContact CB-CE2 3.45Å; K264-Y266 VanDerWaalsContact CB-CE2 3.45Å; K264-Y266 HydrophobicContact CG-CE2 4.23Å
265	G	80	Confident	71.6	Confident	33 Å²	33	122.6 Å²	122.6	34%	0.34	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	83.3	11.2	173.8	0	0	0	0	0	116.3	A261 Q262 F267 S268	A261-G265 PolarHBondContact O-N 3.34Å; Q262-G265 PolarHBondContact O-N 3.34Å; G265-F267 VanDerWaalsContact C-N 3.26Å; G265-F267 PolarHBondContact O-N 3.4Å; G265-S268 WeakPolarHBondContact O-CB 3.34Å; G265-S268 PolarHBondContact O-N 2.97Å; G265-S268 PolarHBondContact O-OG 3.38Å
266	Y	76.6	Confident	68.7	Low	173 Å²	173	126 Å²	126	68%	0.678	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-26.3	-176.7	-72.2	-81.4	0	0	0	114.3	A261 K264	A261-Y266 HydrophobicContact CB-CD2 4.21Å; A261-Y266 PolarHBondContact O-N 3.11Å; A261-Y266 VanDerWaalsContact O-N 3.09Å; K264-Y266 HydrophobicContact CB-CD2 3.62Å; K264-Y266 HydrophobicContact CB-CE2 3.45Å; K264-Y266 VanDerWaalsContact CB-CE2 3.45Å; K264-Y266 HydrophobicContact CG-CE2 4.23Å
267	F	66.8	Low	65.7	Low	144 Å²	144	127.7 Å²	127.7	63%	0.632	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	15.4	179	-68.6	-70.5	0	0	0	113.6	A261 Q262 G265 K269	A261-F267 HydrophobicContact CB-CD2 4.14Å; A261-F267 HydrophobicContact CB-CE2 3.77Å; Q262-F267 HydrophobicContact CG-CD2 4.29Å; G265-F267 VanDerWaalsContact C-N 3.26Å; G265-F267 PolarHBondContact O-N 3.4Å; F267-K269 VanDerWaalsContact C-N 3.32Å; F267-K269 PolarHBondContact O-N 3.36Å
268	S	66.4	Low	62.8	Low	92 Å²	92	130.9 Å²	130.9	64%	0.643	66%	0.659	S	S	*	*			trans	-65.8	97.7	169.8	-52.9	0	0	0	0	107.9	G265 E270	G265-S268 WeakPolarHBondContact O-CB 3.34Å; G265-S268 PolarHBondContact O-N 2.97Å; G265-S268 PolarHBondContact O-OG 3.38Å; S268-E270 PolarHBondContact O-N 3.35Å
269	K	54.7	Low	60	Low	186 Å²	186	132.5 Å²	132.5	81%	0.809	67%	0.673	S	S	*	*			trans	-48.7	125.2	170.1	-138.3	175.3	-174.8	179.1	0	106.8	F267 T271	F267-K269 VanDerWaalsContact C-N 3.32Å; F267-K269 PolarHBondContact O-N 3.36Å; K269-T271 PolarHBondContact O-N 3.09Å
270	E	49.5	Very low	57.2	Low	188 Å²	188	134.4 Å²	134.4	88%	0.879	69%	0.687	S	S	*	*			trans	-60.2	81.7	160.8	-77.4	-176	148.1	0	0	107.8	S268 S272	S268-E270 PolarHBondContact O-N 3.35Å; E270-S272 PolarHBondContact O-N 3.13Å; E270-S272 VanDerWaalsContact O-N 3.12Å
271	T	42.7	Very low	54.4	Low	128 Å²	128	137.3 Å²	137.3	79%	0.785	70%	0.702	S	S	*	*			trans	-68.7	92.2	141	27.5	0	0	0	0	105.7	K269 F273	K269-T271 PolarHBondContact O-N 3.09Å; T271-F273 PolarHBondContact O-N 3.48Å
272	S	39.8	Very low	51.7	Low	92 Å²	92	140.6 Å²	140.6	64%	0.643	73%	0.73	S	S	*	*			trans	-40.2	128.1	154.6	47.2	0	0	0	0	110.9	E270	E270-S272 PolarHBondContact O-N 3.13Å; E270-S272 VanDerWaalsContact O-N 3.12Å
273	F	42.6	Very low	49	Very low	174 Å²	174	140.7 Å²	140.7	76%	0.763	74%	0.739	S	S	*	*				177.9	114.3	117.4	-111.9	-95.8	0	0	0	111.3	T271	T271-F273 PolarHBondContact O-N 3.48Å
274	Q	40.5	Very low	46.4	Very low	166 Å²	166	135.3 Å²	135.3	78%	0.776	73%	0.732	S	S	*	*			trans	33	117.1	149.7	-70	-176.7	-37.5	0	0	120.6
275	K	33.6	Very low	43.7	Very low	221 Å²	221	137.7 Å²	137.7	96%	0.961	75%	0.747	S	S	*	*				-153.9	61.5	129.7	-147.3	165.9	-173.2	171.2	0	112.1
276	S	34.9	Very low	41.5	Very low	105 Å²	105	141 Å²	141	73%	0.734	77%	0.765	S	S	*	*			trans	-99.1	117.4	156.5	51.3	0	0	0	0	109.6
277	N	31.9	Very low	39.7	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	77%	0.768	S	S	*	*			trans	74.6	112.2	147.8	-72.7	0.8	0	0	0	121.5
278	S	31.3	Very low	38.1	Very low	106 Å²	106	139.1 Å²	139.1	74%	0.741	77%	0.768	S	S	*	*				88.1	110.3	118.5	-165.6	0	0	0	0	117.1
279	S	33.3	Very low	36.9	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	77%	0.773	S	S	*	*				40.7	105.2	129.5	-165.7	0	0	0	0	116.7
280	S	33.9	Very low	36	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	77%	0.771	S	S	*	*				172.4	136	110.9	41.5	0	0	0	0	112.3
281	K	33.1	Very low	35.7	Very low	203 Å²	203	139.7 Å²	139.7	88%	0.883	76%	0.763	S	S	*	*			trans	43.6	112.8	145.8	-103.9	170.1	174.1	175	0	120.7
282	A	32.9	Very low	35.5	Very low	87 Å²	87	140.9 Å²	140.9	72%	0.719	76%	0.759	S	S	*	*				47	129.9	124.4	0	0	0	0	0	122
283	T	32.9	Very low	35.4	Very low	124 Å²	124	141.6 Å²	141.6	76%	0.761	76%	0.76	S	S	*	*			trans	112	102.2	138.4	-51.1	0	0	0	0	118.9
284	T	30.3	Very low	35.3	Very low	119 Å²	119	142.4 Å²	142.4	73%	0.73	76%	0.763	S	S	*	*			trans	43.9	128.6	140.2	60.7	0	0	0	0	125.8
285	M	30.4	Very low	35.3	Very low	184 Å²	184	139.6 Å²	139.6	91%	0.906	76%	0.762	S	S	*	*				76.3	132.2	130	-73.4	-166.4	155.3	0	0	124.1
286	S	34.6	Very low	35.6	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	76%	0.758	S	S	*	*			trans	104.4	114.7	133.5	-128.1	0	0	0	0	121.5
287	E	37.5	Very low	36.3	Very low	157 Å²	157	140.9 Å²	140.9	73%	0.734	76%	0.761	S	S	*	*				89.2	115.8	118.3	-157.7	153.9	-169.6	0	0	124.3
288	N	34.2	Very low	36.9	Very low	121 Å²	121	144.6 Å²	144.6	65%	0.647	78%	0.778	S	S	*	*			trans	66.1	146.1	139.1	-63.8	-5.6	0	0	0	126.3
289	D	40.2	Very low	37.1	Very low	137 Å²	137	146.6 Å²	146.6	73%	0.733	78%	0.78	S	S	*	*			trans	75.1	155.6	144.9	-68	-5.1	0	0	0	121.2
290	F	37.1	Very low	37.4	Very low	176 Å²	176	148.8 Å²	148.8	77%	0.772	78%	0.783	S	S	*	*			cis	179.8	157.1	-35.1	-126	-78.5	0	0	0	105.1
291	K	42.5	Very low	37.5	Very low	166 Å²	166	151 Å²	151	72%	0.722	78%	0.784	S	S	*	*			trans	81.6	123	149.3	-73	-178.1	164.6	177.1	0	125.7
292	H	37.4	Very low	37.8	Very low	152 Å²	152	147.9 Å²	147.9	70%	0.704	78%	0.778	S	S	*	*				78.1	124.6	123.9	-72.7	-55.5	0	0	0	127.1
293	T	38.2	Very low	38.1	Very low	108 Å²	108	151.8 Å²	151.8	66%	0.663	78%	0.782	S	S	*	*				77.7	130.2	118.7	-50.2	0	0	0	0	125.3
294	K	41.2	Very low	38.5	Very low	190 Å²	190	153.6 Å²	153.6	83%	0.826	78%	0.783	S	S	*	*			trans	65.9	131.8	149.3	-85.2	176.6	177.9	-177.4	0	123.4
295	S	41.3	Very low	39	Very low	108 Å²	108	156.1 Å²	156.1	76%	0.755	79%	0.787	S	S	*	*				147.5	125.6	110.6	-90.9	0	0	0	0	116.1
296	F	38.6	Very low	39.7	Very low	196 Å²	196	153.9 Å²	153.9	86%	0.86	78%	0.778	S	S	*	*			trans	14.4	161	137.5	-82.7	-90	0	0	0	125
297	I	49	Very low	40.1	Very low	157 Å²	157	158.3 Å²	158.3	81%	0.805	78%	0.784	S	S	*	*			trans	123.9	114.9	150.3	-65.6	172.3	0	0	0	110
298	I	44.7	Very low	40.4	Very low	232 Å²	232	158.5 Å²	158.5	100%	1.19	79%	0.789	S	S	*	*			cis	-129.4	0	6.1	-85.9	144.7	0	0	0	108.7

Retrieved 298 of 298 residues in 73.7 ms (Link to these results)

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