A0A2K6AG69_MANLE Loading...

Vascular endothelial growth factor D

AlphaFold DB , UniProt , Accession A0A2K6AG69, Species MANLE (Mandrillus leucophaeus, Drill), Gene VEGFD, Length 354 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	52.1	Low	52	Low	226 Å²	226	144.2 Å²	144.2	100%	1.113	67%	0.668	S	S	*	*				0	8.8	0	-85	174.4	66.6	0	0	115.8
2	Y	46.3	Very low	52.5	Low	207 Å²	207	142.4 Å²	142.4	81%	0.812	66%	0.663	S	S	*	*			trans	-111.9	-9.3	175	-134.2	-92.9	0	0	0	114.7
3	R	46.4	Very low	52.7	Low	223 Å²	223	140.5 Å²	140.5	84%	0.842	66%	0.657	S	S	*	*	S	Bend	trans	-90.5	-24.5	-180	-83.3	-177.1	77.8	-179.5	3.9	114.7
4	E	47.3	Very low	52.8	Low	163 Å²	163	136.8 Å²	136.8	76%	0.762	64%	0.643	S	S	*	*	H	α-helix	trans	-78.1	-30.9	178.7	-63.8	-156.9	153.7	0	0	112.7	V6 V7 V8	E4-V6 VanDerWaalsContact C-N 3.3Å; E4-V6 PolarHBondContact O-N 2.84Å; E4-V7 PolarHBondContact O-N 3.41Å; E4-V8 WeakPolarHBondContact O-CG2 3.38Å; E4-V8 PolarHBondContact O-N 2.85Å
5	W	44.1	Very low	52.9	Low	188 Å²	188	138.2 Å²	138.2	71%	0.712	64%	0.641	S	S	*	*	H	α-helix	trans	-69.3	-23.7	176.4	-93.9	84.9	0	0	0	114.3	N9	W5-N9 PolarHBondContact O-N 2.77Å; W5-N9 PolarHBondContact O-ND2 3.38Å
6	V	52.8	Low	52.8	Low	76 Å²	76	134.1 Å²	134.1	46%	0.461	63%	0.628	S	S	.	*	H	α-helix	trans	-78	-37.8	178.3	177	0	0	0	0	110.8	E4 N9 I10	E4-V6 VanDerWaalsContact C-N 3.3Å; E4-V6 PolarHBondContact O-N 2.84Å; V6-N9 PolarHBondContact O-N 2.89Å; V6-I10 HydrophobicContact CG1-CD1 3.94Å; V6-I10 VanDerWaalsContact O-CG1 3.29Å; V6-I10 WeakPolarHBondContact O-CG1 3.36Å; V6-I10 PolarHBondContact O-N 2.85Å
7	V	56.6	Low	52.4	Low	82 Å²	82	134.1 Å²	134.1	50%	0.497	63%	0.628	S	S	.	*	H	α-helix	trans	-68.3	-40.7	178.5	180	0	0	0	0	110.7	E4 N9 I10 F11	E4-V7 PolarHBondContact O-N 3.41Å; V7-N9 PolarHBondContact O-N 2.83Å; V7-I10 PolarHBondContact O-N 2.88Å; V7-F11 HydrophobicContact CG1-CD2 3.97Å; V7-F11 HydrophobicContact CG1-CE2 4.12Å; V7-F11 WeakPolarHBondContact O-CD2 3.07Å; V7-F11 PolarHBondContact O-N 2.83Å
8	V	58.6	Low	52.3	Low	90 Å²	90	134.1 Å²	134.1	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-65	-37.9	176	177.5	0	0	0	0	111.8	E4 F11 M12	E4-V8 WeakPolarHBondContact O-CG2 3.38Å; E4-V8 PolarHBondContact O-N 2.85Å; V8-F11 PolarHBondContact O-N 3.09Å; V8-M12 WeakPolarHBondContact O-CB 3.42Å; V8-M12 WeakPolarHBondContact O-CG 3.27Å; V8-M12 PolarHBondContact O-N 3.26Å
9	N	52.6	Low	52.1	Low	89 Å²	89	131.8 Å²	131.8	48%	0.476	63%	0.628	S	S	.	*	H	α-helix	trans	-66.9	-38.9	175.1	-106.4	-73.1	0	0	0	112.7	W5 V6 V7 M12 M13	W5-N9 PolarHBondContact O-N 2.77Å; W5-N9 PolarHBondContact O-ND2 3.38Å; V6-N9 PolarHBondContact O-N 2.89Å; V7-N9 PolarHBondContact O-N 2.83Å; N9-M12 PolarHBondContact O-N 3Å; N9-M13 WeakPolarHBondContact O-CB 3.27Å; N9-M13 VanDerWaalsContact O-CG 3.24Å; N9-M13 WeakPolarHBondContact O-CG 3.39Å; N9-M13 PolarHBondContact O-N 3.46Å
10	I	58.3	Low	51.7	Low	95 Å²	95	133.1 Å²	133.1	49%	0.487	63%	0.633	S	S	.	*	H	α-helix	trans	-67	-41.3	177.6	-68.8	168.2	0	0	0	110.7	V6 V7 M13 L14	V6-I10 HydrophobicContact CG1-CD1 3.94Å; V6-I10 VanDerWaalsContact O-CG1 3.29Å; V6-I10 WeakPolarHBondContact O-CG1 3.36Å; V6-I10 PolarHBondContact O-N 2.85Å; V7-I10 PolarHBondContact O-N 2.88Å; I10-M13 PolarHBondContact O-N 3.06Å; I10-L14 HydrophobicContact CG2-CD1 3.87Å; I10-L14 WeakPolarHBondContact O-CB 3.3Å; I10-L14 WeakPolarHBondContact O-CG 3.32Å; I10-L14 PolarHBondContact O-N 2.68Å
11	F	57.3	Low	51.2	Low	147 Å²	147	129.7 Å²	129.7	65%	0.645	63%	0.634	S	S	*	*	H	α-helix	trans	-67	-38	175.9	-92.4	-86.6	0	0	0	113	V7 V8 Y15	V7-F11 HydrophobicContact CG1-CD2 3.97Å; V7-F11 HydrophobicContact CG1-CE2 4.12Å; V7-F11 WeakPolarHBondContact O-CD2 3.07Å; V7-F11 PolarHBondContact O-N 2.83Å; V8-F11 PolarHBondContact O-N 3.09Å; F11-Y15 WeakPolarHBondContact O-CB 3.26Å; F11-Y15 PolarHBondContact O-N 2.94Å
12	M	57.3	Low	50.3	Low	123 Å²	123	123.6 Å²	123.6	61%	0.606	61%	0.613	S	S	*	*	H	α-helix	trans	-68.8	-37	175.7	-76.8	-67.4	-103.2	0	0	112.6	V8 N9 Y15 V16	V8-M12 WeakPolarHBondContact O-CB 3.42Å; V8-M12 WeakPolarHBondContact O-CG 3.27Å; V8-M12 PolarHBondContact O-N 3.26Å; N9-M12 PolarHBondContact O-N 3Å; M12-Y15 PolarHBondContact O-N 2.91Å; M12-V16 WeakPolarHBondContact O-CG2 3.4Å; M12-V16 PolarHBondContact O-N 3.02Å
13	M	55.6	Low	49.5	Very low	118 Å²	118	118.2 Å²	118.2	58%	0.581	61%	0.606	S	S	*	*	H	α-helix	trans	-73.2	-33.3	177.1	-67.4	-63.6	-80.3	0	0	112.4	N9 I10 Q17	N9-M13 WeakPolarHBondContact O-CB 3.27Å; N9-M13 VanDerWaalsContact O-CG 3.24Å; N9-M13 WeakPolarHBondContact O-CG 3.39Å; N9-M13 PolarHBondContact O-N 3.46Å; I10-M13 PolarHBondContact O-N 3.06Å; M13-Q17 WeakPolarHBondContact O-CG 3.49Å; M13-Q17 PolarHBondContact O-N 2.76Å; M13-Q17 VanDerWaalsContact O-N 3.12Å
14	L	54.3	Low	49.2	Very low	88 Å²	88	114.4 Å²	114.4	46%	0.461	60%	0.602	S	S	.	*	H	α-helix	trans	-68.6	-35.1	170.8	-77.2	164.5	0	0	0	112.2	I10 Q17 L18	I10-L14 HydrophobicContact CG2-CD1 3.87Å; I10-L14 WeakPolarHBondContact O-CB 3.3Å; I10-L14 WeakPolarHBondContact O-CG 3.32Å; I10-L14 PolarHBondContact O-N 2.68Å; L14-Q17 PolarHBondContact O-N 2.8Å; L14-L18 WeakPolarHBondContact O-CB 3.15Å; L14-L18 PolarHBondContact O-N 3.32Å
15	Y	54.1	Low	48.6	Very low	158 Å²	158	115.7 Å²	115.7	62%	0.62	61%	0.609	S	S	*	*	H	α-helix	trans	-66.3	-41.7	174.3	-169.2	-98	0	0	0	112	F11 M12 Q17 L18 V19	F11-Y15 WeakPolarHBondContact O-CB 3.26Å; F11-Y15 PolarHBondContact O-N 2.94Å; M12-Y15 PolarHBondContact O-N 2.91Å; Y15-Q17 VanDerWaalsContact C-N 3.33Å; Y15-Q17 PolarHBondContact O-N 2.67Å; Y15-L18 PolarHBondContact O-N 2.99Å; Y15-V19 HydrophobicContact CD1-CG2 4.08Å; Y15-V19 HydrophobicContact CE1-CG2 3.79Å; Y15-V19 VanDerWaalsContact O-CG2 3.31Å; Y15-V19 WeakPolarHBondContact O-CG2 3.31Å; Y15-V19 PolarHBondContact O-N 3.5Å
16	V	50.4	Low	48.2	Very low	72 Å²	72	114.4 Å²	114.4	44%	0.436	61%	0.61	S	S	.	*	H	α-helix	trans	-65.5	-36.5	176.3	173.9	0	0	0	0	111.6	M12 Q20	M12-V16 WeakPolarHBondContact O-CG2 3.4Å; M12-V16 PolarHBondContact O-N 3.02Å; V16-Q20 WeakPolarHBondContact O-CB 3.29Å; V16-Q20 PolarHBondContact O-N 3.46Å; V16-Q20 VanDerWaalsContact O-N 3.11Å
17	Q	47	Very low	47.4	Very low	134 Å²	134	113.3 Å²	113.3	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-74.2	-28.8	175.3	-71.6	-170.3	-16	0	0	113.7	M13 L14 Y15 G21	M13-Q17 WeakPolarHBondContact O-CG 3.49Å; M13-Q17 PolarHBondContact O-N 2.76Å; M13-Q17 VanDerWaalsContact O-N 3.12Å; L14-Q17 PolarHBondContact O-N 2.8Å; Y15-Q17 VanDerWaalsContact C-N 3.33Å; Y15-Q17 PolarHBondContact O-N 2.67Å; Q17-G21 PolarHBondContact O-N 3.21Å
18	L	49.5	Very low	46.7	Very low	134 Å²	134	116 Å²	116	70%	0.702	63%	0.633	S	S	*	*	H	α-helix	trans	-75.6	-34.1	172.6	-85	158.6	0	0	0	112.6	L14 Y15 Q20 G21	L14-L18 WeakPolarHBondContact O-CB 3.15Å; L14-L18 PolarHBondContact O-N 3.32Å; Y15-L18 PolarHBondContact O-N 2.99Å; L18-Q20 VanDerWaalsContact C-N 3.33Å; L18-G21 PolarHBondContact O-N 3.48Å
19	V	48.3	Very low	46.1	Very low	91 Å²	91	117.2 Å²	117.2	55%	0.552	64%	0.641	S	S	*	*	H	α-helix	trans	-74.6	-23.7	175	175	0	0	0	0	112.1	Y15	Y15-V19 HydrophobicContact CD1-CG2 4.08Å; Y15-V19 HydrophobicContact CE1-CG2 3.79Å; Y15-V19 VanDerWaalsContact O-CG2 3.31Å; Y15-V19 WeakPolarHBondContact O-CG2 3.31Å; Y15-V19 PolarHBondContact O-N 3.5Å
20	Q	44.5	Very low	45.7	Very low	157 Å²	157	120.1 Å²	120.1	73%	0.734	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-0.1	171.7	-78.5	172.4	-31.2	0	0	114.1	V16 L18	V16-Q20 WeakPolarHBondContact O-CB 3.29Å; V16-Q20 PolarHBondContact O-N 3.46Å; V16-Q20 VanDerWaalsContact O-N 3.11Å; L18-Q20 VanDerWaalsContact C-N 3.33Å
21	G	41.1	Very low	44.9	Very low	62 Å²	62	126.4 Å²	126.4	64%	0.639	67%	0.667	S	S	*	*	S	Bend	trans	-99.7	-7.1	-173.5	0	0	0	0	0	116.7	Q17 L18	Q17-G21 PolarHBondContact O-N 3.21Å; L18-G21 PolarHBondContact O-N 3.48Å
22	S	33.9	Very low	44.3	Very low	98 Å²	98	123.4 Å²	123.4	69%	0.685	66%	0.664	S	S	*	*			trans	-103.2	86.8	173.9	64.5	0	0	0	0	111.3
23	S	30.4	Very low	44	Very low	95 Å²	95	120.6 Å²	120.6	66%	0.664	66%	0.656	S	S	*	*				-0.7	142.7	123.4	-126.9	0	0	0	0	114.2
24	N	38.8	Very low	44	Very low	142 Å²	142	120.6 Å²	120.6	76%	0.759	66%	0.655	S	S	*	*			cis	173.8	119.2	4.4	-123.7	-9.9	0	0	0	101.7
25	E	34.9	Very low	44.5	Very low	191 Å²	191	119.2 Å²	119.2	89%	0.893	65%	0.653	S	S	*	*			trans	-161.9	68	158.9	-94.1	-106.1	112.4	0	0	106.5
26	H	36.8	Very low	45.1	Very low	161 Å²	161	115.6 Å²	115.6	75%	0.745	65%	0.647	S	S	*	*			trans	-117.7	92.6	162	-82.6	75	0	0	0	106.5
27	G	35.2	Very low	46	Very low	53 Å²	53	117.1 Å²	117.1	55%	0.546	65%	0.652	S	S	.	*			trans	-56	163.2	169.3	0	0	0	0	0	112.1	V29	G27-V29 PolarHBondContact O-N 3.07Å
28	P	42.3	Very low	47.3	Very low	137 Å²	137	115.5 Å²	115.5	89%	0.89	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	54	-167.2	36.2	-36.6	0	0	0	112.5
29	V	46.2	Very low	48.4	Very low	117 Å²	117	116.8 Å²	116.8	71%	0.709	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-19.1	-176.1	-178	0	0	0	0	113.1	G27	G27-V29 PolarHBondContact O-N 3.07Å
30	K	43.3	Very low	49.8	Very low	149 Å²	149	114.3 Å²	114.3	65%	0.648	63%	0.627	S	S	*	*	H	α-helix	trans	-82.7	-17.4	-173.3	-99.5	175.9	177.3	173.4	0	116.6	S33	K30-S33 PolarHBondContact O-OG 3.14Å; K30-S33 VanDerWaalsContact O-OG 3.13Å
31	R	40.8	Very low	51.6	Low	228 Å²	228	110.5 Å²	110.5	86%	0.86	61%	0.609	S	S	*	*	H	α-helix	trans	-79.9	-27.7	-176.5	-151.3	173.8	-168.3	172.6	2.2	112.9	S35	R31-S35 PolarHBondContact O-N 3.3Å; R31-S35 PolarHBondContact O-OG 3.01Å
32	S	46.3	Very low	53.6	Low	83 Å²	83	113.7 Å²	113.7	58%	0.58	61%	0.607	S	S	*	*	H	α-helix	trans	-80.2	-31.4	179.1	-175.4	0	0	0	0	113.2	S35 T36	S32-S35 PolarHBondContact O-OG 3.43Å; S32-T36 PolarHBondContact O-N 2.83Å; S32-T36 PolarHBondContact O-OG1 3.12Å
33	S	50.7	Low	56	Low	64 Å²	64	113.3 Å²	113.3	45%	0.448	59%	0.594	S	S	.	*	H	α-helix	trans	-76.1	-34.4	178.6	54.5	0	0	0	0	111.9	K30 T36 L37	K30-S33 PolarHBondContact O-OG 3.14Å; K30-S33 VanDerWaalsContact O-OG 3.13Å; S33-T36 VanDerWaalsContact CA-OG1 3.28Å; S33-T36 WeakPolarHBondContact CA-OG1 3.41Å; S33-T36 PolarHBondContact O-OG1 3.3Å; S33-T36 VanDerWaalsContact O-OG1 3.08Å; S33-L37 PolarHBondContact O-N 2.83Å; S33-L37 VanDerWaalsContact O-N 3.12Å
34	Q	54.8	Low	58.7	Low	119 Å²	119	112.2 Å²	112.2	56%	0.556	58%	0.581	S	S	*	*	H	α-helix	trans	-71.1	-39.1	176.5	-165.8	166.7	2.2	0	0	111.4	T36 L37 E38	Q34-T36 PolarHBondContact O-N 3.41Å; Q34-L37 PolarHBondContact O-N 2.82Å; Q34-E38 WeakPolarHBondContact O-CB 3.43Å; Q34-E38 VanDerWaalsContact O-CG 3.25Å; Q34-E38 WeakPolarHBondContact O-CG 3.35Å; Q34-E38 PolarHBondContact O-N 2.81Å
35	S	64.3	Low	60.9	Low	59 Å²	59	112.1 Å²	112.1	41%	0.413	57%	0.569	S	S	.	*	H	α-helix	trans	-69.1	-30.8	175.4	64.9	0	0	0	0	113.5	R31 S32 R39	R31-S35 PolarHBondContact O-N 3.3Å; R31-S35 PolarHBondContact O-OG 3.01Å; S32-S35 PolarHBondContact O-OG 3.43Å; S35-R39 WeakPolarHBondContact O-CB 3.33Å; S35-R39 PolarHBondContact O-N 3.4Å
36	T	66.6	Low	63.3	Low	82 Å²	82	104.7 Å²	104.7	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-73.9	-38.5	175	27.9	0	0	0	0	112.2	S32 S33 Q34 R39 S40	S32-T36 PolarHBondContact O-N 2.83Å; S32-T36 PolarHBondContact O-OG1 3.12Å; S33-T36 VanDerWaalsContact CA-OG1 3.28Å; S33-T36 WeakPolarHBondContact CA-OG1 3.41Å; S33-T36 PolarHBondContact O-OG1 3.3Å; S33-T36 VanDerWaalsContact O-OG1 3.08Å; Q34-T36 PolarHBondContact O-N 3.41Å; T36-R39 PolarHBondContact O-N 2.85Å; T36-S40 PolarHBondContact O-N 2.71Å
37	L	70.3	Confident	65.8	Low	104 Å²	104	97 Å²	97	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-64	-49.7	172.5	-176.7	65.1	0	0	0	111.2	S33 Q34 R39 S40 E41	S33-L37 PolarHBondContact O-N 2.83Å; S33-L37 VanDerWaalsContact O-N 3.12Å; Q34-L37 PolarHBondContact O-N 2.82Å; L37-R39 VanDerWaalsContact C-N 3.27Å; L37-R39 PolarHBondContact O-N 3.18Å; L37-S40 PolarHBondContact O-N 3.03Å; L37-S40 PolarHBondContact O-OG 2.86Å; L37-E41 WeakPolarHBondContact O-CG 3.44Å; L37-E41 PolarHBondContact O-N 3.41Å
38	E	74.4	Confident	68.3	Low	99 Å²	99	97.1 Å²	97.1	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-57.9	-39.4	176.5	-73.8	169.7	-175.1	0	0	112.1	Q34 E41 Q42	Q34-E38 WeakPolarHBondContact O-CB 3.43Å; Q34-E38 VanDerWaalsContact O-CG 3.25Å; Q34-E38 WeakPolarHBondContact O-CG 3.35Å; Q34-E38 PolarHBondContact O-N 2.81Å; E38-E41 PolarHBondContact O-N 2.79Å; E38-Q42 WeakPolarHBondContact O-CG 3.39Å; E38-Q42 PolarHBondContact O-N 3.49Å
39	R	72.8	Confident	70.4	Confident	162 Å²	162	91.9 Å²	91.9	61%	0.611	46%	0.464	S	S	*	.	H	α-helix	trans	-64.6	-42.6	174.3	-175.5	-179.5	-178.2	101.3	-0.3	112	S35 T36 L37 E41 Q42 Q43	S35-R39 WeakPolarHBondContact O-CB 3.33Å; S35-R39 PolarHBondContact O-N 3.4Å; T36-R39 PolarHBondContact O-N 2.85Å; L37-R39 VanDerWaalsContact C-N 3.27Å; L37-R39 PolarHBondContact O-N 3.18Å; R39-E41 VanDerWaalsContact C-N 3.34Å; R39-E41 PolarHBondContact O-N 2.84Å; R39-Q42 PolarHBondContact O-N 2.79Å; R39-Q43 WeakPolarHBondContact O-CG 3.44Å; R39-Q43 PolarHBondContact O-N 2.99Å
40	S	77.8	Confident	72.1	Confident	39 Å²	39	86.5 Å²	86.5	27%	0.273	43%	0.432	S	S	.	.	H	α-helix	trans	-64.7	-38.7	178.1	72.2	0	0	0	0	112.1	T36 L37 Q43 I44	T36-S40 PolarHBondContact O-N 2.71Å; L37-S40 PolarHBondContact O-N 3.03Å; L37-S40 PolarHBondContact O-OG 2.86Å; S40-Q43 PolarHBondContact O-N 3.39Å; S40-I44 WeakPolarHBondContact O-CG1 3.35Å; S40-I44 PolarHBondContact O-N 3.41Å
41	E	82.4	Confident	73.8	Confident	77 Å²	77	82.4 Å²	82.4	36%	0.36	42%	0.415	S	S	.	.	H	α-helix	trans	-66.5	-40.8	175.6	-64.8	-174.6	177.1	0	0	112.1	L37 E38 R39 Q43 I44 R45	L37-E41 WeakPolarHBondContact O-CG 3.44Å; L37-E41 PolarHBondContact O-N 3.41Å; E38-E41 PolarHBondContact O-N 2.79Å; R39-E41 VanDerWaalsContact C-N 3.34Å; R39-E41 PolarHBondContact O-N 2.84Å; E41-Q43 VanDerWaalsContact C-N 3.29Å; E41-Q43 PolarHBondContact O-N 2.88Å; E41-I44 PolarHBondContact O-N 3.49Å; E41-R45 VanDerWaalsContact CB-NH1 3.28Å; E41-R45 WeakPolarHBondContact O-CG 3.28Å; E41-R45 PolarHBondContact O-N 3.33Å; E41-R45 IonicContact OE2-CZ 2.64Å; E41-R45 IonicContact OE2-NH1 3.82Å; E41-R45 PolarHBondContact OE2-NH1 2.73Å; E41-R45 IonicContact OE2-NH2 3.67Å; E41-R45 PolarHBondContact OE2-NH2 3.09Å
42	Q	82.7	Confident	75.9	Confident	128 Å²	128	74.7 Å²	74.7	60%	0.598	39%	0.389	S	S	*	.	H	α-helix	trans	-60.5	-41	174.7	-75.2	172.3	-4.1	0	0	111.4	E38 R39 R45 A46	E38-Q42 WeakPolarHBondContact O-CG 3.39Å; E38-Q42 PolarHBondContact O-N 3.49Å; R39-Q42 PolarHBondContact O-N 2.79Å; Q42-R45 PolarHBondContact O-N 3.4Å; Q42-A46 VanDerWaalsContact O-CB 3.3Å; Q42-A46 WeakPolarHBondContact O-CB 3.22Å; Q42-A46 PolarHBondContact O-N 3.03Å
43	Q	84.8	Confident	77.7	Confident	90 Å²	90	72.8 Å²	72.8	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-42.7	175.9	-70	178.4	-70.5	0	0	111.9	R39 S40 E41 A46 A47 I56	R39-Q43 WeakPolarHBondContact O-CG 3.44Å; R39-Q43 PolarHBondContact O-N 2.99Å; S40-Q43 PolarHBondContact O-N 3.39Å; E41-Q43 VanDerWaalsContact C-N 3.29Å; E41-Q43 PolarHBondContact O-N 2.88Å; Q43-A46 PolarHBondContact O-N 2.97Å; Q43-A47 PolarHBondContact O-N 2.89Å; Q43-I56 HydrophobicContact CB-CD1 4.05Å; Q43-I56 HydrophobicContact CB-CG1 4.43Å; Q43-I56 HydrophobicContact CB-CG2 4.11Å; Q43-I56 WeakPolarHBondContact O-CD1 3.29Å
44	I	85.8	Confident	79.1	Confident	73 Å²	73	70.8 Å²	70.8	37%	0.374	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-44.8	176.5	-70	167.6	0	0	0	111	S40 E41 A46 A47 L53 I56 T57	S40-I44 WeakPolarHBondContact O-CG1 3.35Å; S40-I44 PolarHBondContact O-N 3.41Å; E41-I44 PolarHBondContact O-N 3.49Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 2.83Å; I44-A47 WeakPolarHBondContact O-CB 3.17Å; I44-A47 PolarHBondContact O-N 3.48Å; I44-L53 HydrophobicContact CG2-CD1 3.86Å; I44-I56 HydrophobicContact CG1-CG2 3.73Å; I44-T57 HydrophobicContact CD1-CG2 4.15Å; I44-T57 HydrophobicContact CG1-CG2 4.23Å
45	R	85.3	Confident	80.2	Confident	139 Å²	139	70.7 Å²	70.7	53%	0.525	35%	0.35	S	S	.	.	H	α-helix	trans	-63.7	-39	177.5	-69.5	179.9	-167.7	104.2	4	111.8	E41 Q42 A47	E41-R45 VanDerWaalsContact CB-NH1 3.28Å; E41-R45 WeakPolarHBondContact O-CG 3.28Å; E41-R45 PolarHBondContact O-N 3.33Å; E41-R45 IonicContact OE2-CZ 2.64Å; E41-R45 IonicContact OE2-NH1 3.82Å; E41-R45 PolarHBondContact OE2-NH1 2.73Å; E41-R45 IonicContact OE2-NH2 3.67Å; E41-R45 PolarHBondContact OE2-NH2 3.09Å; Q42-R45 PolarHBondContact O-N 3.4Å; R45-A47 VanDerWaalsContact C-N 3.34Å
46	A	86.6	Confident	81.1	Confident	36 Å²	36	70.3 Å²	70.3	30%	0.298	34%	0.343	S	S	.	.	H	α-helix	trans	-80.4	-10.3	-178.1	0	0	0	0	0	114.5	Q42 Q43 I44 S48 E148	Q42-A46 VanDerWaalsContact O-CB 3.3Å; Q42-A46 WeakPolarHBondContact O-CB 3.22Å; Q42-A46 PolarHBondContact O-N 3.03Å; Q43-A46 PolarHBondContact O-N 2.97Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 2.83Å; A46-S48 PolarHBondContact O-N 3.32Å; A46-E148 HydrophobicContact CB-CG 4.29Å
47	A	89.4	Confident	81.6	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.337	C	S	.	.			trans	-53.4	132.2	-177.5	0	0	0	0	0	111	Q43 I44 R45 E52 L53 I56 W106 N147	Q43-A47 PolarHBondContact O-N 2.89Å; I44-A47 WeakPolarHBondContact O-CB 3.17Å; I44-A47 PolarHBondContact O-N 3.48Å; R45-A47 VanDerWaalsContact C-N 3.34Å; A47-E52 HydrophobicContact CB-CB 4.44Å; A47-E52 HydrophobicContact CB-CG 4.26Å; A47-L53 HydrophobicContact CB-CB 4.09Å; A47-L53 HydrophobicContact CB-CD1 4.35Å; A47-I56 HydrophobicContact CB-CD1 4.08Å; A47-W106 WeakPolarHBondContact O-CZ2 3.41Å; A47-N147 WeakPolarHBondContact O-CB 3.41Å; A47-N147 VanDerWaalsContact O-CG 3.3Å
48	S	86.7	Confident	81.5	Confident	54 Å²	54	68.3 Å²	68.3	38%	0.378	33%	0.329	S	S	.	.			trans	-100.2	-9.2	-171.6	67.4	0	0	0	0	115.2	A46 E52 W106 N147	A46-S48 PolarHBondContact O-N 3.32Å; S48-E52 VanDerWaalsContact CB-OE2 3.31Å; S48-E52 WeakPolarHBondContact CB-OE2 3.47Å; S48-E52 PolarHBondContact N-OE2 3.25Å; S48-E52 PolarHBondContact OG-OE2 2.88Å; S48-W106 PolarHBondContact O-NE1 3.36Å; S48-N147 VanDerWaalsContact CA-ND2 3.31Å; S48-N147 WeakPolarHBondContact CA-ND2 3.33Å; S48-N147 WeakPolarHBondContact CB-ND2 3.47Å
49	S	86	Confident	81.2	Confident	27 Å²	27	66.8 Å²	66.8	19%	0.189	33%	0.329	C	S	.	.	S	Bend	trans	-155	163.2	-179.4	59.3	0	0	0	0	110.4	E51 E52 L53	S49-E51 PolarHBondContact O-N 2.96Å; S49-E52 PolarHBondContact O-N 2.98Å; S49-E52 PolarHBondContact OG-N 3.32Å; S49-L53 PolarHBondContact O-N 3.27Å
50	L	83	Confident	80.6	Confident	5 Å²	5	66.2 Å²	66.2	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-37.4	171.9	-177.1	61.9	0	0	0	111.7	E52 L53 L54 W65 L99 I102 D103	L50-E52 PolarHBondContact O-N 3.41Å; L50-L53 PolarHBondContact O-N 3.29Å; L50-L54 HydrophobicContact CD1-CD1 4.23Å; L50-L54 HydrophobicContact CD1-CG 4.13Å; L50-L54 HydrophobicContact CG-CD1 3.98Å; L50-L54 HydrophobicContact CG-CG 4.31Å; L50-L54 WeakPolarHBondContact O-CB 3.43Å; L50-L54 VanDerWaalsContact O-CG 3.26Å; L50-L54 WeakPolarHBondContact O-CG 3.35Å; L50-L54 PolarHBondContact O-N 2.99Å; L50-W65 HydrophobicContact CD2-CH2 4.43Å; L50-W65 HydrophobicContact CD2-CZ2 4.4Å; L50-L99 HydrophobicContact CD1-CD2 4.14Å; L50-L99 HydrophobicContact CD2-CB 3.96Å; L50-L99 HydrophobicContact CD2-CD2 4.07Å; L50-L99 WeakPolarHBondContact CD2-O 3.05Å; L50-I102 HydrophobicContact CD1-CG2 4.05Å; L50-I102 HydrophobicContact CD2-CG2 4.43Å; L50-D103 HydrophobicContact CB-CB 4.28Å; L50-D103 HydrophobicContact CD2-CB 3.84Å
51	E	78.3	Confident	79.8	Confident	63 Å²	63	66.6 Å²	66.6	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-42.1	177.2	-176.4	176.5	-167.5	0	0	112	S49 R55 R66	S49-E51 PolarHBondContact O-N 2.96Å; E51-R55 WeakPolarHBondContact O-CB 3.43Å; E51-R55 PolarHBondContact O-N 3.03Å; E51-R55 VanDerWaalsContact O-N 3.09Å; E51-R66 IonicContact OE1-CZ 2.87Å; E51-R66 IonicContact OE1-NE 2.63Å; E51-R66 PolarHBondContact OE1-NE 3.49Å
52	E	84.2	Confident	79.1	Confident	66 Å²	66	64.5 Å²	64.5	31%	0.308	32%	0.322	S	S	.	.	H	α-helix	trans	-68.3	-42.7	177	-172.5	170.1	-162.3	0	0	111.6	A47 S48 S49 L50 L54 R55 I56	A47-E52 HydrophobicContact CB-CB 4.44Å; A47-E52 HydrophobicContact CB-CG 4.26Å; S48-E52 VanDerWaalsContact CB-OE2 3.31Å; S48-E52 WeakPolarHBondContact CB-OE2 3.47Å; S48-E52 PolarHBondContact N-OE2 3.25Å; S48-E52 PolarHBondContact OG-OE2 2.88Å; S49-E52 PolarHBondContact O-N 2.98Å; S49-E52 PolarHBondContact OG-N 3.32Å; L50-E52 PolarHBondContact O-N 3.41Å; E52-L54 PolarHBondContact O-N 3.41Å; E52-R55 WeakPolarHBondContact O-CB 3.31Å; E52-R55 PolarHBondContact O-N 3.36Å; E52-I56 HydrophobicContact CG-CD1 4.03Å; E52-I56 WeakPolarHBondContact O-CD1 3.49Å; E52-I56 WeakPolarHBondContact O-CG1 3.48Å; E52-I56 PolarHBondContact O-N 3.16Å
53	L	85	Confident	78.3	Confident	43 Å²	43	62.1 Å²	62.1	23%	0.225	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-46.4	177.2	-179.6	64.3	0	0	0	111.9	I44 A47 S49 L50 R55 I56 T57	I44-L53 HydrophobicContact CG2-CD1 3.86Å; A47-L53 HydrophobicContact CB-CB 4.09Å; A47-L53 HydrophobicContact CB-CD1 4.35Å; S49-L53 PolarHBondContact O-N 3.27Å; L50-L53 PolarHBondContact O-N 3.29Å; L53-R55 VanDerWaalsContact C-N 3.29Å; L53-R55 PolarHBondContact O-N 3.34Å; L53-I56 PolarHBondContact O-N 2.93Å; L53-T57 HydrophobicContact CD1-CG2 4.31Å; L53-T57 WeakPolarHBondContact O-CG2 3.34Å; L53-T57 PolarHBondContact O-N 2.95Å; L53-T57 PolarHBondContact O-OG1 3.1Å
54	L	79.6	Confident	77.4	Confident	21 Å²	21	60 Å²	60	11%	0.11	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-32.5	177.7	-69.8	176.5	0	0	0	111.9	L50 E52 H58 W65	L50-L54 HydrophobicContact CD1-CD1 4.23Å; L50-L54 HydrophobicContact CD1-CG 4.13Å; L50-L54 HydrophobicContact CG-CD1 3.98Å; L50-L54 HydrophobicContact CG-CG 4.31Å; L50-L54 WeakPolarHBondContact O-CB 3.43Å; L50-L54 VanDerWaalsContact O-CG 3.26Å; L50-L54 WeakPolarHBondContact O-CG 3.35Å; L50-L54 PolarHBondContact O-N 2.99Å; E52-L54 PolarHBondContact O-N 3.41Å; L54-H58 CarbonylContact O-C 3.48Å; L54-H58 VanDerWaalsContact O-CA 3.3Å; L54-H58 WeakPolarHBondContact O-CA 3.49Å; L54-H58 WeakPolarHBondContact O-CB 3.29Å; L54-H58 PolarHBondContact O-N 3.39Å; L54-W65 HydrophobicContact CD1-CD2 3.88Å; L54-W65 HydrophobicContact CD1-CE3 3.94Å; L54-W65 HydrophobicContact CD1-CG 4.49Å; L54-W65 HydrophobicContact CD1-CH2 4.12Å; L54-W65 HydrophobicContact CD1-CZ2 4.08Å; L54-W65 HydrophobicContact CD1-CZ3 4.06Å
55	R	78.8	Confident	76.4	Confident	117 Å²	117	58.4 Å²	58.4	44%	0.442	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-35.5	175.8	-163.3	-173.5	-42.1	176.4	8.8	112.7	E51 E52 L53 S59 W62	E51-R55 WeakPolarHBondContact O-CB 3.43Å; E51-R55 PolarHBondContact O-N 3.03Å; E51-R55 VanDerWaalsContact O-N 3.09Å; E52-R55 WeakPolarHBondContact O-CB 3.31Å; E52-R55 PolarHBondContact O-N 3.36Å; L53-R55 VanDerWaalsContact C-N 3.29Å; L53-R55 PolarHBondContact O-N 3.34Å; R55-S59 WeakPolarHBondContact O-CA 3.17Å; R55-W62 HydrophobicContact CB-CG 4.48Å; R55-W62 HydrophobicContact CG-CD2 4.33Å; R55-W62 HydrophobicContact CG-CG 4.34Å
56	I	82.4	Confident	75.6	Confident	52 Å²	52	54.8 Å²	54.8	27%	0.267	28%	0.276	S	S	.	.	H	α-helix	trans	-74.1	-40.3	177.7	-65.1	158.6	0	0	0	111	Q43 I44 A47 E52 L53	Q43-I56 HydrophobicContact CB-CD1 4.05Å; Q43-I56 HydrophobicContact CB-CG1 4.43Å; Q43-I56 HydrophobicContact CB-CG2 4.11Å; Q43-I56 WeakPolarHBondContact O-CD1 3.29Å; I44-I56 HydrophobicContact CG1-CG2 3.73Å; A47-I56 HydrophobicContact CB-CD1 4.08Å; E52-I56 HydrophobicContact CG-CD1 4.03Å; E52-I56 WeakPolarHBondContact O-CD1 3.49Å; E52-I56 WeakPolarHBondContact O-CG1 3.48Å; E52-I56 PolarHBondContact O-N 3.16Å; L53-I56 PolarHBondContact O-N 2.93Å
57	T	76.9	Confident	74.7	Confident	59 Å²	59	53.3 Å²	53.3	36%	0.362	26%	0.263	S	S	.	.	H	α-helix	trans	-89.4	-27.1	-174.1	52.2	0	0	0	0	113.9	I44 L53	I44-T57 HydrophobicContact CD1-CG2 4.15Å; I44-T57 HydrophobicContact CG1-CG2 4.23Å; L53-T57 HydrophobicContact CD1-CG2 4.31Å; L53-T57 WeakPolarHBondContact O-CG2 3.34Å; L53-T57 PolarHBondContact O-N 2.95Å; L53-T57 PolarHBondContact O-OG1 3.1Å
58	H	69.6	Low	73.5	Confident	84 Å²	84	57.3 Å²	57.3	39%	0.389	28%	0.279	S	S	.	.			trans	-142.5	59.3	-172.9	-59.5	-69.5	0	0	0	111.6	L54 E60 D61 W62	L54-H58 CarbonylContact O-C 3.48Å; L54-H58 VanDerWaalsContact O-CA 3.3Å; L54-H58 WeakPolarHBondContact O-CA 3.49Å; L54-H58 WeakPolarHBondContact O-CB 3.29Å; L54-H58 PolarHBondContact O-N 3.39Å; H58-E60 VanDerWaalsContact C-N 3.25Å; H58-E60 PolarHBondContact O-N 2.88Å; H58-D61 PolarHBondContact O-N 2.87Å; H58-D61 VanDerWaalsContact O-N 3.17Å; H58-W62 PolarHBondContact O-N 3.39Å; H58-W62 VanDerWaalsContact O-N 3.08Å
59	S	66.3	Low	72.4	Confident	67 Å²	67	58.4 Å²	58.4	47%	0.469	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.1	-175	62	0	0	0	0	115.3	R55 W62	R55-S59 WeakPolarHBondContact O-CA 3.17Å; S59-W62 PolarHBondContact O-NE1 3.41Å
60	E	61.3	Low	71.3	Confident	151 Å²	151	62.9 Å²	62.9	71%	0.706	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-28.7	-179.5	-60.8	-55.7	120.7	0	0	112.3	H58	H58-E60 VanDerWaalsContact C-N 3.25Å; H58-E60 PolarHBondContact O-N 2.88Å
61	D	61.1	Low	70.3	Confident	46 Å²	46	67.1 Å²	67.1	25%	0.246	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-14.5	-166	-69.2	-30.9	0	0	0	114.2	H58 K63 L64 W65 A90	H58-D61 PolarHBondContact O-N 2.87Å; H58-D61 VanDerWaalsContact O-N 3.17Å; D61-K63 PolarHBondContact O-N 3.34Å; D61-L64 WeakPolarHBondContact O-CB 3.37Å; D61-L64 PolarHBondContact O-N 2.82Å; D61-L64 VanDerWaalsContact O-N 3.13Å; D61-W65 PolarHBondContact O-N 3.4Å; D61-A90 HydrophobicContact CB-CB 3.71Å; D61-A90 WeakPolarHBondContact OD1-CB 3.43Å; D61-A90 WeakPolarHBondContact OD2-CA 3.05Å; D61-A90 VanDerWaalsContact OD2-CB 3.24Å; D61-A90 WeakPolarHBondContact OD2-CB 3.04Å
62	W	66.6	Low	69.2	Low	34 Å²	34	70.2 Å²	70.2	13%	0.129	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-31.4	-177.4	80.4	-85.6	0	0	0	112.5	R55 H58 S59 W65 R66	R55-W62 HydrophobicContact CB-CG 4.48Å; R55-W62 HydrophobicContact CG-CD2 4.33Å; R55-W62 HydrophobicContact CG-CG 4.34Å; H58-W62 PolarHBondContact O-N 3.39Å; H58-W62 VanDerWaalsContact O-N 3.08Å; S59-W62 PolarHBondContact O-NE1 3.41Å; W62-W65 WeakPolarHBondContact O-CB 3.5Å; W62-W65 PolarHBondContact O-N 2.71Å; W62-R66 WeakPolarHBondContact O-CB 3Å; W62-R66 PolarHBondContact O-N 3.05Å
63	K	67.1	Low	67.5	Low	77 Å²	77	71.5 Å²	71.5	34%	0.335	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-46	176.4	-63.2	177.6	177.9	-173.9	0	111.3	D61 W65 R66 C67 E266	D61-K63 PolarHBondContact O-N 3.34Å; K63-W65 VanDerWaalsContact C-N 3.31Å; K63-W65 PolarHBondContact O-N 2.67Å; K63-R66 PolarHBondContact O-N 3.05Å; K63-C67 PolarHBondContact O-N 3.33Å; K63-C67 VanDerWaalsContact O-N 3.14Å; K63-E266 HydrophobicContact CD-CG 4.19Å; K63-E266 VanDerWaalsContact CD-OE1 3.3Å; K63-E266 WeakPolarHBondContact CD-OE1 3.41Å; K63-E266 VanDerWaalsContact CE-CD 3.47Å; K63-E266 WeakPolarHBondContact CE-OE1 3.4Å; K63-E266 WeakPolarHBondContact CE-OE2 3.48Å; K63-E266 IonicContact NZ-OE1 3.19Å; K63-E266 PolarHBondContact NZ-OE1 2.03Å; K63-E266 IonicContact NZ-OE2 2.71Å
64	L	64.7	Low	65.5	Low	46 Å²	46	77.4 Å²	77.4	24%	0.241	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-38	176.1	179.1	60.8	0	0	0	111	D61 R68 A90 L257	D61-L64 WeakPolarHBondContact O-CB 3.37Å; D61-L64 PolarHBondContact O-N 2.82Å; D61-L64 VanDerWaalsContact O-N 3.13Å; L64-R68 VanDerWaalsContact CD2-NH2 3.31Å; L64-R68 VanDerWaalsContact O-CG 3.32Å; L64-R68 WeakPolarHBondContact O-CG 3.37Å; L64-R68 PolarHBondContact O-N 3.07Å; L64-A90 HydrophobicContact CD2-CB 4.01Å; L64-L257 HydrophobicContact CB-CD2 4.26Å; L64-L257 HydrophobicContact CD1-CD2 3.59Å; L64-L257 HydrophobicContact CG-CD2 4.42Å
65	W	65.8	Low	63.5	Low	39 Å²	39	80.8 Å²	80.8	15%	0.148	39%	0.39	C	S	.	.	H	α-helix	trans	-63.6	-50.5	174.2	178.4	81.9	0	0	0	112.9	L50 L54 D61 W62 K63 C67 R68 L69 L99	L50-W65 HydrophobicContact CD2-CH2 4.43Å; L50-W65 HydrophobicContact CD2-CZ2 4.4Å; L54-W65 HydrophobicContact CD1-CD2 3.88Å; L54-W65 HydrophobicContact CD1-CE3 3.94Å; L54-W65 HydrophobicContact CD1-CG 4.49Å; L54-W65 HydrophobicContact CD1-CH2 4.12Å; L54-W65 HydrophobicContact CD1-CZ2 4.08Å; L54-W65 HydrophobicContact CD1-CZ3 4.06Å; D61-W65 PolarHBondContact O-N 3.4Å; W62-W65 WeakPolarHBondContact O-CB 3.5Å; W62-W65 PolarHBondContact O-N 2.71Å; K63-W65 VanDerWaalsContact C-N 3.31Å; K63-W65 PolarHBondContact O-N 2.67Å; W65-C67 PolarHBondContact O-N 3Å; W65-R68 WeakPolarHBondContact O-CB 3.08Å; W65-R68 PolarHBondContact O-N 3.46Å; W65-R68 VanDerWaalsContact O-N 3.08Å; W65-L69 HydrophobicContact CH2-CD2 3.91Å; W65-L69 HydrophobicContact CZ2-CD2 4.22Å; W65-L69 HydrophobicContact CZ3-CD2 4.41Å; W65-L69 PolarHBondContact O-N 3.02Å; W65-L99 HydrophobicContact CZ2-CB 3.99Å; W65-L99 HydrophobicContact CZ2-CD1 4.17Å
66	R	67.4	Low	61.8	Low	63 Å²	63	81.7 Å²	81.7	24%	0.238	41%	0.413	C	S	.	.	H	α-helix	trans	-55.1	-39	178.6	-173.7	174.5	-169.5	-148.2	5.8	111.3	E51 W62 K63 L69 R70	E51-R66 IonicContact OE1-CZ 2.87Å; E51-R66 IonicContact OE1-NE 2.63Å; E51-R66 PolarHBondContact OE1-NE 3.49Å; W62-R66 WeakPolarHBondContact O-CB 3Å; W62-R66 PolarHBondContact O-N 3.05Å; K63-R66 PolarHBondContact O-N 3.05Å; R66-L69 PolarHBondContact O-N 3.37Å; R66-R70 PolarHBondContact O-N 2.93Å; R66-R70 VanDerWaalsContact O-N 3.15Å
67	C	68.4	Low	59.6	Low	5 Å²	5	86.5 Å²	86.5	3%	0.034	44%	0.437	C	S	.	.	H	α-helix	trans	-72.7	-40.9	177.1	-72.4	0	0	0	0	114	K63 W65 L69 R70 L71 F264 C269	K63-C67 PolarHBondContact O-N 3.33Å; K63-C67 VanDerWaalsContact O-N 3.14Å; W65-C67 PolarHBondContact O-N 3Å; C67-L69 PolarHBondContact O-N 3.49Å; C67-R70 PolarHBondContact O-N 3.34Å; C67-R70 VanDerWaalsContact O-N 3.17Å; C67-L71 HydrophobicContact CB-CD1 4.18Å; C67-L71 WeakPolarHBondContact O-CB 3.49Å; C67-L71 WeakPolarHBondContact O-CD1 3.39Å; C67-L71 PolarHBondContact O-N 2.84Å; C67-F264 HydrophobicContact CB-CZ 3.94Å; C67-F264 WeakPolarHBondContact SG-CZ 2.99Å; C67-C269 WeakPolarHBondContact CA-SG 3.32Å; C67-C269 HydrophobicContact CB-CB 3.45Å; C67-C269 VanDerWaalsContact CB-CB 3.45Å; C67-C269 WeakPolarHBondContact CB-SG 3.44Å; C67-C269 WeakPolarHBondContact SG-CA 3.26Å; C67-C269 WeakPolarHBondContact SG-CB 3.38Å; C67-C269 CovalentContact SG-SG 2.04Å; C67-C269 PolarHBondContact SG-SG 2.62Å
68	R	64.8	Low	57.4	Low	85 Å²	85	90.8 Å²	90.8	32%	0.321	46%	0.457	S	S	.	.	H	α-helix	trans	-57.2	-36.4	171.1	-73.8	171.6	-179.9	160.9	3.2	112.8	L64 W65 K72 A91 I96	L64-R68 VanDerWaalsContact CD2-NH2 3.31Å; L64-R68 VanDerWaalsContact O-CG 3.32Å; L64-R68 WeakPolarHBondContact O-CG 3.37Å; L64-R68 PolarHBondContact O-N 3.07Å; W65-R68 WeakPolarHBondContact O-CB 3.08Å; W65-R68 PolarHBondContact O-N 3.46Å; W65-R68 VanDerWaalsContact O-N 3.08Å; R68-K72 PolarHBondContact O-N 3.25Å; R68-A91 VanDerWaalsContact NH1-CA 3.32Å; R68-A91 VanDerWaalsContact NH1-CB 3.32Å; R68-I96 HydrophobicContact CB-CD1 3.91Å
69	L	63.8	Low	56	Low	76 Å²	76	92.9 Å²	92.9	40%	0.398	48%	0.481	S	S	.	.	H	α-helix	trans	-67.6	-43.3	176.5	-168.7	70.5	0	0	0	111.9	W65 R66 C67 I96	W65-L69 HydrophobicContact CH2-CD2 3.91Å; W65-L69 HydrophobicContact CZ2-CD2 4.22Å; W65-L69 HydrophobicContact CZ3-CD2 4.41Å; W65-L69 PolarHBondContact O-N 3.02Å; R66-L69 PolarHBondContact O-N 3.37Å; C67-L69 PolarHBondContact O-N 3.49Å; L69-I96 HydrophobicContact CD1-CG2 3.65Å
70	R	63.1	Low	55.1	Low	121 Å²	121	100.7 Å²	100.7	46%	0.457	50%	0.501	S	S	.	.	H	α-helix	trans	-67.8	-39.8	176.4	-76.2	-171.6	172.7	173.4	1.1	113.1	R66 C67 K72 S73 D267	R66-R70 PolarHBondContact O-N 2.93Å; R66-R70 VanDerWaalsContact O-N 3.15Å; C67-R70 PolarHBondContact O-N 3.34Å; C67-R70 VanDerWaalsContact O-N 3.17Å; R70-K72 VanDerWaalsContact C-N 3.34Å; R70-K72 PolarHBondContact O-N 3.07Å; R70-S73 WeakPolarHBondContact O-CB 3.03Å; R70-S73 PolarHBondContact O-N 3.23Å; R70-D267 PolarHBondContact NH1-O 2.72Å
71	L	60.8	Low	54	Low	94 Å²	94	99 Å²	99	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-70.3	-23.9	-177.9	-87.3	113.2	0	0	0	113.5	C67 S73 F74 C269	C67-L71 HydrophobicContact CB-CD1 4.18Å; C67-L71 WeakPolarHBondContact O-CB 3.49Å; C67-L71 WeakPolarHBondContact O-CD1 3.39Å; C67-L71 PolarHBondContact O-N 2.84Å; L71-S73 PolarHBondContact O-N 3.48Å; L71-F74 CarbonylContact O-C 3.51Å; L71-F74 PolarHBondContact O-N 3.49Å; L71-C269 HydrophobicContact CD1-CB 3.71Å
72	K	54.6	Low	52.9	Low	128 Å²	128	100.7 Å²	100.7	56%	0.557	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-2.6	172.3	-105.3	-177.8	177.7	-179.7	0	114.1	R68 R70 F74 I96	R68-K72 PolarHBondContact O-N 3.25Å; R70-K72 VanDerWaalsContact C-N 3.34Å; R70-K72 PolarHBondContact O-N 3.07Å; K72-F74 VanDerWaalsContact C-N 3.26Å; K72-I96 HydrophobicContact CD-CD1 4.15Å; K72-I96 HydrophobicContact CD-CG2 4.38Å
73	S	49	Very low	51.5	Low	93 Å²	93	104.4 Å²	104.4	65%	0.65	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-18.3	163.7	-179.9	0	0	0	0	113.2	R70 L71	R70-S73 WeakPolarHBondContact O-CB 3.03Å; R70-S73 PolarHBondContact O-N 3.23Å; L71-S73 PolarHBondContact O-N 3.48Å
74	F	44.3	Very low	50.6	Low	167 Å²	167	108.8 Å²	108.8	73%	0.732	58%	0.578	S	S	*	*	S	Bend	trans	-141	115.8	-179.9	-86.3	-94.5	0	0	0	108.8	L71 K72	L71-F74 CarbonylContact O-C 3.51Å; L71-F74 PolarHBondContact O-N 3.49Å; K72-F74 VanDerWaalsContact C-N 3.26Å
75	T	36.3	Very low	49.4	Very low	93 Å²	93	116.5 Å²	116.5	57%	0.571	60%	0.604	S	S	*	*			trans	99.2	94.9	174.8	76.2	0	0	0	0	116.3	M77	T75-M77 VanDerWaalsContact C-N 3.28Å; T75-M77 HydrophobicContact CG2-CG 4.21Å; T75-M77 HydrophobicContact CG2-SD 3.86Å; T75-M77 PolarHBondContact O-N 2.88Å
76	S	43.1	Very low	48.1	Very low	135 Å²	135	120.4 Å²	120.4	94%	0.944	64%	0.637	S	S	*	*			trans	-60.5	99.5	130	179	0	0	0	0	106.3
77	M	37.2	Very low	47	Very low	153 Å²	153	122.2 Å²	122.2	75%	0.754	66%	0.656	S	S	*	*			trans	-119.5	128.8	170.4	-101.6	174.4	79.2	0	0	109.1	T75	T75-M77 VanDerWaalsContact C-N 3.28Å; T75-M77 HydrophobicContact CG2-CG 4.21Å; T75-M77 HydrophobicContact CG2-SD 3.86Å; T75-M77 PolarHBondContact O-N 2.88Å
78	D	31	Very low	46	Very low	149 Å²	149	130.6 Å²	130.6	80%	0.797	69%	0.687	S	S	*	*			trans	-45.5	137.8	-168.5	-80.2	-60.2	0	0	0	115.7	R80	D78-R80 PolarHBondContact O-N 3.35Å
79	S	40.5	Very low	45	Very low	128 Å²	128	135.3 Å²	135.3	90%	0.895	71%	0.71	S	S	*	*	S	Bend	trans	-68.2	34.6	172.5	-45.3	0	0	0	0	114.3
80	R	45.5	Very low	43.9	Very low	231 Å²	231	133.2 Å²	133.2	87%	0.872	70%	0.704	S	S	*	*			trans	-139.8	62.8	-172.9	-64.8	-173	-179.9	174.3	1.4	113.8	D78	D78-R80 PolarHBondContact O-N 3.35Å
81	S	38.4	Very low	43	Very low	116 Å²	116	129.8 Å²	129.8	81%	0.811	70%	0.701	S	S	*	*			trans	-160.7	67.4	144.3	-163.2	0	0	0	0	110.3	S83	S81-S83 PolarHBondContact O-N 2.79Å
82	A	39.3	Very low	42.4	Very low	82 Å²	82	129.3 Å²	129.3	68%	0.678	70%	0.702	S	S	*	*			trans	-87.6	78.1	172.6	0	0	0	0	0	109.6	H84	A82-H84 VanDerWaalsContact C-N 3.35Å; A82-H84 PolarHBondContact O-CD2 3.01Å; A82-H84 PolarHBondContact O-N 3.26Å
83	S	37.2	Very low	42.5	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	71%	0.708	S	S	*	*			trans	-70.4	96.2	160.3	167.8	0	0	0	0	108.4	S81 R85	S81-S83 PolarHBondContact O-N 2.79Å; S83-R85 PolarHBondContact O-N 3.44Å; S83-R85 VanDerWaalsContact O-N 3.14Å
84	H	48.3	Very low	43.2	Very low	169 Å²	169	133.1 Å²	133.1	78%	0.782	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	107.1	177.6	-87.8	-102.1	0	0	0	113.1	A82	A82-H84 VanDerWaalsContact C-N 3.35Å; A82-H84 PolarHBondContact O-CD2 3.01Å; A82-H84 PolarHBondContact O-N 3.26Å
85	R	38.4	Very low	44.5	Very low	209 Å²	209	129.7 Å²	129.7	79%	0.789	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.6	-17.9	138	-115.7	176.3	171.1	124.8	-4.7	114	S83	S83-R85 PolarHBondContact O-N 3.44Å; S83-R85 VanDerWaalsContact O-N 3.14Å
86	S	39.9	Very low	46.2	Very low	120 Å²	120	126.6 Å²	126.6	84%	0.839	67%	0.674	S	S	*	*	S	Bend	trans	-109.9	43.9	-168.5	-160.4	0	0	0	0	114.8
87	T	44.1	Very low	47.7	Very low	102 Å²	102	124.7 Å²	124.7	63%	0.626	65%	0.649	S	S	*	*			trans	-117.1	15.5	172.1	45.6	0	0	0	0	112.5	F89	T87-F89 PolarHBondContact O-N 3.35Å
88	R	46	Very low	49.9	Very low	181 Å²	181	120.5 Å²	120.5	68%	0.683	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-9.6	-147.7	-106.1	-178.3	-174.2	-179.6	0.7	119.4
89	F	43.7	Very low	52.1	Low	183 Å²	183	113.8 Å²	113.8	80%	0.803	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.6	-10.9	-177.2	-95.3	-83.8	0	0	0	118.9	T87	T87-F89 PolarHBondContact O-N 3.35Å
90	A	41.2	Very low	54	Low	33 Å²	33	112.1 Å²	112.1	27%	0.273	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.7	-16.6	-172.8	0	0	0	0	0	115.7	D61 L64	D61-A90 HydrophobicContact CB-CB 3.71Å; D61-A90 WeakPolarHBondContact OD1-CB 3.43Å; D61-A90 WeakPolarHBondContact OD2-CA 3.05Å; D61-A90 VanDerWaalsContact OD2-CB 3.24Å; D61-A90 WeakPolarHBondContact OD2-CB 3.04Å; L64-A90 HydrophobicContact CD2-CB 4.01Å
91	A	45.3	Very low	56	Low	49 Å²	49	104.6 Å²	104.6	41%	0.405	55%	0.553	S	S	.	*	S	Bend	trans	-96.3	12.4	-174.4	0	0	0	0	0	113.2	R68	R68-A91 VanDerWaalsContact NH1-CA 3.32Å; R68-A91 VanDerWaalsContact NH1-CB 3.32Å
92	T	47.8	Very low	58.3	Low	84 Å²	84	102.3 Å²	102.3	52%	0.515	53%	0.531	S	S	.	.	S	Bend	trans	-124.3	16.8	-146.7	95.3	0	0	0	0	114.6
93	F	57.3	Low	60.5	Low	153 Å²	153	101.2 Å²	101.2	67%	0.671	51%	0.514	S	S	*	.	S	Bend	trans	-125.3	-34.8	177.9	-73.1	-76.7	0	0	0	115.9
94	Y	62.6	Low	63	Low	148 Å²	148	99 Å²	99	58%	0.58	49%	0.491	S	S	*	.			trans	-142.8	137.3	175.9	-56.8	-73.8	0	0	0	110.8	L99	Y94-L99 HydrophobicContact CD2-CD2 4.39Å; Y94-L99 HydrophobicContact CG-CD2 4.34Å
95	D	70.6	Confident	65.1	Low	94 Å²	94	95.4 Å²	95.4	50%	0.503	48%	0.475	S	S	.	.			trans	-66.6	150.6	171.9	-178.4	34.1	0	0	0	110.2	E97 T98 L99	D95-E97 PolarHBondContact O-N 3.4Å; D95-E97 WeakPolarHBondContact OD2-CB 3.45Å; D95-T98 WeakPolarHBondContact O-CB 3.34Å; D95-T98 PolarHBondContact O-N 3.13Å; D95-L99 PolarHBondContact O-N 2.91Å; D95-L99 VanDerWaalsContact O-N 3.09Å
96	I	72.4	Confident	67.6	Low	29 Å²	29	88.5 Å²	88.5	15%	0.149	45%	0.449	C	S	.	.	H	α-helix	trans	-57.6	-36.8	179.3	-62.5	172.5	0	0	0	110.2	R68 L69 K72 L99 K100	R68-I96 HydrophobicContact CB-CD1 3.91Å; L69-I96 HydrophobicContact CD1-CG2 3.65Å; K72-I96 HydrophobicContact CD-CD1 4.15Å; K72-I96 HydrophobicContact CD-CG2 4.38Å; I96-L99 PolarHBondContact O-N 3.04Å; I96-K100 WeakPolarHBondContact O-CB 3.47Å; I96-K100 PolarHBondContact O-N 3.37Å
97	E	76.1	Confident	70	Confident	94 Å²	94	87.4 Å²	87.4	44%	0.439	43%	0.43	S	S	.	.	H	α-helix	trans	-64.6	-40.9	177.1	-166.2	60.1	-151.7	0	0	111.6	D95 L99 K100 V101	D95-E97 PolarHBondContact O-N 3.4Å; D95-E97 WeakPolarHBondContact OD2-CB 3.45Å; E97-L99 PolarHBondContact O-N 3.24Å; E97-K100 PolarHBondContact O-N 2.03Å; E97-V101 WeakPolarHBondContact O-CG2 3.41Å; E97-V101 PolarHBondContact O-N 2.95Å
98	T	81.7	Confident	72.3	Confident	65 Å²	65	88.6 Å²	88.6	40%	0.399	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-45.3	176.5	-51.6	0	0	0	0	111.5	D95 K100 V101 I102	D95-T98 WeakPolarHBondContact O-CB 3.34Å; D95-T98 PolarHBondContact O-N 3.13Å; T98-K100 VanDerWaalsContact C-N 3.33Å; T98-K100 PolarHBondContact O-N 3.43Å; T98-V101 PolarHBondContact O-N 3.17Å; T98-I102 HydrophobicContact CG2-CD1 4.08Å; T98-I102 VanDerWaalsContact O-CG1 3.31Å; T98-I102 WeakPolarHBondContact O-CG1 3.44Å; T98-I102 PolarHBondContact O-N 2.88Å
99	L	78.3	Confident	74.7	Confident	9 Å²	9	83.1 Å²	83.1	5%	0.047	41%	0.41	C	S	.	.	H	α-helix	trans	-67.3	-35.8	179.3	-70.6	171.8	0	0	0	112	L50 W65 Y94 D95 I96 E97 I102 D103	L50-L99 HydrophobicContact CD1-CD2 4.14Å; L50-L99 HydrophobicContact CD2-CB 3.96Å; L50-L99 HydrophobicContact CD2-CD2 4.07Å; L50-L99 WeakPolarHBondContact CD2-O 3.05Å; W65-L99 HydrophobicContact CZ2-CB 3.99Å; W65-L99 HydrophobicContact CZ2-CD1 4.17Å; Y94-L99 HydrophobicContact CD2-CD2 4.39Å; Y94-L99 HydrophobicContact CG-CD2 4.34Å; D95-L99 PolarHBondContact O-N 2.91Å; D95-L99 VanDerWaalsContact O-N 3.09Å; I96-L99 PolarHBondContact O-N 3.04Å; E97-L99 PolarHBondContact O-N 3.24Å; L99-I102 HydrophobicContact CD2-CD1 4.32Å; L99-I102 PolarHBondContact O-N 3.3Å; L99-D103 PolarHBondContact O-N 3.11Å
100	K	79.8	Confident	77.1	Confident	93 Å²	93	77.6 Å²	77.6	40%	0.404	39%	0.386	S	S	.	.	H	α-helix	trans	-61.8	-46.2	172.3	-176.7	-174.9	171.1	-159	0	111.6	I96 E97 T98 I102 D103 E104	I96-K100 WeakPolarHBondContact O-CB 3.47Å; I96-K100 PolarHBondContact O-N 3.37Å; E97-K100 PolarHBondContact O-N 2.03Å; T98-K100 VanDerWaalsContact C-N 3.33Å; T98-K100 PolarHBondContact O-N 3.43Å; K100-I102 VanDerWaalsContact C-N 3.29Å; K100-I102 PolarHBondContact O-N 3.47Å; K100-D103 PolarHBondContact O-N 3.38Å; K100-E104 VanDerWaalsContact CE-OE1 3.22Å; K100-E104 WeakPolarHBondContact CE-OE1 3.42Å; K100-E104 WeakPolarHBondContact O-CB 3.27Å; K100-E104 WeakPolarHBondContact O-CG 3.39Å; K100-E104 PolarHBondContact O-N 2.87Å
101	V	88.8	Confident	79.7	Confident	73 Å²	73	77.3 Å²	77.3	44%	0.442	38%	0.382	S	S	.	.	H	α-helix	trans	-59.2	-42.6	175.7	171.4	0	0	0	0	110.9	E97 T98 E104 E105	E97-V101 WeakPolarHBondContact O-CG2 3.41Å; E97-V101 PolarHBondContact O-N 2.95Å; T98-V101 PolarHBondContact O-N 3.17Å; V101-E104 PolarHBondContact O-N 3.15Å; V101-E105 WeakPolarHBondContact O-CG 3.46Å; V101-E105 PolarHBondContact O-N 2.03Å
102	I	85.1	Confident	82.2	Confident	67 Å²	67	76.9 Å²	76.9	34%	0.344	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-45.6	177	-67.7	164.1	0	0	0	111.4	L50 T98 L99 K100 E105 W106	L50-I102 HydrophobicContact CD1-CG2 4.05Å; L50-I102 HydrophobicContact CD2-CG2 4.43Å; T98-I102 HydrophobicContact CG2-CD1 4.08Å; T98-I102 VanDerWaalsContact O-CG1 3.31Å; T98-I102 WeakPolarHBondContact O-CG1 3.44Å; T98-I102 PolarHBondContact O-N 2.88Å; L99-I102 HydrophobicContact CD2-CD1 4.32Å; L99-I102 PolarHBondContact O-N 3.3Å; K100-I102 VanDerWaalsContact C-N 3.29Å; K100-I102 PolarHBondContact O-N 3.47Å; I102-E105 PolarHBondContact O-N 2.91Å; I102-W106 WeakPolarHBondContact O-CB 3.46Å; I102-W106 PolarHBondContact O-N 2.89Å
103	D	85.8	Confident	84.6	Confident	59 Å²	59	75 Å²	75	32%	0.316	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-43.6	177.5	-173.8	52.1	0	0	0	111.1	L50 L99 K100 E105 W106 Q107	L50-D103 HydrophobicContact CB-CB 4.28Å; L50-D103 HydrophobicContact CD2-CB 3.84Å; L99-D103 PolarHBondContact O-N 3.11Å; K100-D103 PolarHBondContact O-N 3.38Å; D103-E105 VanDerWaalsContact C-N 3.34Å; D103-E105 PolarHBondContact O-N 3.32Å; D103-W106 WeakPolarHBondContact O-CB 3.26Å; D103-W106 PolarHBondContact O-N 3.18Å; D103-W106 VanDerWaalsContact O-N 3.16Å; D103-Q107 VanDerWaalsContact O-CG 3.29Å; D103-Q107 WeakPolarHBondContact O-CG 3.38Å; D103-Q107 PolarHBondContact O-N 2.83Å; D103-Q107 PolarHBondContact OD1-NE2 2.93Å
104	E	89.6	Confident	86.5	Confident	64 Å²	64	71.6 Å²	71.6	30%	0.299	35%	0.349	S	S	.	.	H	α-helix	trans	-59.9	-42.7	176.1	-73.7	-177.6	-164.1	0	0	112.5	K100 V101 Q107 R108	K100-E104 VanDerWaalsContact CE-OE1 3.22Å; K100-E104 WeakPolarHBondContact CE-OE1 3.42Å; K100-E104 WeakPolarHBondContact O-CB 3.27Å; K100-E104 WeakPolarHBondContact O-CG 3.39Å; K100-E104 PolarHBondContact O-N 2.87Å; V101-E104 PolarHBondContact O-N 3.15Å; E104-Q107 PolarHBondContact O-N 3.32Å; E104-R108 WeakPolarHBondContact O-CB 3.41Å; E104-R108 VanDerWaalsContact O-CG 3.29Å; E104-R108 WeakPolarHBondContact O-CG 3.43Å; E104-R108 PolarHBondContact O-N 3.18Å; E104-R108 IonicContact OE2-CZ 2.76Å; E104-R108 IonicContact OE2-NH1 3.87Å; E104-R108 PolarHBondContact OE2-NH1 3.47Å; E104-R108 IonicContact OE2-NH2 2.68Å; E104-R108 PolarHBondContact OE2-NH2 3.49Å
105	E	93.1	Very high	88.2	Confident	95 Å²	95	70.4 Å²	70.4	44%	0.444	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-44	174.4	-73.3	-55.3	111.5	0	0	111.3	V101 I102 D103 Q107 R108 T109	V101-E105 WeakPolarHBondContact O-CG 3.46Å; V101-E105 PolarHBondContact O-N 2.03Å; I102-E105 PolarHBondContact O-N 2.91Å; D103-E105 VanDerWaalsContact C-N 3.34Å; D103-E105 PolarHBondContact O-N 3.32Å; E105-Q107 VanDerWaalsContact C-N 3.33Å; E105-Q107 PolarHBondContact O-N 3.14Å; E105-R108 PolarHBondContact O-N 3.47Å; E105-R108 VanDerWaalsContact O-N 3.1Å; E105-R108 IonicContact OE1-CZ 3.45Å; E105-R108 IonicContact OE1-NH1 3.2Å; E105-R108 PolarHBondContact OE1-NH1 3.4Å; E105-T109 WeakPolarHBondContact O-CG2 3.31Å; E105-T109 PolarHBondContact O-N 3.48Å; E105-T109 PolarHBondContact O-OG1 3.17Å
106	W	90.4	Very high	89.4	Confident	64 Å²	64	68.4 Å²	68.4	24%	0.242	34%	0.339	C	S	.	.	H	α-helix	trans	-57.9	-44.9	174.8	-163.3	-72.8	0	0	0	111.7	A47 S48 I102 D103 T109 Q110 N147	A47-W106 WeakPolarHBondContact O-CZ2 3.41Å; S48-W106 PolarHBondContact O-NE1 3.36Å; I102-W106 WeakPolarHBondContact O-CB 3.46Å; I102-W106 PolarHBondContact O-N 2.89Å; D103-W106 WeakPolarHBondContact O-CB 3.26Å; D103-W106 PolarHBondContact O-N 3.18Å; D103-W106 VanDerWaalsContact O-N 3.16Å; W106-T109 PolarHBondContact O-N 3.38Å; W106-T109 PolarHBondContact O-OG1 3.32Å; W106-Q110 WeakPolarHBondContact O-CG 3.49Å; W106-Q110 PolarHBondContact O-N 3.34Å; W106-Q110 PolarHBondContact O-NE2 3.02Å; W106-N147 WeakPolarHBondContact CZ2-OD1 3.22Å
107	Q	90.2	Very high	90.6	Very high	96 Å²	96	71 Å²	71	45%	0.449	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-43.6	173.8	-63.2	-46.2	-49.3	0	0	112	D103 E104 E105 T109	D103-Q107 VanDerWaalsContact O-CG 3.29Å; D103-Q107 WeakPolarHBondContact O-CG 3.38Å; D103-Q107 PolarHBondContact O-N 2.83Å; D103-Q107 PolarHBondContact OD1-NE2 2.93Å; E104-Q107 PolarHBondContact O-N 3.32Å; E105-Q107 VanDerWaalsContact C-N 3.33Å; E105-Q107 PolarHBondContact O-N 3.14Å; Q107-T109 VanDerWaalsContact C-N 3.31Å; Q107-T109 PolarHBondContact O-N 2.99Å
108	R	93.5	Very high	91.5	Very high	128 Å²	128	67.2 Å²	67.2	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-69.3	-25.2	-179.6	-75.5	179.4	-167.9	111.9	13.3	113.6	E104 E105 R114	E104-R108 WeakPolarHBondContact O-CB 3.41Å; E104-R108 VanDerWaalsContact O-CG 3.29Å; E104-R108 WeakPolarHBondContact O-CG 3.43Å; E104-R108 PolarHBondContact O-N 3.18Å; E104-R108 IonicContact OE2-CZ 2.76Å; E104-R108 IonicContact OE2-NH1 3.87Å; E104-R108 PolarHBondContact OE2-NH1 3.47Å; E104-R108 IonicContact OE2-NH2 2.68Å; E104-R108 PolarHBondContact OE2-NH2 3.49Å; E105-R108 PolarHBondContact O-N 3.47Å; E105-R108 VanDerWaalsContact O-N 3.1Å; E105-R108 IonicContact OE1-CZ 3.45Å; E105-R108 IonicContact OE1-NH1 3.2Å; E105-R108 PolarHBondContact OE1-NH1 3.4Å; R108-R114 PolarHBondContact O-NH1 3.14Å; R108-R114 PolarHBondContact O-NH2 3.19Å
109	T	94.8	Very high	92.2	Very high	65 Å²	65	69 Å²	69	40%	0.399	35%	0.346	S	S	.	.	H	α-helix	trans	-97.9	-3.6	-177.8	55.1	0	0	0	0	114.8	E105 W106 Q107 G144 C145	E105-T109 WeakPolarHBondContact O-CG2 3.31Å; E105-T109 PolarHBondContact O-N 3.48Å; E105-T109 PolarHBondContact O-OG1 3.17Å; W106-T109 PolarHBondContact O-N 3.38Å; W106-T109 PolarHBondContact O-OG1 3.32Å; Q107-T109 VanDerWaalsContact C-N 3.31Å; Q107-T109 PolarHBondContact O-N 2.99Å; T109-G144 CarbonylContact O-C 3.39Å; T109-G144 WeakPolarHBondContact O-CA 3.47Å; T109-C145 PolarHBondContact O-N 2.99Å
110	Q	94.6	Very high	92.9	Very high	67 Å²	67	68.5 Å²	68.5	31%	0.313	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-63.2	156.1	-179.7	-88.4	172.4	75	0	0	114.4	W106 S112 R114	W106-Q110 WeakPolarHBondContact O-CG 3.49Å; W106-Q110 PolarHBondContact O-N 3.34Å; W106-Q110 PolarHBondContact O-NE2 3.02Å; Q110-S112 PolarHBondContact O-N 2.78Å; Q110-R114 PolarHBondContact O-NH2 3.48Å
111	C	97.1	Very high	93.5	Very high	27 Å²	27	65.3 Å²	65.3	18%	0.182	34%	0.335	C	S	.	.	S	Bend	trans	-59.1	108.2	175.6	176.4	0	0	0	0	112.1	G143 C145 C153	C111-G143 WeakPolarHBondContact CA-O 3.47Å; C111-C145 PolarHBondContact N-O 3.22Å; C111-C153 WeakPolarHBondContact CA-SG 3.43Å; C111-C153 HydrophobicContact CB-CB 3.74Å; C111-C153 WeakPolarHBondContact CB-SG 3.42Å; C111-C153 WeakPolarHBondContact SG-CA 3.48Å; C111-C153 WeakPolarHBondContact SG-CB 3.25Å; C111-C153 CovalentContact SG-SG 2.03Å; C111-C153 PolarHBondContact SG-SG 2.81Å
112	S	97.1	Very high	93.5	Very high	41 Å²	41	65.8 Å²	65.8	29%	0.287	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	163.3	-179.2	72.3	0	0	0	0	111.8	Q110 R114 G143	Q110-S112 PolarHBondContact O-N 2.78Å; S112-R114 PolarHBondContact O-N 2.03Å; S112-G143 PolarHBondContact N-O 3.19Å; S112-G143 PolarHBondContact O-N 3.06Å; S112-G143 VanDerWaalsContact O-N 3.07Å; S112-G143 VanDerWaalsContact O-O 3.08Å
113	P	98.1	Very high	93.7	Very high	45 Å²	45	66.5 Å²	66.5	29%	0.292	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	128.4	167.2	-19	31.2	0	0	0	110.2	F140 R141 C189	P113-F140 HydrophobicContact CB-CB 4.18Å; P113-F140 HydrophobicContact CB-CD1 4.11Å; P113-R141 CarbonylContact C-O 3.57Å; P113-R141 WeakPolarHBondContact CA-O 2.98Å; P113-C189 VanDerWaalsContact CD-SG 3.54Å
114	R	97.5	Very high	93.7	Very high	81 Å²	81	67 Å²	67	31%	0.306	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142	-179.5	-65.1	172.8	-173.8	-87.1	-8.9	109.9	R108 Q110 S112 T116 F140 R141 G143	R108-R114 PolarHBondContact O-NH1 3.14Å; R108-R114 PolarHBondContact O-NH2 3.19Å; Q110-R114 PolarHBondContact O-NH2 3.48Å; S112-R114 PolarHBondContact O-N 2.03Å; R114-T116 PolarHBondContact O-N 3.28Å; R114-F140 CarbonylContact O-C 3.49Å; R114-F140 VanDerWaalsContact O-CA 3.28Å; R114-F140 WeakPolarHBondContact O-CA 3Å; R114-R141 PolarHBondContact N-O 2.85Å; R114-R141 PolarHBondContact O-N 3.01Å; R114-G143 PolarHBondContact NE-O 3.08Å
115	E	97	Very high	93.5	Very high	123 Å²	123	67.3 Å²	67.3	58%	0.575	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	128.8	175.8	-169.5	176.1	-164.6	0	0	109.9	N138 F140	E115-N138 HydrophobicContact CG-CB 4.14Å; E115-N138 VanDerWaalsContact OE1-CB 3.31Å; E115-N138 WeakPolarHBondContact OE1-CB 3.33Å; E115-N138 PolarHBondContact OE1-ND2 3.13Å; E115-F140 HydrophobicContact CB-CE1 4.21Å; E115-F140 HydrophobicContact CB-CZ 4.32Å
116	T	97.1	Very high	92.8	Very high	51 Å²	51	66.1 Å²	66.1	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.1	-177.9	58.8	0	0	0	0	110.1	R114 N138 V139 R141	R114-T116 PolarHBondContact O-N 3.28Å; T116-N138 WeakPolarHBondContact O-CA 3.3Å; T116-V139 PolarHBondContact N-O 2.86Å; T116-V139 PolarHBondContact O-N 3Å; T116-V139 VanDerWaalsContact O-O 3.13Å; T116-V139 PolarHBondContact OG1-O 3.42Å; T116-R141 HydrophobicContact CG2-CB 4.2Å; T116-R141 WeakPolarHBondContact OG1-CG 3.32Å
117	C	97.1	Very high	92.1	Very high	85 Å²	85	66.6 Å²	66.6	57%	0.574	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.5	175.6	177.5	0	0	0	0	108.9	C136	C117-C136 WeakPolarHBondContact SG-CB 3.46Å
118	V	95.8	Very high	91.4	Very high	13 Å²	13	67.6 Å²	67.6	8%	0.079	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.4	-179.2	-59	0	0	0	0	111	E123 C136 V137 V139 R141 V183	V118-E123 HydrophobicContact CB-CG 4.24Å; V118-E123 HydrophobicContact CG2-CG 4.26Å; V118-C136 CarbonylContact O-C 3.6Å; V118-C136 WeakPolarHBondContact O-CA 3.15Å; V118-C136 WeakPolarHBondContact O-CB 3.44Å; V118-V137 HydrophobicContact CG2-CG2 3.83Å; V118-V137 PolarHBondContact N-O 3.18Å; V118-V137 PolarHBondContact O-N 3.05Å; V118-V139 HydrophobicContact CB-CG2 4.36Å; V118-V139 HydrophobicContact CG1-CG2 3.74Å; V118-V139 HydrophobicContact CG2-CG1 4.34Å; V118-V139 HydrophobicContact CG2-CG2 3.65Å; V118-R141 HydrophobicContact CG1-CG 4.33Å; V118-V183 HydrophobicContact CG2-CG1 3.98Å
119	E	95.2	Very high	91	Very high	102 Å²	102	66 Å²	66	48%	0.477	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	122.4	174.6	-176.1	-174.9	-159.2	0	0	110.5	A121 S122 E123	E119-A121 PolarHBondContact O-N 3.01Å; E119-S122 PolarHBondContact O-N 3.33Å; E119-S122 PolarHBondContact OE2-OG 2.97Å; E119-E123 VanDerWaalsContact O-CG 3.29Å; E119-E123 WeakPolarHBondContact O-CG 3.31Å; E119-E123 PolarHBondContact O-N 2.94Å
120	V	94.1	Very high	90.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-69	-37.6	-171.5	178.4	0	0	0	0	112.2	S122 E123 L124 F132 P135 V137 L165 V181	V120-S122 PolarHBondContact O-N 3.3Å; V120-E123 PolarHBondContact O-N 3.46Å; V120-L124 HydrophobicContact CG1-CD1 3.9Å; V120-L124 HydrophobicContact CG1-CG 4.38Å; V120-L124 WeakPolarHBondContact O-CG 3.09Å; V120-L124 PolarHBondContact O-N 2.04Å; V120-L124 VanDerWaalsContact O-N 3.12Å; V120-F132 HydrophobicContact CB-CB 4.47Å; V120-F132 HydrophobicContact CB-CD2 4.12Å; V120-F132 HydrophobicContact CB-CG 4.36Å; V120-F132 HydrophobicContact CG1-CD1 4.34Å; V120-F132 HydrophobicContact CG1-CD2 3.72Å; V120-F132 HydrophobicContact CG1-CE1 4.46Å; V120-F132 HydrophobicContact CG1-CE2 3.84Å; V120-F132 HydrophobicContact CG1-CG 3.95Å; V120-F132 HydrophobicContact CG1-CZ 4.18Å; V120-P135 WeakPolarHBondContact CG2-O 3.24Å; V120-P135 PolarHBondContact N-O 2.96Å; V120-V137 HydrophobicContact CG2-CB 4.45Å; V120-V137 HydrophobicContact CG2-CG1 3.86Å; V120-V137 HydrophobicContact CG2-CG2 3.95Å; V120-L165 HydrophobicContact CB-CD1 4.2Å; V120-L165 HydrophobicContact CG1-CD1 3.75Å; V120-L165 HydrophobicContact CG2-CD1 3.66Å; V120-V181 HydrophobicContact CG1-CG1 3.86Å; V120-V181 HydrophobicContact CG1-CG2 4.44Å
121	A	91.3	Very high	90.6	Very high	26 Å²	26	65.3 Å²	65.3	22%	0.215	38%	0.378	C	S	.	.	H	α-helix	trans	-63	-44.1	-179.4	0	0	0	0	0	111.7	E119 L124 G125 K126 F132	E119-A121 PolarHBondContact O-N 3.01Å; A121-L124 PolarHBondContact O-N 2.96Å; A121-G125 PolarHBondContact O-N 2.78Å; A121-K126 PolarHBondContact O-N 3.2Å; A121-K126 VanDerWaalsContact O-N 3.14Å; A121-F132 HydrophobicContact CB-CD2 4.47Å
122	S	90	Very high	90.5	Very high	82 Å²	82	64.3 Å²	64.3	57%	0.573	37%	0.371	S	S	*	.	H	α-helix	trans	-64.6	-40.2	177.5	-68.6	0	0	0	0	112.3	E119 V120 G125	E119-S122 PolarHBondContact O-N 3.33Å; E119-S122 PolarHBondContact OE2-OG 2.97Å; V120-S122 PolarHBondContact O-N 3.3Å; S122-G125 PolarHBondContact O-N 3.3Å
123	E	88.4	Confident	90.4	Very high	83 Å²	83	67.7 Å²	67.7	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-67	-35	177.9	-71.8	-74.7	152.8	0	0	113.5	V118 E119 V120 R141	V118-E123 HydrophobicContact CB-CG 4.24Å; V118-E123 HydrophobicContact CG2-CG 4.26Å; E119-E123 VanDerWaalsContact O-CG 3.29Å; E119-E123 WeakPolarHBondContact O-CG 3.31Å; E119-E123 PolarHBondContact O-N 2.94Å; V120-E123 PolarHBondContact O-N 3.46Å; E123-R141 IonicContact OE1-CZ 3.8Å; E123-R141 VanDerWaalsContact OE1-CZ 3.31Å; E123-R141 IonicContact OE1-NH1 3.56Å; E123-R141 PolarHBondContact OE1-NH1 3.17Å; E123-R141 IonicContact OE1-NH2 3.42Å; E123-R141 PolarHBondContact OE1-NH2 2.94Å; E123-R141 IonicContact OE2-CZ 2.81Å; E123-R141 IonicContact OE2-NH1 2.82Å; E123-R141 IonicContact OE2-NH2 3.4Å; E123-R141 PolarHBondContact OE2-NH2 3.19Å
124	L	86.6	Confident	90.3	Very high	70 Å²	70	69.1 Å²	69.1	37%	0.366	39%	0.389	S	S	.	.	H	α-helix	trans	-90.6	-5.8	179.7	-64.1	178.6	0	0	0	113.5	V120 A121 K126 F132 V181	V120-L124 HydrophobicContact CG1-CD1 3.9Å; V120-L124 HydrophobicContact CG1-CG 4.38Å; V120-L124 WeakPolarHBondContact O-CG 3.09Å; V120-L124 PolarHBondContact O-N 2.04Å; V120-L124 VanDerWaalsContact O-N 3.12Å; A121-L124 PolarHBondContact O-N 2.96Å; L124-K126 HydrophobicContact CB-CG 3.95Å; L124-K126 PolarHBondContact O-N 2.81Å; L124-F132 HydrophobicContact CD1-CE1 4.46Å; L124-F132 HydrophobicContact CD1-CE2 3.84Å; L124-F132 HydrophobicContact CD1-CZ 3.51Å; L124-V181 HydrophobicContact CD1-CG1 3.69Å; L124-V181 HydrophobicContact CD1-CG2 4.31Å; L124-V181 HydrophobicContact CD2-CG1 4.09Å; L124-V181 HydrophobicContact CG-CG1 4.19Å
125	G	84.7	Confident	90.2	Very high	69 Å²	69	68.3 Å²	68.3	71%	0.711	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	30.9	-173.9	0	0	0	0	0	113.5	A121 S122	A121-G125 PolarHBondContact O-N 2.78Å; S122-G125 PolarHBondContact O-N 3.3Å
126	K	78.4	Confident	90.2	Very high	70 Å²	70	64.7 Å²	64.7	30%	0.304	38%	0.383	S	S	.	.			trans	-74.1	149.8	-178.4	-74	-155.5	-178.9	179.6	0	111.7	A121 L124 T130 F132 E167	A121-K126 PolarHBondContact O-N 3.2Å; A121-K126 VanDerWaalsContact O-N 3.14Å; L124-K126 HydrophobicContact CB-CG 3.95Å; L124-K126 PolarHBondContact O-N 2.81Å; K126-T130 HydrophobicContact CD-CG2 3.85Å; K126-F132 HydrophobicContact CD-CE2 3.69Å; K126-F132 HydrophobicContact CD-CZ 3.61Å; K126-F132 HydrophobicContact CG-CE2 4.37Å; K126-F132 VanDerWaalsContact NZ-CZ 3.29Å; K126-E167 IonicContact NZ-OE1 2.78Å; K126-E167 PolarHBondContact NZ-OE1 3.02Å; K126-E167 IonicContact NZ-OE2 2.73Å; K126-E167 PolarHBondContact NZ-OE2 3.34Å
127	S	74.8	Confident	90.2	Very high	75 Å²	75	62.9 Å²	62.9	52%	0.524	37%	0.371	S	S	.	.			trans	-67	163.1	178	74	0	0	0	0	113.2	N129 T130	S127-N129 PolarHBondContact O-N 2.75Å; S127-T130 PolarHBondContact O-N 3.3Å
128	T	76.6	Confident	90.2	Very high	116 Å²	116	62.6 Å²	62.6	71%	0.712	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-10.8	178.7	54.6	0	0	0	0	115.2	F131	T128-F131 WeakPolarHBondContact O-CE2 2.97Å; T128-F131 WeakPolarHBondContact O-CZ 3.33Å
129	N	84.9	Confident	90.3	Very high	95 Å²	95	62 Å²	62	51%	0.508	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-2.2	-176.1	-61.8	-7.6	0	0	0	112.8	S127 S169 V170	S127-N129 PolarHBondContact O-N 2.75Å; N129-S169 CarbonylContact O-C 3.47Å; N129-S169 VanDerWaalsContact O-CA 3.27Å; N129-S169 WeakPolarHBondContact O-CA 2.98Å; N129-V170 PolarHBondContact O-N 3.03Å
130	T	89	Confident	90.4	Very high	21 Å²	21	61.4 Å²	61.4	13%	0.129	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.3	179	-55.6	0	0	0	0	110.3	K126 S127 E167 I168	K126-T130 HydrophobicContact CD-CG2 3.85Å; S127-T130 PolarHBondContact O-N 3.3Å; T130-E167 HydrophobicContact CG2-CG 3.63Å; T130-E167 VanDerWaalsContact CG2-OE1 3.26Å; T130-E167 WeakPolarHBondContact CG2-OE1 3.2Å; T130-I168 CarbonylContact C-O 3.47Å; T130-I168 WeakPolarHBondContact CA-O 3.29Å
131	F	92.2	Very high	90.6	Very high	96 Å²	96	63.5 Å²	63.5	42%	0.421	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.3	-176.6	-57.5	-87.5	0	0	0	110.7	T128 I168 V170	T128-F131 WeakPolarHBondContact O-CE2 2.97Å; T128-F131 WeakPolarHBondContact O-CZ 3.33Å; F131-I168 PolarHBondContact N-O 3.43Å; F131-I168 PolarHBondContact O-N 3.44Å; F131-V170 HydrophobicContact CD2-CG2 3.81Å; F131-V170 HydrophobicContact CE2-CB 4.12Å; F131-V170 HydrophobicContact CE2-CG2 3.59Å
132	F	94.4	Very high	90.9	Very high	7 Å²	7	63.5 Å²	63.5	3%	0.031	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	144.4	174.8	-66	-80.5	0	0	0	111.9	V120 A121 L124 K126 P134 P135 L165 F166 E167 V181	V120-F132 HydrophobicContact CB-CB 4.47Å; V120-F132 HydrophobicContact CB-CD2 4.12Å; V120-F132 HydrophobicContact CB-CG 4.36Å; V120-F132 HydrophobicContact CG1-CD1 4.34Å; V120-F132 HydrophobicContact CG1-CD2 3.72Å; V120-F132 HydrophobicContact CG1-CE1 4.46Å; V120-F132 HydrophobicContact CG1-CE2 3.84Å; V120-F132 HydrophobicContact CG1-CG 3.95Å; V120-F132 HydrophobicContact CG1-CZ 4.18Å; A121-F132 HydrophobicContact CB-CD2 4.47Å; L124-F132 HydrophobicContact CD1-CE1 4.46Å; L124-F132 HydrophobicContact CD1-CE2 3.84Å; L124-F132 HydrophobicContact CD1-CZ 3.51Å; K126-F132 HydrophobicContact CD-CE2 3.69Å; K126-F132 HydrophobicContact CD-CZ 3.61Å; K126-F132 HydrophobicContact CG-CE2 4.37Å; K126-F132 VanDerWaalsContact NZ-CZ 3.29Å; F132-P134 CarbonylContact C-O 3.54Å; F132-P134 CarbonylContact O-C 3.59Å; F132-P135 WeakPolarHBondContact O-CA 3.5Å; F132-L165 HydrophobicContact CB-CD1 4.46Å; F132-L165 HydrophobicContact CD1-CB 4.19Å; F132-L165 HydrophobicContact CD1-CD1 4.25Å; F132-F166 CarbonylContact C-O 3.55Å; F132-F166 VanDerWaalsContact CA-O 3.27Å; F132-F166 WeakPolarHBondContact CA-O 3.35Å; F132-E167 HydrophobicContact CD1-CB 4.37Å; F132-E167 HydrophobicContact CE1-CB 4.18Å; F132-E167 HydrophobicContact CE1-CG 4.3Å; F132-V181 HydrophobicContact CD1-CG2 4.36Å; F132-V181 HydrophobicContact CE1-CG2 3.77Å; F132-V181 HydrophobicContact CZ-CG2 4.3Å
133	K	94.9	Very high	91.2	Very high	112 Å²	112	60.5 Å²	60.5	49%	0.487	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.2	170.4	-62.7	-64.5	175.4	-169.9	0	110.8	F166 I168	K133-F166 HydrophobicContact CB-CB 4.26Å; K133-F166 PolarHBondContact N-O 3.32Å; K133-F166 PolarHBondContact O-N 2.95Å; K133-I168 HydrophobicContact CG-CD1 3.86Å
134	P	96.6	Very high	91.5	Very high	74 Å²	74	58.4 Å²	58.4	48%	0.481	35%	0.345	S	S	.	.	S	Bend	cis	-60.4	154.3	-10.9	27.3	-36.3	0	0	0	112.8	F132 C136 L165	F132-P134 CarbonylContact C-O 3.54Å; F132-P134 CarbonylContact O-C 3.59Å; P134-C136 VanDerWaalsContact C-N 3.27Å; P134-C136 PolarHBondContact O-N 3.42Å; P134-L165 HydrophobicContact CG-CD2 3.64Å
135	P	95.1	Very high	91.9	Very high	64 Å²	64	59 Å²	59	42%	0.416	35%	0.354	S	S	.	.	S	Bend	trans	-74.5	-19	-179.6	30.3	-35.4	0	0	0	113.2	V120 F132	V120-P135 WeakPolarHBondContact CG2-O 3.24Å; V120-P135 PolarHBondContact N-O 2.96Å; F132-P135 WeakPolarHBondContact O-CA 3.5Å
136	C	96.8	Very high	92.3	Very high	48 Å²	48	57 Å²	57	32%	0.324	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	154.6	-176.6	-51.1	0	0	0	0	111.7	C117 V118 P134	C117-C136 WeakPolarHBondContact SG-CB 3.46Å; V118-C136 CarbonylContact O-C 3.6Å; V118-C136 WeakPolarHBondContact O-CA 3.15Å; V118-C136 WeakPolarHBondContact O-CB 3.44Å; P134-C136 VanDerWaalsContact C-N 3.27Å; P134-C136 PolarHBondContact O-N 3.42Å
137	V	97.1	Very high	92.9	Very high	12 Å²	12	56.6 Å²	56.6	7%	0.073	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	149.9	174.2	-63.6	0	0	0	0	110.9	V118 V120 V139 K163 L165 V183	V118-V137 HydrophobicContact CG2-CG2 3.83Å; V118-V137 PolarHBondContact N-O 3.18Å; V118-V137 PolarHBondContact O-N 3.05Å; V120-V137 HydrophobicContact CG2-CB 4.45Å; V120-V137 HydrophobicContact CG2-CG1 3.86Å; V120-V137 HydrophobicContact CG2-CG2 3.95Å; V137-V139 HydrophobicContact CG2-CG1 4.07Å; V137-K163 HydrophobicContact CB-CG 4.21Å; V137-K163 HydrophobicContact CG1-CB 4.06Å; V137-K163 HydrophobicContact CG1-CG 4.08Å; V137-K163 HydrophobicContact CG2-CG 4.45Å; V137-L165 HydrophobicContact CG1-CD1 4.15Å; V137-L165 HydrophobicContact CG1-CD2 3.88Å; V137-L165 HydrophobicContact CG1-CG 4.49Å; V137-V183 HydrophobicContact CG2-CB 4.48Å; V137-V183 HydrophobicContact CG2-CG1 4.32Å; V137-V183 HydrophobicContact CG2-CG2 4Å
138	N	97.5	Very high	93.5	Very high	79 Å²	79	57.5 Å²	57.5	42%	0.422	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.8	171.9	-73.9	4.1	0	0	0	110.9	E115 T116 K163	E115-N138 HydrophobicContact CG-CB 4.14Å; E115-N138 VanDerWaalsContact OE1-CB 3.31Å; E115-N138 WeakPolarHBondContact OE1-CB 3.33Å; E115-N138 PolarHBondContact OE1-ND2 3.13Å; T116-N138 WeakPolarHBondContact O-CA 3.3Å; N138-K163 WeakPolarHBondContact O-CE 3.49Å; N138-K163 PolarHBondContact O-NZ 2.81Å
139	V	97.5	Very high	93.9	Very high	2 Å²	2	61 Å²	61	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	160.3	174.9	-56.7	0	0	0	0	110.6	T116 V118 V137 R141 I161 V183	T116-V139 PolarHBondContact N-O 2.86Å; T116-V139 PolarHBondContact O-N 3Å; T116-V139 VanDerWaalsContact O-O 3.13Å; T116-V139 PolarHBondContact OG1-O 3.42Å; V118-V139 HydrophobicContact CB-CG2 4.36Å; V118-V139 HydrophobicContact CG1-CG2 3.74Å; V118-V139 HydrophobicContact CG2-CG1 4.34Å; V118-V139 HydrophobicContact CG2-CG2 3.65Å; V137-V139 HydrophobicContact CG2-CG1 4.07Å; V139-R141 HydrophobicContact CG2-CG 4.15Å; V139-I161 HydrophobicContact CG1-CD1 4.04Å; V139-I161 HydrophobicContact CG1-CG1 4.45Å; V139-V183 HydrophobicContact CG1-CB 4.09Å; V139-V183 HydrophobicContact CG1-CG1 3.69Å; V139-V183 HydrophobicContact CG2-CG1 4.4Å
140	F	98.3	Very high	93.9	Very high	88 Å²	88	60 Å²	60	39%	0.386	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	128.8	172.1	-73.1	-93.3	0	0	0	111.2	P113 R114 E115 N185 H186	P113-F140 HydrophobicContact CB-CB 4.18Å; P113-F140 HydrophobicContact CB-CD1 4.11Å; R114-F140 CarbonylContact O-C 3.49Å; R114-F140 VanDerWaalsContact O-CA 3.28Å; R114-F140 WeakPolarHBondContact O-CA 3Å; E115-F140 HydrophobicContact CB-CE1 4.21Å; E115-F140 HydrophobicContact CB-CZ 4.32Å; F140-N185 WeakPolarHBondContact CB-OD1 3.49Å; F140-N185 PolarHBondContact N-OD1 3.21Å; F140-H186 PolarHBondContact O-N 3.08Å
141	R	97.6	Very high	94.1	Very high	44 Å²	44	61.1 Å²	61.1	17%	0.166	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154.2	171	-64	-63.7	171.9	91.4	-7.9	110.1	P113 R114 T116 V118 E123 V139 G143 A184	P113-R141 CarbonylContact C-O 3.57Å; P113-R141 WeakPolarHBondContact CA-O 2.98Å; R114-R141 PolarHBondContact N-O 2.85Å; R114-R141 PolarHBondContact O-N 3.01Å; T116-R141 HydrophobicContact CG2-CB 4.2Å; T116-R141 WeakPolarHBondContact OG1-CG 3.32Å; V118-R141 HydrophobicContact CG1-CG 4.33Å; E123-R141 IonicContact OE1-CZ 3.8Å; E123-R141 VanDerWaalsContact OE1-CZ 3.31Å; E123-R141 IonicContact OE1-NH1 3.56Å; E123-R141 PolarHBondContact OE1-NH1 3.17Å; E123-R141 IonicContact OE1-NH2 3.42Å; E123-R141 PolarHBondContact OE1-NH2 2.94Å; E123-R141 IonicContact OE2-CZ 2.81Å; E123-R141 IonicContact OE2-NH1 2.82Å; E123-R141 IonicContact OE2-NH2 3.4Å; E123-R141 PolarHBondContact OE2-NH2 3.19Å; V139-R141 HydrophobicContact CG2-CG 4.15Å; R141-G143 PolarHBondContact O-N 3.09Å; R141-A184 PolarHBondContact NE-O 3.34Å; R141-A184 PolarHBondContact NH2-O 3.46Å
142	C	98.1	Very high	94.2	Very high	26 Å²	26	60.4 Å²	60.4	18%	0.176	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	129.1	177.6	-69.4	0	0	0	0	108.8	N155 H186 C189	C142-N155 WeakPolarHBondContact SG-CA 3.47Å; C142-H186 PolarHBondContact N-ND1 3.3Å; C142-H186 PolarHBondContact SG-ND1 3.01Å; C142-H186 VanDerWaalsContact SG-ND1 3.37Å; C142-C189 WeakPolarHBondContact CA-SG 3.35Å; C142-C189 HydrophobicContact CB-CB 3.8Å; C142-C189 WeakPolarHBondContact CB-SG 3.3Å; C142-C189 WeakPolarHBondContact SG-CB 2.99Å; C142-C189 CovalentContact SG-SG 2.03Å; C142-C189 PolarHBondContact SG-SG 3.5Å
143	G	96.3	Very high	94.3	Very high	20 Å²	20	61.1 Å²	61.1	21%	0.206	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	171	178.1	0	0	0	0	0	111.4	C111 S112 R114 R141	C111-G143 WeakPolarHBondContact CA-O 3.47Å; S112-G143 PolarHBondContact N-O 3.19Å; S112-G143 PolarHBondContact O-N 3.06Å; S112-G143 VanDerWaalsContact O-N 3.07Å; S112-G143 VanDerWaalsContact O-O 3.08Å; R114-G143 PolarHBondContact NE-O 3.08Å; R141-G143 PolarHBondContact O-N 3.09Å
144	G	95.3	Very high	94.4	Very high	38 Å²	38	59.6 Å²	59.6	39%	0.392	34%	0.341	S	S	.	.	S	Bend	trans	107.5	-176.8	-169.2	0	0	0	0	0	111.5	T109	T109-G144 CarbonylContact O-C 3.39Å; T109-G144 WeakPolarHBondContact O-CA 3.47Å
145	C	94.1	Very high	94.4	Very high	83 Å²	83	59.3 Å²	59.3	56%	0.561	34%	0.335	S	S	*	.	B	Isolated β-bridge	trans	-105	150.8	-171.4	-61.4	0	0	0	0	111.4	T109 C111	T109-C145 PolarHBondContact O-N 2.99Å; C111-C145 PolarHBondContact N-O 3.22Å
146	C	94	Very high	94.5	Very high	28 Å²	28	59.8 Å²	59.8	19%	0.189	34%	0.337	C	S	.	.			trans	-105.7	152.9	166.2	-62.8	0	0	0	0	108.5	L151 C191	C146-L151 HydrophobicContact CB-CB 3.82Å; C146-C191 WeakPolarHBondContact CA-SG 3.36Å; C146-C191 HydrophobicContact CB-CB 3.84Å; C146-C191 WeakPolarHBondContact CB-SG 3.44Å; C146-C191 VanDerWaalsContact SG-CA 3.56Å; C146-C191 WeakPolarHBondContact SG-CB 3.44Å; C146-C191 CovalentContact SG-SG 2.03Å; C146-C191 PolarHBondContact SG-SG 3.39Å
147	N	90.3	Very high	94.5	Very high	60 Å²	60	60 Å²	60	32%	0.321	34%	0.339	S	S	.	.	S	Bend	trans	-76.1	-31.1	-177	-48	-48.7	0	0	0	111.6	A47 S48 W106	A47-N147 WeakPolarHBondContact O-CB 3.41Å; A47-N147 VanDerWaalsContact O-CG 3.3Å; S48-N147 VanDerWaalsContact CA-ND2 3.31Å; S48-N147 WeakPolarHBondContact CA-ND2 3.33Å; S48-N147 WeakPolarHBondContact CB-ND2 3.47Å; W106-N147 WeakPolarHBondContact CZ2-OD1 3.22Å
148	E	87.5	Confident	94.5	Very high	94 Å²	94	61.7 Å²	61.7	44%	0.439	35%	0.349	S	S	.	.	S	Bend	trans	-98.4	133.3	175.8	-66.1	176.6	-139.3	0	0	111.5	A46 S150 L151	A46-E148 HydrophobicContact CB-CG 4.29Å; E148-S150 PolarHBondContact O-N 2.57Å; E148-L151 HydrophobicContact CB-CD1 3.88Å; E148-L151 HydrophobicContact CB-CG 3.9Å; E148-L151 HydrophobicContact CG-CD1 4.37Å; E148-L151 PolarHBondContact O-N 2.03Å
149	E	84	Confident	94.5	Very high	190 Å²	190	60 Å²	60	89%	0.888	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.8	179.2	-66.3	179.1	-178	0	0	113.5	L151	E149-L151 PolarHBondContact O-N 3.42Å
150	S	86.3	Confident	94.5	Very high	75 Å²	75	67.5 Å²	67.5	52%	0.524	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.6	177.9	52.8	0	0	0	0	114.1	E148 P193	E148-S150 PolarHBondContact O-N 2.57Å; S150-P193 WeakPolarHBondContact O-CA 3.41Å
151	L	91.8	Very high	94.4	Very high	43 Å²	43	65.7 Å²	65.7	23%	0.225	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.4	-177.7	-56.2	179.5	0	0	0	111	C146 E148 E149 C191 L192 P193	C146-L151 HydrophobicContact CB-CB 3.82Å; E148-L151 HydrophobicContact CB-CD1 3.88Å; E148-L151 HydrophobicContact CB-CG 3.9Å; E148-L151 HydrophobicContact CG-CD1 4.37Å; E148-L151 PolarHBondContact O-N 2.03Å; E149-L151 PolarHBondContact O-N 3.42Å; L151-C191 HydrophobicContact CB-CB 4Å; L151-C191 HydrophobicContact CD1-CB 3.98Å; L151-L192 WeakPolarHBondContact CA-O 3Å; L151-P193 HydrophobicContact CD2-CB 4.15Å
152	I	94.8	Very high	94.3	Very high	82 Å²	82	67.1 Å²	67.1	42%	0.421	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.6	174.9	-61.2	-176.1	0	0	0	108.7	M154 L192 T194	I152-M154 HydrophobicContact CB-CG 4.38Å; I152-M154 HydrophobicContact CG2-CG 4.17Å; I152-M154 PolarHBondContact O-N 3.48Å; I152-M154 VanDerWaalsContact O-N 3.13Å; I152-L192 PolarHBondContact N-O 2.77Å; I152-L192 PolarHBondContact O-N 3.49Å; I152-T194 HydrophobicContact CD1-CG2 3.64Å; I152-T194 WeakPolarHBondContact CD1-OG1 3.37Å; I152-T194 WeakPolarHBondContact CG1-OG1 3.47Å
153	C	96.8	Very high	94.2	Very high	21 Å²	21	69.3 Å²	69.3	14%	0.142	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	104.9	175.5	-174.9	0	0	0	0	110	C111	C111-C153 WeakPolarHBondContact CA-SG 3.43Å; C111-C153 HydrophobicContact CB-CB 3.74Å; C111-C153 WeakPolarHBondContact CB-SG 3.42Å; C111-C153 WeakPolarHBondContact SG-CA 3.48Å; C111-C153 WeakPolarHBondContact SG-CB 3.25Å; C111-C153 CovalentContact SG-SG 2.03Å; C111-C153 PolarHBondContact SG-SG 2.81Å
154	M	96.4	Very high	94.3	Very high	81 Å²	81	74 Å²	74	40%	0.399	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	154.6	-176.4	-63.2	-176.1	77.3	0	0	110.9	I152 C189 K190 L192	I152-M154 HydrophobicContact CB-CG 4.38Å; I152-M154 HydrophobicContact CG2-CG 4.17Å; I152-M154 PolarHBondContact O-N 3.48Å; I152-M154 VanDerWaalsContact O-N 3.13Å; M154-C189 CarbonylContact O-C 3.34Å; M154-C189 VanDerWaalsContact O-CA 3.27Å; M154-C189 WeakPolarHBondContact O-CA 3.42Å; M154-K190 PolarHBondContact N-O 3.4Å; M154-K190 PolarHBondContact O-N 3.4Å; M154-L192 HydrophobicContact CB-CD1 4.2Å; M154-L192 HydrophobicContact SD-CB 4.21Å
155	N	97.2	Very high	94.3	Very high	68 Å²	68	72.4 Å²	72.4	36%	0.364	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.9	175.1	62.2	-61.3	0	0	0	111.3	C142 T158 H186 G188	C142-N155 WeakPolarHBondContact SG-CA 3.47Å; N155-T158 PolarHBondContact ND2-OG1 2.84Å; N155-H186 HydrophobicContact CB-CB 4.31Å; N155-G188 WeakPolarHBondContact CA-O 3.3Å
156	T	96.8	Very high	94.4	Very high	74 Å²	74	73.4 Å²	73.4	45%	0.454	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-24.4	170.5	55.4	0	0	0	0	112.1	G188 K190	T156-G188 PolarHBondContact N-O 3.22Å; T156-G188 VanDerWaalsContact OG1-C 3.31Å; T156-G188 PolarHBondContact OG1-O 2.64Å; T156-K190 HydrophobicContact CG2-CB 3.69Å; T156-K190 HydrophobicContact CG2-CD 3.89Å; T156-K190 HydrophobicContact CG2-CG 3.62Å
157	S	97.3	Very high	94.4	Very high	51 Å²	51	74.1 Å²	74.1	36%	0.357	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	140.6	177.3	59.2	0	0	0	0	110.5	T187 G188	S157-T187 WeakPolarHBondContact CB-OG1 3.41Å; S157-T187 PolarHBondContact O-N 3.45Å; S157-T187 PolarHBondContact O-OG1 2.69Å; S157-T187 PolarHBondContact OG-OG1 2.89Å; S157-G188 PolarHBondContact N-O 3.14Å; S157-G188 PolarHBondContact O-N 3.39Å; S157-G188 WeakPolarHBondContact OG-CA 3.06Å; S157-G188 PolarHBondContact OG-N 2.71Å; S157-G188 VanDerWaalsContact OG-N 3.11Å
158	T	97.8	Very high	94.5	Very high	48 Å²	48	73 Å²	73	29%	0.294	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	131.1	-176.8	-59.6	0	0	0	0	108.9	N155 Y160 A184	N155-T158 PolarHBondContact ND2-OG1 2.84Å; T158-Y160 HydrophobicContact CG2-CE2 4.41Å; T158-A184 HydrophobicContact CG2-CB 3.87Å
159	S	97.4	Very high	94.6	Very high	43 Å²	43	70.9 Å²	70.9	30%	0.301	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	166	164	64.9	0	0	0	0	109.8	N185	S159-N185 PolarHBondContact N-O 3.06Å; S159-N185 PolarHBondContact O-N 2.98Å; S159-N185 PolarHBondContact OG-O 2.95Å
160	Y	96.5	Very high	94.8	Very high	161 Å²	161	65.3 Å²	65.3	63%	0.631	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.1	173.7	-73.6	-95.7	0	0	0	108.9	T158 V183 A184	T158-Y160 HydrophobicContact CG2-CE2 4.41Å; Y160-V183 WeakPolarHBondContact CA-O 3.44Å; Y160-A184 HydrophobicContact CD1-CB 4.44Å; Y160-A184 HydrophobicContact CE1-CB 4.02Å
161	I	95.9	Very high	94.9	Very high	50 Å²	50	66.4 Å²	66.4	26%	0.256	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.4	178.2	63.9	178.3	0	0	0	109.9	V139 K182 V183 N185	V139-I161 HydrophobicContact CG1-CD1 4.04Å; V139-I161 HydrophobicContact CG1-CG1 4.45Å; I161-K182 WeakPolarHBondContact O-CA 3.34Å; I161-V183 PolarHBondContact N-O 3.06Å; I161-V183 PolarHBondContact O-N 2.67Å; I161-N185 HydrophobicContact CD1-CB 4.18Å; I161-N185 HydrophobicContact CG1-CB 4.18Å; I161-N185 HydrophobicContact CG2-CB 4.08Å
162	S	96.4	Very high	94.4	Very high	74 Å²	74	70.4 Å²	70.4	52%	0.517	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.4	176.4	-61.3	0	0	0	0	110.2	V181	S162-V181 CarbonylContact C-O 3.45Å; S162-V181 WeakPolarHBondContact CA-O 3.35Å
163	K	96.2	Very high	93.8	Very high	71 Å²	71	72.4 Å²	72.4	31%	0.309	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.4	173.5	-61.3	-74.4	-169.5	176.7	0	108.5	V137 N138 V181	V137-K163 HydrophobicContact CB-CG 4.21Å; V137-K163 HydrophobicContact CG1-CB 4.06Å; V137-K163 HydrophobicContact CG1-CG 4.08Å; V137-K163 HydrophobicContact CG2-CG 4.45Å; N138-K163 WeakPolarHBondContact O-CE 3.49Å; N138-K163 PolarHBondContact O-NZ 2.81Å; K163-V181 PolarHBondContact N-O 2.96Å; K163-V181 PolarHBondContact O-N 3.45Å
164	Q	96.9	Very high	93.2	Very high	120 Å²	120	75.3 Å²	75.3	56%	0.561	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.6	177.9	-65.3	-69.1	5.7	0	0	109.8	L178	Q164-L178 HydrophobicContact CB-CD1 4.08Å
165	L	96.4	Very high	92.9	Very high	4 Å²	4	77.5 Å²	77.5	2%	0.021	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.5	-176.8	-59.7	173.1	0	0	0	110.1	V120 F132 P134 V137 V179 V181	V120-L165 HydrophobicContact CB-CD1 4.2Å; V120-L165 HydrophobicContact CG1-CD1 3.75Å; V120-L165 HydrophobicContact CG2-CD1 3.66Å; F132-L165 HydrophobicContact CB-CD1 4.46Å; F132-L165 HydrophobicContact CD1-CB 4.19Å; F132-L165 HydrophobicContact CD1-CD1 4.25Å; P134-L165 HydrophobicContact CG-CD2 3.64Å; V137-L165 HydrophobicContact CG1-CD1 4.15Å; V137-L165 HydrophobicContact CG1-CD2 3.88Å; V137-L165 HydrophobicContact CG1-CG 4.49Å; L165-V179 PolarHBondContact N-O 2.97Å; L165-V179 PolarHBondContact O-N 2.7Å; L165-V181 HydrophobicContact CD1-CB 4.02Å; L165-V181 HydrophobicContact CD1-CG2 3.9Å
166	F	95.7	Very high	92.7	Very high	104 Å²	104	76.8 Å²	76.8	46%	0.456	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.8	167.9	-68.8	-69.9	0	0	0	110.4	F132 K133 P176 E177 L178	F132-F166 CarbonylContact C-O 3.55Å; F132-F166 VanDerWaalsContact CA-O 3.27Å; F132-F166 WeakPolarHBondContact CA-O 3.35Å; K133-F166 HydrophobicContact CB-CB 4.26Å; K133-F166 PolarHBondContact N-O 3.32Å; K133-F166 PolarHBondContact O-N 2.95Å; F166-P176 HydrophobicContact CB-CB 4.33Å; F166-P176 HydrophobicContact CD1-CB 4.29Å; F166-E177 CarbonylContact C-O 3.52Å; F166-E177 VanDerWaalsContact CA-O 3.3Å; F166-E177 WeakPolarHBondContact CA-O 3.4Å; F166-L178 HydrophobicContact CD1-CB 4.46Å; F166-L178 HydrophobicContact CD1-CD1 4.37Å; F166-L178 HydrophobicContact CE1-CB 4.26Å; F166-L178 HydrophobicContact CE1-CD1 4.15Å; F166-L178 HydrophobicContact CZ-CD1 4.36Å
167	E	93.9	Very high	92.6	Very high	43 Å²	43	79.5 Å²	79.5	20%	0.201	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.7	171.5	-178.3	165.2	176.7	0	0	110.1	K126 T130 F132 P176 E177 V179	K126-E167 IonicContact NZ-OE1 2.78Å; K126-E167 PolarHBondContact NZ-OE1 3.02Å; K126-E167 IonicContact NZ-OE2 2.73Å; K126-E167 PolarHBondContact NZ-OE2 3.34Å; T130-E167 HydrophobicContact CG2-CG 3.63Å; T130-E167 VanDerWaalsContact CG2-OE1 3.26Å; T130-E167 WeakPolarHBondContact CG2-OE1 3.2Å; F132-E167 HydrophobicContact CD1-CB 4.37Å; F132-E167 HydrophobicContact CE1-CB 4.18Å; F132-E167 HydrophobicContact CE1-CG 4.3Å; E167-P176 WeakPolarHBondContact O-CA 3.25Å; E167-E177 PolarHBondContact N-O 3.48Å; E167-E177 PolarHBondContact O-N 3.28Å; E167-E177 VanDerWaalsContact O-N 3.09Å; E167-V179 HydrophobicContact CB-CG2 3.97Å
168	I	91.9	Very high	92.5	Very high	35 Å²	35	81.8 Å²	81.8	18%	0.179	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	121.7	-176.2	-52.1	-179.6	0	0	0	108.6	T130 F131 K133 L172 P176	T130-I168 CarbonylContact C-O 3.47Å; T130-I168 WeakPolarHBondContact CA-O 3.29Å; F131-I168 PolarHBondContact N-O 3.43Å; F131-I168 PolarHBondContact O-N 3.44Å; K133-I168 HydrophobicContact CG-CD1 3.86Å; I168-L172 HydrophobicContact CG2-CD2 3.58Å; I168-P176 HydrophobicContact CD1-CB 4.42Å; I168-P176 HydrophobicContact CD1-CG 4.15Å; I168-P176 HydrophobicContact CG1-CB 3.88Å; I168-P176 HydrophobicContact CG1-CG 3.92Å
169	S	90.5	Very high	92.4	Very high	50 Å²	50	80.9 Å²	80.9	35%	0.35	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140.5	174	-65.5	0	0	0	0	111	N129 P171	N129-S169 CarbonylContact O-C 3.47Å; N129-S169 VanDerWaalsContact O-CA 3.27Å; N129-S169 WeakPolarHBondContact O-CA 2.98Å; S169-P171 CarbonylContact O-C 3.54Å
170	V	88.8	Confident	92.3	Very high	73 Å²	73	82.4 Å²	82.4	44%	0.442	45%	0.451	S	S	.	.	S	Bend	trans	-114.9	133.3	-179.8	-179.8	0	0	0	0	109.8	N129 F131	N129-V170 PolarHBondContact O-N 3.03Å; F131-V170 HydrophobicContact CD2-CG2 3.81Å; F131-V170 HydrophobicContact CE2-CB 4.12Å; F131-V170 HydrophobicContact CE2-CG2 3.59Å
171	P	86.8	Confident	92.2	Very high	99 Å²	99	75 Å²	75	64%	0.643	42%	0.423	S	S	*	.	S	Bend	cis	-65.6	149	1.5	28.5	-34.7	0	0	0	112.9	S169 T173	S169-P171 CarbonylContact O-C 3.54Å; P171-T173 VanDerWaalsContact C-N 3.34Å; P171-T173 HydrophobicContact CG-CG2 4.45Å; P171-T173 PolarHBondContact O-N 3.38Å
172	L	83.2	Confident	92.2	Very high	126 Å²	126	79.3 Å²	79.3	66%	0.66	44%	0.44	S	S	*	.			trans	-66.9	88.5	-178	-78.7	156.2	0	0	0	110.2	I168	I168-L172 HydrophobicContact CG2-CD2 3.58Å
173	T	81.5	Confident	92.1	Very high	124 Å²	124	76 Å²	76	76%	0.761	42%	0.416	S	S	*	.			trans	-95.3	-19.2	176.5	53.9	0	0	0	0	112.6	P171	P171-T173 VanDerWaalsContact C-N 3.34Å; P171-T173 HydrophobicContact CG-CG2 4.45Å; P171-T173 PolarHBondContact O-N 3.38Å
174	S	83.9	Confident	92.1	Very high	83 Å²	83	73.4 Å²	73.4	58%	0.58	41%	0.408	S	S	*	.	S	Bend	trans	-138.7	163.3	-179.2	63.2	0	0	0	0	111.9
175	V	90.6	Very high	92.2	Very high	127 Å²	127	68.6 Å²	68.6	77%	0.77	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-65.6	143.3	173.6	-178.9	0	0	0	0	109.4	E177	V175-E177 PolarHBondContact O-N 3.42Å
176	P	92.2	Very high	92.3	Very high	53 Å²	53	69.7 Å²	69.7	34%	0.344	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-52.2	131.8	172.3	-29.7	37.2	0	0	0	112.9	F166 E167 I168	F166-P176 HydrophobicContact CB-CB 4.33Å; F166-P176 HydrophobicContact CD1-CB 4.29Å; E167-P176 WeakPolarHBondContact O-CA 3.25Å; I168-P176 HydrophobicContact CD1-CB 4.42Å; I168-P176 HydrophobicContact CD1-CG 4.15Å; I168-P176 HydrophobicContact CG1-CB 3.88Å; I168-P176 HydrophobicContact CG1-CG 3.92Å
177	E	94.2	Very high	92.4	Very high	131 Å²	131	68.5 Å²	68.5	61%	0.612	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.3	-177.7	-170.3	177.7	169.8	0	0	111.1	F166 E167 V175 V179	F166-E177 CarbonylContact C-O 3.52Å; F166-E177 VanDerWaalsContact CA-O 3.3Å; F166-E177 WeakPolarHBondContact CA-O 3.4Å; E167-E177 PolarHBondContact N-O 3.48Å; E167-E177 PolarHBondContact O-N 3.28Å; E167-E177 VanDerWaalsContact O-N 3.09Å; V175-E177 PolarHBondContact O-N 3.42Å; E177-V179 HydrophobicContact CB-CG2 4.08Å; E177-V179 HydrophobicContact CG-CG2 3.87Å; E177-V179 PolarHBondContact O-N 3.39Å
178	L	96.1	Very high	92.5	Very high	98 Å²	98	67.1 Å²	67.1	51%	0.513	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	104.5	173.9	-175.4	67.4	0	0	0	109.9	Q164 F166	Q164-L178 HydrophobicContact CB-CD1 4.08Å; F166-L178 HydrophobicContact CD1-CB 4.46Å; F166-L178 HydrophobicContact CD1-CD1 4.37Å; F166-L178 HydrophobicContact CE1-CB 4.26Å; F166-L178 HydrophobicContact CE1-CD1 4.15Å; F166-L178 HydrophobicContact CZ-CD1 4.36Å
179	V	94.8	Very high	92.8	Very high	30 Å²	30	66.4 Å²	66.4	18%	0.182	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.8	-172.8	-177.9	0	0	0	0	111.2	L165 E167 E177 V181	L165-V179 PolarHBondContact N-O 2.97Å; L165-V179 PolarHBondContact O-N 2.7Å; E167-V179 HydrophobicContact CB-CG2 3.97Å; E177-V179 HydrophobicContact CB-CG2 4.08Å; E177-V179 HydrophobicContact CG-CG2 3.87Å; E177-V179 PolarHBondContact O-N 3.39Å; V179-V181 PolarHBondContact O-N 3.04Å
180	P	96.1	Very high	93.1	Very high	74 Å²	74	70.3 Å²	70.3	48%	0.481	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	109.6	171.1	30.1	-32.4	0	0	0	110.5
181	V	94.5	Very high	93.4	Very high	7 Å²	7	68.9 Å²	68.9	4%	0.042	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.3	175.8	176.2	0	0	0	0	110.5	V120 L124 F132 S162 K163 L165 V179 V183	V120-V181 HydrophobicContact CG1-CG1 3.86Å; V120-V181 HydrophobicContact CG1-CG2 4.44Å; L124-V181 HydrophobicContact CD1-CG1 3.69Å; L124-V181 HydrophobicContact CD1-CG2 4.31Å; L124-V181 HydrophobicContact CD2-CG1 4.09Å; L124-V181 HydrophobicContact CG-CG1 4.19Å; F132-V181 HydrophobicContact CD1-CG2 4.36Å; F132-V181 HydrophobicContact CE1-CG2 3.77Å; F132-V181 HydrophobicContact CZ-CG2 4.3Å; S162-V181 CarbonylContact C-O 3.45Å; S162-V181 WeakPolarHBondContact CA-O 3.35Å; K163-V181 PolarHBondContact N-O 2.96Å; K163-V181 PolarHBondContact O-N 3.45Å; L165-V181 HydrophobicContact CD1-CB 4.02Å; L165-V181 HydrophobicContact CD1-CG2 3.9Å; V179-V181 PolarHBondContact O-N 3.04Å; V181-V183 HydrophobicContact CG1-CG2 3.82Å
182	K	95.4	Very high	93.8	Very high	140 Å²	140	67.4 Å²	67.4	61%	0.609	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	121.3	173.3	-70.3	-174.7	178.1	-179.7	0	110.2	I161	I161-K182 WeakPolarHBondContact O-CA 3.34Å
183	V	95.6	Very high	94.2	Very high	4 Å²	4	65.1 Å²	65.1	2%	0.024	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.7	179.7	-171.5	0	0	0	0	110.1	V118 V137 V139 Y160 I161 V181 N185	V118-V183 HydrophobicContact CG2-CG1 3.98Å; V137-V183 HydrophobicContact CG2-CB 4.48Å; V137-V183 HydrophobicContact CG2-CG1 4.32Å; V137-V183 HydrophobicContact CG2-CG2 4Å; V139-V183 HydrophobicContact CG1-CB 4.09Å; V139-V183 HydrophobicContact CG1-CG1 3.69Å; V139-V183 HydrophobicContact CG2-CG1 4.4Å; Y160-V183 WeakPolarHBondContact CA-O 3.44Å; I161-V183 PolarHBondContact N-O 3.06Å; I161-V183 PolarHBondContact O-N 2.67Å; V181-V183 HydrophobicContact CG1-CG2 3.82Å; V183-N185 PolarHBondContact O-N 3.5Å
184	A	96.1	Very high	93.9	Very high	16 Å²	16	63.4 Å²	63.4	13%	0.132	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	130.4	178	0	0	0	0	0	111.4	R141 T158 Y160	R141-A184 PolarHBondContact NE-O 3.34Å; R141-A184 PolarHBondContact NH2-O 3.46Å; T158-A184 HydrophobicContact CG2-CB 3.87Å; Y160-A184 HydrophobicContact CD1-CB 4.44Å; Y160-A184 HydrophobicContact CE1-CB 4.02Å
185	N	97.8	Very high	93.2	Very high	19 Å²	19	63.8 Å²	63.8	10%	0.102	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	110.1	-179.9	-176	78.2	0	0	0	109.3	F140 S159 I161 V183 T187	F140-N185 WeakPolarHBondContact CB-OD1 3.49Å; F140-N185 PolarHBondContact N-OD1 3.21Å; S159-N185 PolarHBondContact N-O 3.06Å; S159-N185 PolarHBondContact O-N 2.98Å; S159-N185 PolarHBondContact OG-O 2.95Å; I161-N185 HydrophobicContact CD1-CB 4.18Å; I161-N185 HydrophobicContact CG1-CB 4.18Å; I161-N185 HydrophobicContact CG2-CB 4.08Å; V183-N185 PolarHBondContact O-N 3.5Å; N185-T187 PolarHBondContact O-N 3.03Å
186	H	98.1	Very high	91.5	Very high	28 Å²	28	62.8 Å²	62.8	13%	0.13	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.7	-176.9	-60.4	-177.7	0	0	0	109.8	F140 C142 N155	F140-H186 PolarHBondContact O-N 3.08Å; C142-H186 PolarHBondContact N-ND1 3.3Å; C142-H186 PolarHBondContact SG-ND1 3.01Å; C142-H186 VanDerWaalsContact SG-ND1 3.37Å; N155-H186 HydrophobicContact CB-CB 4.31Å
187	T	97.7	Very high	89.5	Confident	78 Å²	78	71.5 Å²	71.5	48%	0.479	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-13.4	179.6	55.3	0	0	0	0	112.9	S157 N185	S157-T187 WeakPolarHBondContact CB-OG1 3.41Å; S157-T187 PolarHBondContact O-N 3.45Å; S157-T187 PolarHBondContact O-OG1 2.69Å; S157-T187 PolarHBondContact OG-OG1 2.89Å; N185-T187 PolarHBondContact O-N 3.03Å
188	G	97.8	Very high	87.1	Confident	15 Å²	15	72 Å²	72	16%	0.155	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	141.2	177.7	0	0	0	0	0	110.9	N155 T156 S157	N155-G188 WeakPolarHBondContact CA-O 3.3Å; T156-G188 PolarHBondContact N-O 3.22Å; T156-G188 VanDerWaalsContact OG1-C 3.31Å; T156-G188 PolarHBondContact OG1-O 2.64Å; S157-G188 PolarHBondContact N-O 3.14Å; S157-G188 PolarHBondContact O-N 3.39Å; S157-G188 WeakPolarHBondContact OG-CA 3.06Å; S157-G188 PolarHBondContact OG-N 2.71Å; S157-G188 VanDerWaalsContact OG-N 3.11Å
189	C	97.8	Very high	85.1	Confident	20 Å²	20	72.5 Å²	72.5	14%	0.135	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.7	-177.7	-52.5	0	0	0	0	110.4	P113 C142 M154	P113-C189 VanDerWaalsContact CD-SG 3.54Å; C142-C189 WeakPolarHBondContact CA-SG 3.35Å; C142-C189 HydrophobicContact CB-CB 3.8Å; C142-C189 WeakPolarHBondContact CB-SG 3.3Å; C142-C189 WeakPolarHBondContact SG-CB 2.99Å; C142-C189 CovalentContact SG-SG 2.03Å; C142-C189 PolarHBondContact SG-SG 3.5Å; M154-C189 CarbonylContact O-C 3.34Å; M154-C189 VanDerWaalsContact O-CA 3.27Å; M154-C189 WeakPolarHBondContact O-CA 3.42Å
190	K	96.6	Very high	82.9	Confident	132 Å²	132	80 Å²	80	57%	0.574	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.8	171.2	-68.8	-169.9	-176.5	-179	0	110.7	M154 T156 L192	M154-K190 PolarHBondContact N-O 3.4Å; M154-K190 PolarHBondContact O-N 3.4Å; T156-K190 HydrophobicContact CG2-CB 3.69Å; T156-K190 HydrophobicContact CG2-CD 3.89Å; T156-K190 HydrophobicContact CG2-CG 3.62Å; K190-L192 HydrophobicContact CB-CD2 4.32Å; K190-L192 HydrophobicContact CB-CG 4.35Å; K190-L192 PolarHBondContact O-N 2.83Å
191	C	95.8	Very high	80.9	Confident	43 Å²	43	81.3 Å²	81.3	29%	0.291	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	111.5	169.3	-71.7	0	0	0	0	109.4	C146 L151	C146-C191 WeakPolarHBondContact CA-SG 3.36Å; C146-C191 HydrophobicContact CB-CB 3.84Å; C146-C191 WeakPolarHBondContact CB-SG 3.44Å; C146-C191 VanDerWaalsContact SG-CA 3.56Å; C146-C191 WeakPolarHBondContact SG-CB 3.44Å; C146-C191 CovalentContact SG-SG 2.03Å; C146-C191 PolarHBondContact SG-SG 3.39Å; L151-C191 HydrophobicContact CB-CB 4Å; L151-C191 HydrophobicContact CD1-CB 3.98Å
192	L	94	Very high	78.9	Confident	68 Å²	68	88.7 Å²	88.7	36%	0.356	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.7	-177.8	-61.8	179.2	0	0	0	110	L151 I152 M154 K190	L151-L192 WeakPolarHBondContact CA-O 3Å; I152-L192 PolarHBondContact N-O 2.77Å; I152-L192 PolarHBondContact O-N 3.49Å; M154-L192 HydrophobicContact CB-CD1 4.2Å; M154-L192 HydrophobicContact SD-CB 4.21Å; K190-L192 HydrophobicContact CB-CD2 4.32Å; K190-L192 HydrophobicContact CB-CG 4.35Å; K190-L192 PolarHBondContact O-N 2.83Å
193	P	91.3	Very high	76.9	Confident	77 Å²	77	88.8 Å²	88.8	50%	0.5	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.4	175	27.1	-32.6	0	0	0	110.8	S150 L151 V195	S150-P193 WeakPolarHBondContact O-CA 3.41Å; L151-P193 HydrophobicContact CD2-CB 4.15Å; P193-V195 PolarHBondContact O-N 2.93Å
194	T	76.4	Confident	74.7	Confident	88 Å²	88	99.4 Å²	99.4	54%	0.54	51%	0.512	S	S	.	.	S	Bend	trans	-66	-20.6	-178.1	-35.3	0	0	0	0	113.5	I152	I152-T194 HydrophobicContact CD1-CG2 3.64Å; I152-T194 WeakPolarHBondContact CD1-OG1 3.37Å; I152-T194 WeakPolarHBondContact CG1-OG1 3.47Å
195	V	68.3	Low	72.5	Confident	91 Å²	91	109.6 Å²	109.6	55%	0.552	55%	0.547	S	S	*	.	S	Bend	trans	-116.2	121.3	-177.7	-164.2	0	0	0	0	107.9	P193 R197	P193-V195 PolarHBondContact O-N 2.93Å; V195-R197 PolarHBondContact O-N 3.12Å
196	P	56	Low	70.1	Confident	106 Å²	106	113.3 Å²	113.3	69%	0.688	57%	0.574	S	S	*	*			trans	-57.7	113.1	157.6	-8.8	22.6	0	0	0	104.7	H198	P196-H198 VanDerWaalsContact C-N 3.31Å; P196-H198 PolarHBondContact O-N 3.11Å
197	R	49.6	Very low	67.6	Low	237 Å²	237	118.9 Å²	118.9	89%	0.894	60%	0.603	S	S	*	*			trans	-50.5	104.8	174.4	-75.7	-172.8	176.3	166.1	0.5	106.7	V195	V195-R197 PolarHBondContact O-N 3.12Å
198	H	43.3	Very low	64.8	Low	142 Å²	142	123.7 Å²	123.7	66%	0.657	62%	0.621	S	S	*	*			trans	-55.4	134.5	166.6	-80.8	-56.1	0	0	0	105.3	P196 Y200	P196-H198 VanDerWaalsContact C-N 3.31Å; P196-H198 PolarHBondContact O-N 3.11Å; H198-Y200 PolarHBondContact O-N 3.39Å
199	P	54.1	Low	62.1	Low	108 Å²	108	128.5 Å²	128.5	70%	0.701	65%	0.647	S	S	*	*	S	Bend	trans	-59.1	-4.2	179.8	-20.6	30.4	0	0	0	113.8
200	Y	49.8	Very low	59.4	Low	186 Å²	186	132 Å²	132	73%	0.729	67%	0.669	S	S	*	*	S	Bend	trans	-120.2	101.4	-178.9	-37.5	-69.2	0	0	0	106.9	H198 I202	H198-Y200 PolarHBondContact O-N 3.39Å; Y200-I202 PolarHBondContact O-N 3.03Å; Y200-I202 VanDerWaalsContact O-N 3.12Å
201	S	52.3	Low	57.1	Low	102 Å²	102	135 Å²	135	71%	0.713	69%	0.685	S	S	*	*			trans	-48.7	119.1	156.5	50	0	0	0	0	107.6	I203	S201-I203 PolarHBondContact O-N 3.21Å
202	I	52.8	Low	54.6	Low	163 Å²	163	140.6 Å²	140.6	84%	0.836	71%	0.707	S	S	*	*			trans	-52.8	116.1	160.7	-64.7	177	0	0	0	104.8	Y200 R204	Y200-I202 PolarHBondContact O-N 3.03Å; Y200-I202 VanDerWaalsContact O-N 3.12Å; I202-R204 PolarHBondContact O-N 2.03Å
203	I	53.3	Low	52.5	Low	142 Å²	142	144.1 Å²	144.1	73%	0.728	73%	0.726	S	S	*	*			trans	-61.6	85	178.4	-56.6	165.5	0	0	0	106.8	S201 R205	S201-I203 PolarHBondContact O-N 3.21Å; I203-R205 HydrophobicContact CG2-CG 4.11Å; I203-R205 PolarHBondContact O-N 3.19Å
204	R	49.7	Very low	50.9	Low	226 Å²	226	151.3 Å²	151.3	85%	0.853	74%	0.743	S	S	*	*			trans	-63.6	118	139.3	-72.7	-166.5	178.4	-156.1	0.9	102.8	I202 S206	I202-R204 PolarHBondContact O-N 2.03Å; R204-S206 PolarHBondContact O-N 2.63Å
205	R	50.6	Low	50.1	Low	231 Å²	231	148.5 Å²	148.5	87%	0.872	73%	0.727	S	S	*	*			trans	-59.8	75.7	169.2	-73.7	178.1	-178.2	159.3	-0.9	108	I203 I207	I203-R205 HydrophobicContact CG2-CG 4.11Å; I203-R205 PolarHBondContact O-N 3.19Å; R205-I207 VanDerWaalsContact C-N 3.32Å; R205-I207 PolarHBondContact O-N 2.81Å
206	S	48.2	Very low	49.6	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	74%	0.737	S	S	*	*			trans	-62.1	110.1	142.5	52.9	0	0	0	0	103.3	R204 Q208	R204-S206 PolarHBondContact O-N 2.63Å; S206-Q208 VanDerWaalsContact C-N 3.33Å; S206-Q208 PolarHBondContact O-N 3.27Å
207	I	44.2	Very low	49.5	Very low	144 Å²	144	151.3 Å²	151.3	74%	0.738	74%	0.737	S	S	*	*			trans	-42.1	107.2	162.5	-72.6	160.9	0	0	0	105.7	R205 V209	R205-I207 VanDerWaalsContact C-N 3.32Å; R205-I207 PolarHBondContact O-N 2.81Å; I207-V209 HydrophobicContact CG2-CG2 3.97Å; I207-V209 PolarHBondContact O-N 3.25Å
208	Q	39.5	Very low	49.7	Very low	180 Å²	180	145.6 Å²	145.6	84%	0.841	73%	0.733	S	S	*	*			trans	-62.2	95.1	159.7	-71.2	176.2	-1.4	0	0	103.2	S206 P210	S206-Q208 VanDerWaalsContact C-N 3.33Å; S206-Q208 PolarHBondContact O-N 3.27Å; Q208-P210 WeakPolarHBondContact O-CD 3.46Å
209	V	39.8	Very low	50.4	Low	116 Å²	116	148.5 Å²	148.5	70%	0.703	74%	0.744	S	S	*	*			trans	-63.3	117.3	154.9	-177.3	0	0	0	0	102.5	I207 E211	I207-V209 HydrophobicContact CG2-CG2 3.97Å; I207-V209 PolarHBondContact O-N 3.25Å; V209-E211 PolarHBondContact O-N 2.65Å
210	P	41.1	Very low	50.6	Low	93 Å²	93	150.8 Å²	150.8	60%	0.604	74%	0.743	S	S	*	*			trans	-55.1	131.4	174	-14.4	27.3	0	0	0	106.3	Q208 E212	Q208-P210 WeakPolarHBondContact O-CD 3.46Å; P210-E212 HydrophobicContact CB-CG 4.38Å; P210-E212 PolarHBondContact O-N 3.31Å
211	E	48.5	Very low	51.1	Low	195 Å²	195	150.3 Å²	150.3	91%	0.911	75%	0.752	S	S	*	*			trans	-60.4	80.6	152.6	-77	-175	150.6	0	0	105.9	V209 D213	V209-E211 PolarHBondContact O-N 2.65Å; E211-D213 VanDerWaalsContact C-N 3.29Å; E211-D213 PolarHBondContact O-N 3.09Å
212	E	44.7	Very low	52	Low	160 Å²	160	147 Å²	147	75%	0.748	73%	0.728	S	S	*	*			trans	-66.4	102.6	157.5	-83.3	-172.6	160.8	0	0	104.9	P210 R214	P210-E212 HydrophobicContact CB-CG 4.38Å; P210-E212 PolarHBondContact O-N 3.31Å; E212-R214 VanDerWaalsContact C-N 3.28Å; E212-R214 PolarHBondContact O-N 3.4Å
213	D	50.1	Low	52.9	Low	143 Å²	143	143.3 Å²	143.3	77%	0.765	72%	0.715	S	S	*	*			trans	-38.7	101.8	151.6	-86.8	-36.7	0	0	0	107.7	E211 C215	E211-D213 VanDerWaalsContact C-N 3.29Å; E211-D213 PolarHBondContact O-N 3.09Å; D213-C215 PolarHBondContact O-N 3.33Å
214	R	57	Low	53.4	Low	228 Å²	228	144.1 Å²	144.1	86%	0.86	72%	0.719	S	S	*	*	S	Bend	trans	-69.2	2.4	-168.7	-138.5	-178.8	-104.7	-136.4	-3.6	113.2	E212 C233	E212-R214 VanDerWaalsContact C-N 3.28Å; E212-R214 PolarHBondContact O-N 3.4Å; R214-C233 PolarHBondContact O-SG 2.94Å
215	C	58.7	Low	54.1	Low	28 Å²	28	139.7 Å²	139.7	19%	0.189	71%	0.712	C	S	.	*	S	Bend	trans	-132.7	115.4	168.5	-45.4	0	0	0	0	108.5	D213 H217 W228 C233	D213-C215 PolarHBondContact O-N 3.33Å; C215-H217 PolarHBondContact O-N 2.99Å; C215-W228 HydrophobicContact CB-CZ2 4.39Å; C215-C233 HydrophobicContact CB-CB 4.03Å; C215-C233 WeakPolarHBondContact CB-SG 3.19Å; C215-C233 WeakPolarHBondContact SG-CB 3.33Å; C215-C233 CovalentContact SG-SG 2.04Å; C215-C233 PolarHBondContact SG-SG 3.12Å
216	S	57.9	Low	55.1	Low	111 Å²	111	131.7 Å²	131.7	78%	0.776	69%	0.686	S	S	*	*	S	Bend	trans	-66.6	8.6	-172	-45.2	0	0	0	0	116.1
217	H	54.1	Low	56.3	Low	146 Å²	146	132.9 Å²	132.9	68%	0.676	68%	0.684	S	S	*	*	S	Bend	trans	-145.6	104.6	178.7	-65.3	-76.2	0	0	0	110.7	C215 K219	C215-H217 PolarHBondContact O-N 2.99Å; H217-K219 PolarHBondContact O-N 3.45Å
218	S	54.6	Low	58	Low	117 Å²	117	130.7 Å²	130.7	82%	0.818	67%	0.666	S	S	*	*			trans	-51.4	124.7	169.4	54.7	0	0	0	0	112.3
219	K	58	Low	59.6	Low	203 Å²	203	123.9 Å²	123.9	88%	0.883	64%	0.636	S	S	*	*			trans	48.6	83.1	162.4	-64.4	179.7	-178	175.6	0	116.4	H217	H217-K219 PolarHBondContact O-N 3.45Å
220	K	57.3	Low	61	Low	155 Å²	155	122.2 Å²	122.2	67%	0.674	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-81.1	128.8	150.6	-72.1	-175.1	178.9	179.7	0	108.4	C222	K220-C222 PolarHBondContact O-N 3.49Å
221	L	61.6	Low	62.4	Low	177 Å²	177	125 Å²	125	93%	0.927	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.8	169.2	-76.5	140.3	0	0	0	107.8
222	C	71.3	Confident	63.2	Low	31 Å²	31	122.1 Å²	122.1	21%	0.209	62%	0.624	C	S	.	*	P	Polyproline II helix	trans	-68.8	146.3	171.3	-69.3	0	0	0	0	109.4	K220 M226 C235	K220-C222 PolarHBondContact O-N 3.49Å; C222-M226 HydrophobicContact CB-CB 4.11Å; C222-M226 WeakPolarHBondContact CB-O 3.14Å; C222-C235 WeakPolarHBondContact CA-SG 3.43Å; C222-C235 HydrophobicContact CB-CB 3.88Å; C222-C235 WeakPolarHBondContact CB-SG 3.44Å; C222-C235 WeakPolarHBondContact SG-CB 3.41Å; C222-C235 CovalentContact SG-SG 2.04Å; C222-C235 PolarHBondContact SG-SG 3.12Å
223	P	71.8	Confident	64.6	Low	86 Å²	86	117 Å²	117	56%	0.558	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-55.5	159.4	169.4	-20.9	32.4	0	0	0	111.4	D225 M226	P223-D225 PolarHBondContact O-N 3.03Å; P223-M226 PolarHBondContact O-N 3.31Å
224	I	63.1	Low	65.6	Low	159 Å²	159	115.8 Å²	115.8	82%	0.815	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.1	133.8	179.1	-62.6	166.9	0	0	0	109.5
225	D	63.7	Low	66.7	Low	133 Å²	133	106.8 Å²	106.8	71%	0.711	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.2	21.4	-177.4	-52.1	-35	0	0	0	117.5	P223	P223-D225 PolarHBondContact O-N 3.03Å
226	M	72.2	Confident	67.6	Low	63 Å²	63	107.6 Å²	107.6	31%	0.31	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.8	140.5	167.5	-61.8	-167.7	-170.5	0	0	112.7	C222 P223 C235 V236 L237	C222-M226 HydrophobicContact CB-CB 4.11Å; C222-M226 WeakPolarHBondContact CB-O 3.14Å; P223-M226 PolarHBondContact O-N 3.31Å; M226-C235 HydrophobicContact CB-CB 4Å; M226-C235 HydrophobicContact SD-CB 4Å; M226-V236 WeakPolarHBondContact CA-O 3.34Å; M226-V236 WeakPolarHBondContact CB-O 3.37Å; M226-L237 HydrophobicContact CE-CD1 4.14Å; M226-L237 HydrophobicContact CE-CD2 3.61Å; M226-L237 HydrophobicContact CE-CG 3.63Å; M226-L237 HydrophobicContact CG-CD2 3.8Å; M226-L237 HydrophobicContact CG-CG 4.1Å; M226-L237 HydrophobicContact SD-CD2 4.41Å; M226-L237 HydrophobicContact SD-CG 4.28Å
227	L	73.8	Confident	68.1	Low	122 Å²	122	108 Å²	108	64%	0.639	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107	142	175.6	-66.4	172.4	0	0	0	110.6	D229 C235 V236	L227-D229 PolarHBondContact O-N 2.99Å; L227-C235 WeakPolarHBondContact O-CA 3.48Å; L227-V236 PolarHBondContact N-O 3.08Å; L227-V236 VanDerWaalsContact N-O 3.07Å; L227-V236 WeakPolarHBondContact O-CG2 3.42Å; L227-V236 PolarHBondContact O-N 3.44Å
228	W	80.2	Confident	68.3	Low	98 Å²	98	108.5 Å²	108.5	37%	0.371	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.7	118	176.8	-179.9	-98.9	0	0	0	110.4	C215 C233	C215-W228 HydrophobicContact CB-CZ2 4.39Å; W228-C233 HydrophobicContact CH2-CB 4.39Å; W228-C233 WeakPolarHBondContact CH2-O 3.36Å; W228-C233 HydrophobicContact CZ2-CB 4.13Å
229	D	71.9	Confident	68.1	Low	38 Å²	38	111.7 Å²	111.7	20%	0.203	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.2	107.5	172.1	-175.1	-26.5	0	0	0	109.3	L227 N231 K232 C233 K234 V236	L227-D229 PolarHBondContact O-N 2.99Å; D229-N231 PolarHBondContact O-N 3.46Å; D229-N231 WeakPolarHBondContact OD1-CA 3.23Å; D229-N231 WeakPolarHBondContact OD1-CB 2.96Å; D229-N231 PolarHBondContact OD1-N 2.99Å; D229-K232 HydrophobicContact CB-CB 4.17Å; D229-K232 PolarHBondContact O-N 3.38Å; D229-K232 PolarHBondContact OD1-N 3.05Å; D229-K232 VanDerWaalsContact OD1-N 3.13Å; D229-K232 WeakPolarHBondContact OD2-CD 3.38Å; D229-K232 VanDerWaalsContact OD2-CE 3.3Å; D229-K232 WeakPolarHBondContact OD2-CE 3.28Å; D229-K232 WeakPolarHBondContact OD2-CG 3.34Å; D229-K232 IonicContact OD2-NZ 3.62Å; D229-C233 WeakPolarHBondContact O-CA 3.36Å; D229-C233 PolarHBondContact O-N 3.11Å; D229-K234 PolarHBondContact N-O 3.13Å; D229-V236 HydrophobicContact CB-CG1 4.35Å; D229-V236 HydrophobicContact CB-CG2 4.14Å
230	S	69.8	Low	67.4	Low	80 Å²	80	110.2 Å²	110.2	56%	0.559	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-16	-178.7	-161	0	0	0	0	114
231	N	69.7	Low	66.4	Low	153 Å²	153	110.1 Å²	110.1	82%	0.818	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-25.2	175.2	-73	-18	0	0	0	111.9	D229	D229-N231 PolarHBondContact O-N 3.46Å; D229-N231 WeakPolarHBondContact OD1-CA 3.23Å; D229-N231 WeakPolarHBondContact OD1-CB 2.96Å; D229-N231 PolarHBondContact OD1-N 2.99Å
232	K	65.3	Low	65.5	Low	134 Å²	134	107.3 Å²	107.3	58%	0.583	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-4.5	179.8	-59.4	-178.7	-168.4	171.6	0	114	D229 K234	D229-K232 HydrophobicContact CB-CB 4.17Å; D229-K232 PolarHBondContact O-N 3.38Å; D229-K232 PolarHBondContact OD1-N 3.05Å; D229-K232 VanDerWaalsContact OD1-N 3.13Å; D229-K232 WeakPolarHBondContact OD2-CD 3.38Å; D229-K232 VanDerWaalsContact OD2-CE 3.3Å; D229-K232 WeakPolarHBondContact OD2-CE 3.28Å; D229-K232 WeakPolarHBondContact OD2-CG 3.34Å; D229-K232 IonicContact OD2-NZ 3.62Å; K232-K234 VanDerWaalsContact C-N 3.26Å; K232-K234 HydrophobicContact CB-CG 4.08Å; K232-K234 PolarHBondContact O-N 2.98Å
233	C	74.6	Confident	63.9	Low	51 Å²	51	113.2 Å²	113.2	35%	0.345	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	47.3	41.7	-174.5	-58.5	0	0	0	0	113.9	R214 C215 W228 D229	R214-C233 PolarHBondContact O-SG 2.94Å; C215-C233 HydrophobicContact CB-CB 4.03Å; C215-C233 WeakPolarHBondContact CB-SG 3.19Å; C215-C233 WeakPolarHBondContact SG-CB 3.33Å; C215-C233 CovalentContact SG-SG 2.04Å; C215-C233 PolarHBondContact SG-SG 3.12Å; W228-C233 HydrophobicContact CH2-CB 4.39Å; W228-C233 WeakPolarHBondContact CH2-O 3.36Å; W228-C233 HydrophobicContact CZ2-CB 4.13Å; D229-C233 WeakPolarHBondContact O-CA 3.36Å; D229-C233 PolarHBondContact O-N 3.11Å
234	K	71.6	Confident	62.4	Low	119 Å²	119	114 Å²	114	52%	0.517	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-150.1	154.7	176.9	67.6	-179.2	-176.7	176.4	0	112.3	D229 K232 V236	D229-K234 PolarHBondContact N-O 3.13Å; K232-K234 VanDerWaalsContact C-N 3.26Å; K232-K234 HydrophobicContact CB-CG 4.08Å; K232-K234 PolarHBondContact O-N 2.98Å; K234-V236 HydrophobicContact CG-CG1 4.15Å
235	C	79.5	Confident	60.8	Low	39 Å²	39	109.4 Å²	109.4	26%	0.264	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.1	130.8	169.2	-59.2	0	0	0	0	109.3	C222 M226 L227	C222-C235 WeakPolarHBondContact CA-SG 3.43Å; C222-C235 HydrophobicContact CB-CB 3.88Å; C222-C235 WeakPolarHBondContact CB-SG 3.44Å; C222-C235 WeakPolarHBondContact SG-CB 3.41Å; C222-C235 CovalentContact SG-SG 2.04Å; C222-C235 PolarHBondContact SG-SG 3.12Å; M226-C235 HydrophobicContact CB-CB 4Å; M226-C235 HydrophobicContact SD-CB 4Å; L227-C235 WeakPolarHBondContact O-CA 3.48Å
236	V	77.1	Confident	59.7	Low	45 Å²	45	109.5 Å²	109.5	27%	0.273	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.9	139.3	177.6	-67.3	0	0	0	0	109.6	M226 L227 D229 K234	M226-V236 WeakPolarHBondContact CA-O 3.34Å; M226-V236 WeakPolarHBondContact CB-O 3.37Å; L227-V236 PolarHBondContact N-O 3.08Å; L227-V236 VanDerWaalsContact N-O 3.07Å; L227-V236 WeakPolarHBondContact O-CG2 3.42Å; L227-V236 PolarHBondContact O-N 3.44Å; D229-V236 HydrophobicContact CB-CG1 4.35Å; D229-V236 HydrophobicContact CB-CG2 4.14Å; K234-V236 HydrophobicContact CG-CG1 4.15Å
237	L	69.7	Low	57.9	Low	119 Å²	119	114.9 Å²	114.9	62%	0.623	63%	0.625	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.5	138.4	170.3	-78	162.6	0	0	0	108.7	M226 E239	M226-L237 HydrophobicContact CE-CD1 4.14Å; M226-L237 HydrophobicContact CE-CD2 3.61Å; M226-L237 HydrophobicContact CE-CG 3.63Å; M226-L237 HydrophobicContact CG-CD2 3.8Å; M226-L237 HydrophobicContact CG-CG 4.1Å; M226-L237 HydrophobicContact SD-CD2 4.41Å; M226-L237 HydrophobicContact SD-CG 4.28Å; L237-E239 PolarHBondContact O-N 2.69Å
238	Q	58.3	Low	56.1	Low	156 Å²	156	116.6 Å²	116.6	73%	0.729	64%	0.635	S	S	*	*			trans	-67.6	102.6	167	-172.2	165.9	11.3	0	0	107	E240	Q238-E240 PolarHBondContact O-N 3.48Å
239	E	50.2	Low	53.9	Low	184 Å²	184	119.8 Å²	119.8	86%	0.86	65%	0.654	S	S	*	*			trans	-61.3	111.5	169.9	-96.4	174.5	165.7	0	0	107.6	L237 N241	L237-E239 PolarHBondContact O-N 2.69Å; E239-N241 PolarHBondContact O-N 3.24Å
240	E	42.2	Very low	52.6	Low	173 Å²	173	123.4 Å²	123.4	81%	0.808	68%	0.679	S	S	*	*			trans	-55.5	108.2	159.4	-68.7	-167.2	154.2	0	0	107.2	Q238 P242	Q238-E240 PolarHBondContact O-N 3.48Å; E240-P242 WeakPolarHBondContact O-CD 3.24Å
241	N	36.9	Very low	51.5	Low	153 Å²	153	127.5 Å²	127.5	82%	0.818	69%	0.689	S	S	*	*			trans	-50.7	120	164.6	-155.9	17.8	0	0	0	107.3	E239 L243	E239-N241 PolarHBondContact O-N 3.24Å; N241-L243 PolarHBondContact O-N 3.42Å
242	P	41.8	Very low	49.9	Very low	118 Å²	118	128.6 Å²	128.6	77%	0.766	69%	0.694	S	S	*	*			trans	-65.9	103.8	-174.3	-19.6	31.2	0	0	0	111.1	E240	E240-P242 WeakPolarHBondContact O-CD 3.24Å
243	L	37.7	Very low	48.6	Very low	155 Å²	155	130.4 Å²	130.4	81%	0.812	71%	0.705	S	S	*	*			trans	27.1	104.4	146.9	-77	153.1	0	0	0	118.2	N241	N241-L243 PolarHBondContact O-N 3.42Å
244	A	41.1	Very low	46.8	Very low	101 Å²	101	135.8 Å²	135.8	84%	0.835	73%	0.725	S	S	*	*				8	121.5	116.5	0	0	0	0	0	117.6
245	G	30.7	Very low	45.4	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	73%	0.731	S	S	*	*			trans	-153.1	100.9	155.4	0	0	0	0	0	109
246	T	40.3	Very low	43.9	Very low	135 Å²	135	136.2 Å²	136.2	83%	0.828	75%	0.745	S	S	*	*			trans	54.2	109.8	156.6	38.2	0	0	0	0	117.8
247	E	32.8	Very low	43	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	75%	0.752	S	S	*	*				171.5	133.5	97.4	-77.7	-152.6	150.8	0	0	109.8	H249	E247-H249 PolarHBondContact O-N 3.33Å
248	D	37.8	Very low	42.7	Very low	158 Å²	158	133.3 Å²	133.3	85%	0.845	73%	0.729	S	S	*	*			trans	-48.1	113	175.1	-71.4	-61.8	0	0	0	112.8
249	H	33.6	Very low	43.1	Very low	166 Å²	166	127.6 Å²	127.6	77%	0.769	71%	0.713	S	S	*	*			trans	-140.8	118.5	153.5	-86.3	82	0	0	0	110.5	E247 H251	E247-H249 PolarHBondContact O-N 3.33Å; H249-H251 PolarHBondContact O-N 2.64Å
250	P	44.7	Very low	43.9	Very low	113 Å²	113	124.3 Å²	124.3	73%	0.734	71%	0.707	S	S	*	*			trans	-88.3	96.3	-169.6	34.3	-31.7	0	0	0	110.3
251	H	45.8	Very low	45.2	Very low	167 Å²	167	122.2 Å²	122.2	77%	0.773	70%	0.697	S	S	*	*			trans	-142.3	88	169.7	-82.1	-76.3	0	0	0	110.5	H249	H249-H251 PolarHBondContact O-N 2.64Å
252	L	35.8	Very low	46.8	Very low	176 Å²	176	116.1 Å²	116.1	92%	0.921	66%	0.664	S	S	*	*				-158.4	72.9	127.5	-94.5	163.1	0	0	0	105.1	E254	L252-E254 PolarHBondContact O-N 2.7Å
253	Q	38.5	Very low	48.2	Very low	171 Å²	171	113.6 Å²	113.6	80%	0.799	65%	0.646	S	S	*	*			trans	-65.8	87.8	165.6	-166.7	162.8	4.5	0	0	106.1
254	E	36.7	Very low	49.8	Very low	164 Å²	164	108.8 Å²	108.8	77%	0.766	62%	0.619	S	S	*	*			trans	-20.6	126	148.1	-161.3	169.9	-157.7	0	0	108.8	L252 A256	L252-E254 PolarHBondContact O-N 2.7Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 WeakPolarHBondContact O-CA 3.45Å; E254-A256 PolarHBondContact O-N 3.12Å
255	P	42.5	Very low	51.1	Low	101 Å²	101	105.3 Å²	105.3	66%	0.656	59%	0.586	S	S	*	*			trans	-57.9	99	-172.9	22.1	-31.8	0	0	0	108.9	L257	P255-L257 PolarHBondContact O-N 2.96Å
256	A	47.5	Very low	52.8	Low	66 Å²	66	105.7 Å²	105.7	55%	0.545	57%	0.571	S	S	.	*			trans	-77.8	92.5	-163.6	0	0	0	0	0	109.2	E254 C258	E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 WeakPolarHBondContact O-CA 3.45Å; E254-A256 PolarHBondContact O-N 3.12Å; A256-C258 PolarHBondContact O-N 2.81Å
257	L	57.7	Low	54	Low	80 Å²	80	104.6 Å²	104.6	42%	0.419	56%	0.56	S	S	.	*	S	Bend	trans	-58.1	-21.1	167.1	-78.4	109.5	0	0	0	112.2	L64 P255 F264 C271	L64-L257 HydrophobicContact CB-CD2 4.26Å; L64-L257 HydrophobicContact CD1-CD2 3.59Å; L64-L257 HydrophobicContact CG-CD2 4.42Å; P255-L257 PolarHBondContact O-N 2.96Å; L257-F264 HydrophobicContact CB-CB 4.35Å; L257-F264 HydrophobicContact CB-CD2 4.11Å; L257-F264 HydrophobicContact CB-CG 4.23Å; L257-F264 HydrophobicContact CD2-CD1 4.27Å; L257-F264 HydrophobicContact CD2-CD2 4.14Å; L257-F264 HydrophobicContact CD2-CE1 4.12Å; L257-F264 HydrophobicContact CD2-CE2 4Å; L257-F264 HydrophobicContact CD2-CG 4.26Å; L257-F264 HydrophobicContact CD2-CZ 3.97Å; L257-C271 PolarHBondContact O-SG 2.81Å; L257-C271 VanDerWaalsContact O-SG 3.39Å
258	C	63.6	Low	55.5	Low	23 Å²	23	103.1 Å²	103.1	16%	0.155	55%	0.547	C	S	.	.	S	Bend	trans	-135.5	154.3	-175.5	-61.1	0	0	0	0	112.5	A256 M262 F264 C271	A256-C258 PolarHBondContact O-N 2.81Å; C258-M262 HydrophobicContact CB-CB 3.78Å; C258-F264 VanDerWaalsContact SG-CA 3.56Å; C258-C271 WeakPolarHBondContact CA-SG 3.48Å; C258-C271 HydrophobicContact CB-CB 3.72Å; C258-C271 WeakPolarHBondContact CB-SG 3.07Å; C258-C271 WeakPolarHBondContact SG-CA 3.01Å; C258-C271 WeakPolarHBondContact SG-CB 3.04Å; C258-C271 CovalentContact SG-SG 2.03Å; C258-C271 PolarHBondContact SG-SG 2.97Å
259	G	68.3	Low	57	Low	37 Å²	37	96.1 Å²	96.1	38%	0.381	51%	0.511	S	S	.	.			trans	-67.1	172.7	178.4	0	0	0	0	0	114.2	H261 M262	G259-H261 PolarHBondContact O-N 3.3Å; G259-M262 WeakPolarHBondContact O-CB 3.28Å; G259-M262 PolarHBondContact O-N 2.88Å; G259-M262 VanDerWaalsContact O-N 3.14Å
260	P	65.4	Low	58.5	Low	114 Å²	114	93.8 Å²	93.8	74%	0.74	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	140.1	174.6	-22.5	32.6	0	0	0	111.5	M262	P260-M262 PolarHBondContact O-N 3.32Å
261	H	70.1	Confident	60	Low	130 Å²	130	90.6 Å²	90.6	60%	0.602	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	11.8	-176.3	-47.9	-75.3	0	0	0	116.5	G259 K274	G259-H261 PolarHBondContact O-N 3.3Å; H261-K274 WeakPolarHBondContact O-CB 3.24Å; H261-K274 WeakPolarHBondContact O-CG 3.5Å; H261-K274 PolarHBondContact O-N 2.75Å
262	M	71.2	Confident	61.5	Low	24 Å²	24	84.5 Å²	84.5	12%	0.118	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.2	173.1	-56.2	-177.5	95.6	0	0	111.3	C258 G259 P260 C271 V272 K274 P285	C258-M262 HydrophobicContact CB-CB 3.78Å; G259-M262 WeakPolarHBondContact O-CB 3.28Å; G259-M262 PolarHBondContact O-N 2.88Å; G259-M262 VanDerWaalsContact O-N 3.14Å; P260-M262 PolarHBondContact O-N 3.32Å; M262-C271 HydrophobicContact CB-CB 4.31Å; M262-C271 HydrophobicContact CE-CB 3.74Å; M262-C271 WeakPolarHBondContact CE-O 3.36Å; M262-C271 HydrophobicContact SD-CB 4.1Å; M262-V272 CarbonylContact C-O 3.51Å; M262-V272 VanDerWaalsContact CA-O 3.26Å; M262-V272 WeakPolarHBondContact CA-O 3.44Å; M262-K274 WeakPolarHBondContact O-CE 3Å; M262-P285 VanDerWaalsContact CE-O 3.23Å; M262-P285 WeakPolarHBondContact CE-O 3.28Å
263	T	70.1	Confident	63.6	Low	65 Å²	65	77.1 Å²	77.1	40%	0.399	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.1	171.5	33.4	0	0	0	0	108.6	D265 V272 K274	T263-D265 PolarHBondContact O-N 2.03Å; T263-V272 PolarHBondContact N-O 3.04Å; T263-V272 WeakPolarHBondContact O-CG2 3.19Å; T263-V272 PolarHBondContact O-N 3.37Å; T263-V272 VanDerWaalsContact O-O 3.12Å; T263-V272 PolarHBondContact OG1-O 3.34Å; T263-K274 HydrophobicContact CG2-CD 4.26Å; T263-K274 HydrophobicContact CG2-CG 3.58Å
264	F	71.3	Confident	65.5	Low	54 Å²	54	75 Å²	75	24%	0.237	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.5	174.9	-171.2	-109	0	0	0	109.8	C67 L257 C258 E266 C269	C67-F264 HydrophobicContact CB-CZ 3.94Å; C67-F264 WeakPolarHBondContact SG-CZ 2.99Å; L257-F264 HydrophobicContact CB-CB 4.35Å; L257-F264 HydrophobicContact CB-CD2 4.11Å; L257-F264 HydrophobicContact CB-CG 4.23Å; L257-F264 HydrophobicContact CD2-CD1 4.27Å; L257-F264 HydrophobicContact CD2-CD2 4.14Å; L257-F264 HydrophobicContact CD2-CE1 4.12Å; L257-F264 HydrophobicContact CD2-CE2 4Å; L257-F264 HydrophobicContact CD2-CG 4.26Å; L257-F264 HydrophobicContact CD2-CZ 3.97Å; C258-F264 VanDerWaalsContact SG-CA 3.56Å; F264-E266 HydrophobicContact CD1-CG 4.29Å; F264-C269 HydrophobicContact CZ-CB 4.44Å
265	D	68.9	Low	67.3	Low	28 Å²	28	71.8 Å²	71.8	15%	0.15	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	114.2	171.8	-169.6	-64	0	0	0	109.5	T263 D267 R268 C269 E270 V272	T263-D265 PolarHBondContact O-N 2.03Å; D265-D267 VanDerWaalsContact C-N 3.31Å; D265-D267 PolarHBondContact O-N 2.81Å; D265-D267 PolarHBondContact OD1-N 3.4Å; D265-R268 HydrophobicContact CB-CB 4.3Å; D265-R268 PolarHBondContact OD1-N 2.83Å; D265-R268 IonicContact OD2-CZ 3.52Å; D265-R268 IonicContact OD2-NE 2.89Å; D265-R268 IonicContact OD2-NH1 2.81Å; D265-R268 PolarHBondContact OD2-NH1 3.12Å; D265-R268 IonicContact OD2-NH2 2.62Å; D265-R268 PolarHBondContact OD2-NH2 3.13Å; D265-C269 VanDerWaalsContact O-CA 3.25Å; D265-C269 WeakPolarHBondContact O-CA 2.95Å; D265-C269 PolarHBondContact O-N 2.73Å; D265-E270 WeakPolarHBondContact CB-O 3.49Å; D265-E270 PolarHBondContact N-O 2.96Å; D265-E270 PolarHBondContact O-N 3.22Å; D265-V272 HydrophobicContact CB-CG1 4.16Å; D265-V272 HydrophobicContact CB-CG2 4.19Å
266	E	67.3	Low	68.5	Low	73 Å²	73	72.1 Å²	72.1	34%	0.341	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.4	-176.4	-65.5	179.1	-158.3	0	0	113.4	K63 F264	K63-E266 HydrophobicContact CD-CG 4.19Å; K63-E266 VanDerWaalsContact CD-OE1 3.3Å; K63-E266 WeakPolarHBondContact CD-OE1 3.41Å; K63-E266 VanDerWaalsContact CE-CD 3.47Å; K63-E266 WeakPolarHBondContact CE-OE1 3.4Å; K63-E266 WeakPolarHBondContact CE-OE2 3.48Å; K63-E266 IonicContact NZ-OE1 3.19Å; K63-E266 PolarHBondContact NZ-OE1 2.03Å; K63-E266 IonicContact NZ-OE2 2.71Å; F264-E266 HydrophobicContact CD1-CG 4.29Å
267	D	65.1	Low	69.7	Low	112 Å²	112	69.9 Å²	69.9	60%	0.599	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-37.3	-177.9	-70.4	-43.8	0	0	0	111.3	R70 D265	R70-D267 PolarHBondContact NH1-O 2.72Å; D265-D267 VanDerWaalsContact C-N 3.31Å; D265-D267 PolarHBondContact O-N 2.81Å; D265-D267 PolarHBondContact OD1-N 3.4Å
268	R	63	Low	70.5	Confident	143 Å²	143	70.3 Å²	70.3	54%	0.54	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-14.3	177.5	-64.4	-169	-69.8	-86.5	3.9	113.4	D265 E270	D265-R268 HydrophobicContact CB-CB 4.3Å; D265-R268 PolarHBondContact OD1-N 2.83Å; D265-R268 IonicContact OD2-CZ 3.52Å; D265-R268 IonicContact OD2-NE 2.89Å; D265-R268 IonicContact OD2-NH1 2.81Å; D265-R268 PolarHBondContact OD2-NH1 3.12Å; D265-R268 IonicContact OD2-NH2 2.62Å; D265-R268 PolarHBondContact OD2-NH2 3.13Å; R268-E270 HydrophobicContact CB-CB 4.29Å; R268-E270 HydrophobicContact CB-CG 4.47Å; R268-E270 PolarHBondContact O-N 3.21Å
269	C	69.9	Low	70.3	Confident	12 Å²	12	78.2 Å²	78.2	8%	0.081	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	38.5	-174.3	-65.4	0	0	0	0	113	C67 L71 F264 D265	C67-C269 WeakPolarHBondContact CA-SG 3.32Å; C67-C269 HydrophobicContact CB-CB 3.45Å; C67-C269 VanDerWaalsContact CB-CB 3.45Å; C67-C269 WeakPolarHBondContact CB-SG 3.44Å; C67-C269 WeakPolarHBondContact SG-CA 3.26Å; C67-C269 WeakPolarHBondContact SG-CB 3.38Å; C67-C269 CovalentContact SG-SG 2.04Å; C67-C269 PolarHBondContact SG-SG 2.62Å; L71-C269 HydrophobicContact CD1-CB 3.71Å; F264-C269 HydrophobicContact CZ-CB 4.44Å; D265-C269 VanDerWaalsContact O-CA 3.25Å; D265-C269 WeakPolarHBondContact O-CA 2.95Å; D265-C269 PolarHBondContact O-N 2.73Å
270	E	66.3	Low	70.4	Confident	117 Å²	117	79 Å²	79	55%	0.547	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148.8	-174.3	-74.2	177.6	173	0	0	110.5	D265 R268 V272	D265-E270 WeakPolarHBondContact CB-O 3.49Å; D265-E270 PolarHBondContact N-O 2.96Å; D265-E270 PolarHBondContact O-N 3.22Å; R268-E270 HydrophobicContact CB-CB 4.29Å; R268-E270 HydrophobicContact CB-CG 4.47Å; R268-E270 PolarHBondContact O-N 3.21Å; E270-V272 PolarHBondContact O-N 3.44Å
271	C	75.6	Confident	70.8	Confident	46 Å²	46	76.4 Å²	76.4	31%	0.311	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.3	170	-64.3	0	0	0	0	109.5	L257 C258 M262	L257-C271 PolarHBondContact O-SG 2.81Å; L257-C271 VanDerWaalsContact O-SG 3.39Å; C258-C271 WeakPolarHBondContact CA-SG 3.48Å; C258-C271 HydrophobicContact CB-CB 3.72Å; C258-C271 WeakPolarHBondContact CB-SG 3.07Å; C258-C271 WeakPolarHBondContact SG-CA 3.01Å; C258-C271 WeakPolarHBondContact SG-CB 3.04Å; C258-C271 CovalentContact SG-SG 2.03Å; C258-C271 PolarHBondContact SG-SG 2.97Å; M262-C271 HydrophobicContact CB-CB 4.31Å; M262-C271 HydrophobicContact CE-CB 3.74Å; M262-C271 WeakPolarHBondContact CE-O 3.36Å; M262-C271 HydrophobicContact SD-CB 4.1Å
272	V	77.5	Confident	70.9	Confident	39 Å²	39	73.3 Å²	73.3	24%	0.236	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	154.6	175.9	-60.4	0	0	0	0	110.6	M262 T263 D265 E270	M262-V272 CarbonylContact C-O 3.51Å; M262-V272 VanDerWaalsContact CA-O 3.26Å; M262-V272 WeakPolarHBondContact CA-O 3.44Å; T263-V272 PolarHBondContact N-O 3.04Å; T263-V272 WeakPolarHBondContact O-CG2 3.19Å; T263-V272 PolarHBondContact O-N 3.37Å; T263-V272 VanDerWaalsContact O-O 3.12Å; T263-V272 PolarHBondContact OG1-O 3.34Å; D265-V272 HydrophobicContact CB-CG1 4.16Å; D265-V272 HydrophobicContact CB-CG2 4.19Å; E270-V272 PolarHBondContact O-N 3.44Å
273	C	79.8	Confident	71.2	Confident	21 Å²	21	74.9 Å²	74.9	14%	0.142	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.4	-179.2	-65.3	0	0	0	0	111.9	T275 Q283 C288	C273-T275 VanDerWaalsContact C-N 3.28Å; C273-T275 PolarHBondContact O-N 2.81Å; C273-Q283 HydrophobicContact CB-CG 4.4Å; C273-Q283 VanDerWaalsContact SG-CD 3.52Å; C273-C288 WeakPolarHBondContact CA-SG 3.41Å; C273-C288 HydrophobicContact CB-CB 3.65Å; C273-C288 WeakPolarHBondContact CB-SG 3.16Å; C273-C288 WeakPolarHBondContact SG-CA 3.12Å; C273-C288 WeakPolarHBondContact SG-CB 3.29Å; C273-C288 CovalentContact SG-SG 2.03Å; C273-C288 PolarHBondContact SG-SG 3.25Å
274	K	78.4	Confident	71.1	Confident	127 Å²	127	75 Å²	75	55%	0.552	38%	0.384	S	S	*	.	S	Bend	trans	-57.2	-42.1	-179.1	-76.8	-174.1	-172.3	-168.3	0	112.2	H261 M262 T263	H261-K274 WeakPolarHBondContact O-CB 3.24Å; H261-K274 WeakPolarHBondContact O-CG 3.5Å; H261-K274 PolarHBondContact O-N 2.75Å; M262-K274 WeakPolarHBondContact O-CE 3Å; T263-K274 HydrophobicContact CG2-CD 4.26Å; T263-K274 HydrophobicContact CG2-CG 3.58Å
275	T	73.4	Confident	70.8	Confident	96 Å²	96	76.9 Å²	76.9	59%	0.589	40%	0.401	S	S	*	.	S	Bend	trans	-118.9	121.8	-178.2	48.2	0	0	0	0	108.9	C273 Q283	C273-T275 VanDerWaalsContact C-N 3.28Å; C273-T275 PolarHBondContact O-N 2.81Å; T275-Q283 PolarHBondContact O-NE2 3.41Å
276	P	69.3	Low	70.6	Confident	107 Å²	107	83.9 Å²	83.9	70%	0.695	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-65.6	150	170.1	28.8	-33	0	0	0	109.3
277	C	72.6	Confident	70.7	Confident	20 Å²	20	84.8 Å²	84.8	14%	0.135	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-59.8	152.5	172.5	-71.8	0	0	0	0	111	L281 Q283 C290	C277-L281 HydrophobicContact CB-CB 3.94Å; C277-Q283 HydrophobicContact CB-CB 4.46Å; C277-Q283 VanDerWaalsContact SG-CB 3.53Å; C277-C290 VanDerWaalsContact CA-SG 3.59Å; C277-C290 HydrophobicContact CB-CB 3.99Å; C277-C290 WeakPolarHBondContact CB-SG 3.19Å; C277-C290 WeakPolarHBondContact SG-CA 3.43Å; C277-C290 WeakPolarHBondContact SG-CB 3.15Å; C277-C290 CovalentContact SG-SG 2.03Å; C277-C290 PolarHBondContact SG-SG 3.24Å
278	P	73.1	Confident	71.2	Confident	89 Å²	89	80.2 Å²	80.2	58%	0.578	41%	0.414	S	S	*	.	S	Bend	trans	-48.2	147.4	168.1	-23.7	32.8	0	0	0	110.2	D280 L281	P278-D280 PolarHBondContact O-N 3.49Å; P278-L281 HydrophobicContact CB-CD1 4.15Å; P278-L281 PolarHBondContact O-N 3.48Å; P278-L281 VanDerWaalsContact O-N 3.13Å
279	K	60.7	Low	71.8	Confident	189 Å²	189	75.7 Å²	75.7	82%	0.822	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	133.4	-179.4	-68.1	-176.8	-178.4	178.6	0	108.2
280	D	69.3	Low	72.3	Confident	54 Å²	54	77.7 Å²	77.7	29%	0.289	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	9.8	179.1	-40.9	-44.5	0	0	0	117	P278 C293 K294 C312	P278-D280 PolarHBondContact O-N 3.49Å; D280-C293 CarbonylContact O-C 3.43Å; D280-C293 VanDerWaalsContact O-CA 3.24Å; D280-C293 WeakPolarHBondContact O-CA 3.23Å; D280-K294 PolarHBondContact O-N 3.29Å; D280-C312 HydrophobicContact CB-CB 3.94Å; D280-C312 WeakPolarHBondContact CB-O 3.39Å
281	L	74.4	Confident	72.5	Confident	59 Å²	59	77.2 Å²	77.2	31%	0.309	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.2	165.8	-70.3	92.7	0	0	0	113.2	C277 P278 C290 E292 C312	C277-L281 HydrophobicContact CB-CB 3.94Å; P278-L281 HydrophobicContact CB-CD1 4.15Å; P278-L281 PolarHBondContact O-N 3.48Å; P278-L281 VanDerWaalsContact O-N 3.13Å; L281-C290 HydrophobicContact CB-CB 4Å; L281-C290 HydrophobicContact CD2-CB 3.66Å; L281-C290 HydrophobicContact CG-CB 4.48Å; L281-E292 CarbonylContact C-O 3.54Å; L281-E292 WeakPolarHBondContact CA-O 3.36Å; L281-C312 HydrophobicContact CD1-CB 4.42Å
282	I	71.8	Confident	72.3	Confident	65 Å²	65	80.7 Å²	80.7	33%	0.333	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	128.1	174.7	-54.9	178.8	0	0	0	108.8	C290 F291 E292 K294	I282-C290 WeakPolarHBondContact O-CA 3.31Å; I282-F291 HydrophobicContact CB-CE1 4.23Å; I282-F291 HydrophobicContact CB-CZ 4.15Å; I282-F291 HydrophobicContact CG2-CE1 3.71Å; I282-F291 HydrophobicContact CG2-CE2 4.34Å; I282-F291 HydrophobicContact CG2-CZ 3.51Å; I282-F291 VanDerWaalsContact O-CD1 3.28Å; I282-F291 WeakPolarHBondContact O-CD1 2.96Å; I282-F291 PolarHBondContact O-N 2.95Å; I282-F291 VanDerWaalsContact O-N 3.12Å; I282-E292 HydrophobicContact CB-CB 4.46Å; I282-E292 HydrophobicContact CD1-CB 4.25Å; I282-E292 HydrophobicContact CD1-CG 4.41Å; I282-E292 PolarHBondContact N-O 3.44Å; I282-K294 HydrophobicContact CG1-CB 4.37Å
283	Q	77.2	Confident	72.3	Confident	56 Å²	56	80.5 Å²	80.5	26%	0.262	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.8	-179	-172	161.7	47.1	0	0	111.5	C273 T275 C277 C288	C273-Q283 HydrophobicContact CB-CG 4.4Å; C273-Q283 VanDerWaalsContact SG-CD 3.52Å; T275-Q283 PolarHBondContact O-NE2 3.41Å; C277-Q283 HydrophobicContact CB-CB 4.46Å; C277-Q283 VanDerWaalsContact SG-CB 3.53Å; Q283-C288 PolarHBondContact NE2-O 2.89Å
284	H	69.3	Low	72	Confident	68 Å²	68	86.9 Å²	86.9	32%	0.315	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-78.1	129.6	177.3	-176.6	-87.3	0	0	0	110.3	K286 N287 C288 S289 F291	H284-K286 VanDerWaalsContact C-N 3.31Å; H284-K286 PolarHBondContact ND1-N 3.12Å; H284-K286 PolarHBondContact O-N 3.37Å; H284-N287 WeakPolarHBondContact CB-OD1 3.41Å; H284-N287 PolarHBondContact ND1-OD1 3.24Å; H284-C288 WeakPolarHBondContact O-CA 3.46Å; H284-C288 PolarHBondContact O-N 3.13Å; H284-S289 WeakPolarHBondContact CB-O 2.87Å; H284-S289 PolarHBondContact N-O 2.99Å; H284-F291 HydrophobicContact CB-CD1 3.57Å; H284-F291 HydrophobicContact CB-CE1 3.71Å
285	P	64.8	Low	71.7	Confident	93 Å²	93	82.4 Å²	82.4	60%	0.604	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.9	-165.6	24.1	-34.4	0	0	0	115.1	M262	M262-P285 VanDerWaalsContact CE-O 3.23Å; M262-P285 WeakPolarHBondContact CE-O 3.28Å
286	K	63.1	Low	71.7	Confident	176 Å²	176	79.8 Å²	79.8	77%	0.765	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-23	-173.6	-65.1	-175	177.2	180	0	115.8	H284	H284-K286 VanDerWaalsContact C-N 3.31Å; H284-K286 PolarHBondContact ND1-N 3.12Å; H284-K286 PolarHBondContact O-N 3.37Å
287	N	70.4	Confident	71.8	Confident	91 Å²	91	78.8 Å²	78.8	49%	0.487	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	0.4	-176	68.7	-5.6	0	0	0	111.9	H284 S289	H284-N287 WeakPolarHBondContact CB-OD1 3.41Å; H284-N287 PolarHBondContact ND1-OD1 3.24Å; N287-S289 PolarHBondContact ND2-OG 3.04Å; N287-S289 VanDerWaalsContact ND2-OG 3.11Å; N287-S289 PolarHBondContact O-N 2.86Å; N287-S289 PolarHBondContact OD1-N 3.43Å; N287-S289 VanDerWaalsContact OD1-N 3.12Å; N287-S289 PolarHBondContact OD1-OG 2.95Å
288	C	74.6	Confident	71.7	Confident	16 Å²	16	83.9 Å²	83.9	11%	0.108	43%	0.428	C	S	.	.			trans	58.5	16.4	178.7	-56.4	0	0	0	0	115.6	C273 Q283 H284	C273-C288 WeakPolarHBondContact CA-SG 3.41Å; C273-C288 HydrophobicContact CB-CB 3.65Å; C273-C288 WeakPolarHBondContact CB-SG 3.16Å; C273-C288 WeakPolarHBondContact SG-CA 3.12Å; C273-C288 WeakPolarHBondContact SG-CB 3.29Å; C273-C288 CovalentContact SG-SG 2.03Å; C273-C288 PolarHBondContact SG-SG 3.25Å; Q283-C288 PolarHBondContact NE2-O 2.89Å; H284-C288 WeakPolarHBondContact O-CA 3.46Å; H284-C288 PolarHBondContact O-N 3.13Å
289	S	76.9	Confident	71.7	Confident	48 Å²	48	82 Å²	82	34%	0.336	42%	0.415	S	S	.	.			trans	-73.9	140	175.4	63.8	0	0	0	0	110.9	H284 N287	H284-S289 WeakPolarHBondContact CB-O 2.87Å; H284-S289 PolarHBondContact N-O 2.99Å; N287-S289 PolarHBondContact ND2-OG 3.04Å; N287-S289 VanDerWaalsContact ND2-OG 3.11Å; N287-S289 PolarHBondContact O-N 2.86Å; N287-S289 PolarHBondContact OD1-N 3.43Å; N287-S289 VanDerWaalsContact OD1-N 3.12Å; N287-S289 PolarHBondContact OD1-OG 2.95Å
290	C	79.3	Confident	72.3	Confident	54 Å²	54	73 Å²	73	37%	0.365	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	119.7	171.9	-49	0	0	0	0	108.5	C277 L281 I282	C277-C290 VanDerWaalsContact CA-SG 3.59Å; C277-C290 HydrophobicContact CB-CB 3.99Å; C277-C290 WeakPolarHBondContact CB-SG 3.19Å; C277-C290 WeakPolarHBondContact SG-CA 3.43Å; C277-C290 WeakPolarHBondContact SG-CB 3.15Å; C277-C290 CovalentContact SG-SG 2.03Å; C277-C290 PolarHBondContact SG-SG 3.24Å; L281-C290 HydrophobicContact CB-CB 4Å; L281-C290 HydrophobicContact CD2-CB 3.66Å; L281-C290 HydrophobicContact CG-CB 4.48Å; I282-C290 WeakPolarHBondContact O-CA 3.31Å
291	F	71.1	Confident	72.3	Confident	108 Å²	108	71.9 Å²	71.9	47%	0.474	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	-17.9	-165.6	65.9	-86.2	0	0	0	115.2	I282 H284	I282-F291 HydrophobicContact CB-CE1 4.23Å; I282-F291 HydrophobicContact CB-CZ 4.15Å; I282-F291 HydrophobicContact CG2-CE1 3.71Å; I282-F291 HydrophobicContact CG2-CE2 4.34Å; I282-F291 HydrophobicContact CG2-CZ 3.51Å; I282-F291 VanDerWaalsContact O-CD1 3.28Å; I282-F291 WeakPolarHBondContact O-CD1 2.96Å; I282-F291 PolarHBondContact O-N 2.95Å; I282-F291 VanDerWaalsContact O-N 3.12Å; H284-F291 HydrophobicContact CB-CD1 3.57Å; H284-F291 HydrophobicContact CB-CE1 3.71Å
292	E	71.6	Confident	72.2	Confident	119 Å²	119	76.3 Å²	76.3	56%	0.556	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.9	148.7	-177.9	-170.6	169.1	-164.2	0	0	111.4	L281 I282	L281-E292 CarbonylContact C-O 3.54Å; L281-E292 WeakPolarHBondContact CA-O 3.36Å; I282-E292 HydrophobicContact CB-CB 4.46Å; I282-E292 HydrophobicContact CD1-CB 4.25Å; I282-E292 HydrophobicContact CD1-CG 4.41Å; I282-E292 PolarHBondContact N-O 3.44Å
293	C	76.4	Confident	72	Confident	34 Å²	34	78.8 Å²	78.8	23%	0.23	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.9	173.4	-56	0	0	0	0	110.2	D280 E295 F307 C312	D280-C293 CarbonylContact O-C 3.43Å; D280-C293 VanDerWaalsContact O-CA 3.24Å; D280-C293 WeakPolarHBondContact O-CA 3.23Å; C293-E295 VanDerWaalsContact CB-O 3.29Å; C293-E295 WeakPolarHBondContact CB-O 3.26Å; C293-E295 PolarHBondContact O-N 2.93Å; C293-F307 HydrophobicContact CB-CE2 4.22Å; C293-F307 HydrophobicContact CB-CZ 3.98Å; C293-C312 HydrophobicContact CB-CB 3.52Å; C293-C312 WeakPolarHBondContact CB-SG 3.38Å; C293-C312 WeakPolarHBondContact SG-CB 2.91Å; C293-C312 CovalentContact SG-SG 2.03Å; C293-C312 PolarHBondContact SG-SG 3.31Å
294	K	74.4	Confident	71.5	Confident	156 Å²	156	81.7 Å²	81.7	68%	0.678	41%	0.413	S	S	*	.	S	Bend	trans	-64.2	-32.6	176.1	-173.8	-180	179.2	-178.3	0	111.9	D280 I282	D280-K294 PolarHBondContact O-N 3.29Å; I282-K294 HydrophobicContact CG1-CB 4.37Å
295	E	72.9	Confident	71.6	Confident	33 Å²	33	81.5 Å²	81.5	15%	0.154	41%	0.411	C	S	.	.	S	Bend	trans	-104.6	135	173.7	-57.7	-163.6	133.8	0	0	109.2	C293 K303 F307 C314	C293-E295 VanDerWaalsContact CB-O 3.29Å; C293-E295 WeakPolarHBondContact CB-O 3.26Å; C293-E295 PolarHBondContact O-N 2.93Å; E295-K303 IonicContact OE1-NZ 3.55Å; E295-K303 PolarHBondContact OE1-NZ 3.46Å; E295-F307 WeakPolarHBondContact O-CE2 3.49Å; E295-F307 WeakPolarHBondContact O-CZ 2.91Å; E295-C314 WeakPolarHBondContact OE2-CB 3.16Å; E295-C314 PolarHBondContact OE2-N 3.07Å; E295-C314 PolarHBondContact OE2-SG 3.36Å
296	S	73.3	Confident	71.8	Confident	41 Å²	41	79.6 Å²	79.6	29%	0.287	40%	0.396	S	S	.	.			trans	-101.7	165.6	172.2	82.7	0	0	0	0	111.1	E298 T299 C300	S296-E298 WeakPolarHBondContact CB-OE2 3.35Å; S296-E298 PolarHBondContact O-N 2.88Å; S296-E298 PolarHBondContact OG-N 2.86Å; S296-E298 PolarHBondContact OG-OE2 2.84Å; S296-T299 PolarHBondContact N-OG1 3.22Å; S296-T299 PolarHBondContact O-N 2.92Å; S296-T299 VanDerWaalsContact O-N 3.09Å; S296-T299 PolarHBondContact O-OG1 2.96Å; S296-T299 PolarHBondContact OG-N 3.29Å; S296-C300 PolarHBondContact O-N 3.35Å
297	L	69.6	Low	72.1	Confident	85 Å²	85	72.9 Å²	72.9	45%	0.445	37%	0.366	S	S	.	.	H	α-helix	trans	-50.6	-43.1	172.3	-177.1	65	0	0	0	111.5	C300 C301 F307	L297-C300 PolarHBondContact O-N 3.23Å; L297-C301 WeakPolarHBondContact O-CB 3.26Å; L297-C301 PolarHBondContact O-N 3Å; L297-C301 PolarHBondContact O-SG 3.07Å; L297-F307 HydrophobicContact CB-CD1 4.43Å; L297-F307 HydrophobicContact CD1-CB 3.94Å
298	E	70.6	Confident	72.2	Confident	128 Å²	128	71.6 Å²	71.6	60%	0.598	36%	0.357	S	S	*	.	H	α-helix	trans	-65.6	-44.6	178.2	-57.6	84.3	-170.1	0	0	112.5	S296 C300 C301 Q302	S296-E298 WeakPolarHBondContact CB-OE2 3.35Å; S296-E298 PolarHBondContact O-N 2.88Å; S296-E298 PolarHBondContact OG-N 2.86Å; S296-E298 PolarHBondContact OG-OE2 2.84Å; E298-C300 VanDerWaalsContact C-N 3.27Å; E298-C300 PolarHBondContact O-N 3.39Å; E298-C301 PolarHBondContact O-N 3.04Å; E298-Q302 WeakPolarHBondContact O-CG 3.17Å; E298-Q302 PolarHBondContact O-N 3.32Å
299	T	74.1	Confident	71.7	Confident	48 Å²	48	75 Å²	75	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-64.9	-34.8	179.9	63.1	0	0	0	0	111.9	S296 K303	S296-T299 PolarHBondContact N-OG1 3.22Å; S296-T299 PolarHBondContact O-N 2.92Å; S296-T299 VanDerWaalsContact O-N 3.09Å; S296-T299 PolarHBondContact O-OG1 2.96Å; S296-T299 PolarHBondContact OG-N 3.29Å; T299-K303 WeakPolarHBondContact O-CG 3.44Å; T299-K303 PolarHBondContact O-N 2.02Å
300	C	74.2	Confident	71.2	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-70.2	-43.2	175.9	-148.6	0	0	0	0	112.3	S296 L297 E298 Q302 K303 H304 K305 F307 C314	S296-C300 PolarHBondContact O-N 3.35Å; L297-C300 PolarHBondContact O-N 3.23Å; E298-C300 VanDerWaalsContact C-N 3.27Å; E298-C300 PolarHBondContact O-N 3.39Å; C300-Q302 VanDerWaalsContact C-N 3.32Å; C300-Q302 PolarHBondContact O-N 2.82Å; C300-K303 CarbonylContact O-C 3.39Å; C300-K303 WeakPolarHBondContact O-CA 3.36Å; C300-K303 WeakPolarHBondContact O-CB 3.3Å; C300-K303 PolarHBondContact O-N 2.05Å; C300-H304 PolarHBondContact O-N 3.08Å; C300-H304 VanDerWaalsContact O-N 3.12Å; C300-K305 CarbonylContact C-O 3.4Å; C300-K305 PolarHBondContact O-N 3.45Å; C300-K305 VanDerWaalsContact SG-C 3.5Å; C300-K305 VanDerWaalsContact SG-CB 3.59Å; C300-K305 PolarHBondContact SG-O 2.81Å; C300-F307 HydrophobicContact CB-CB 3.72Å; C300-F307 PolarHBondContact SG-N 3.33Å; C300-C314 WeakPolarHBondContact CA-SG 2.99Å; C300-C314 HydrophobicContact CB-CB 4.39Å; C300-C314 WeakPolarHBondContact CB-SG 3.35Å; C300-C314 WeakPolarHBondContact SG-CA 3.18Å; C300-C314 WeakPolarHBondContact SG-CB 3.19Å; C300-C314 CovalentContact SG-SG 2.02Å; C300-C314 PolarHBondContact SG-SG 3.35Å
301	C	68.9	Low	70.6	Confident	32 Å²	32	80.1 Å²	80.1	22%	0.216	40%	0.402	C	S	.	.	H	α-helix	trans	-61.2	-39.2	174.7	-74.4	0	0	0	0	112.1	L297 E298 K303 H304 H335	L297-C301 WeakPolarHBondContact O-CB 3.26Å; L297-C301 PolarHBondContact O-N 3Å; L297-C301 PolarHBondContact O-SG 3.07Å; E298-C301 PolarHBondContact O-N 3.04Å; C301-K303 PolarHBondContact O-N 3.11Å; C301-H304 PolarHBondContact O-N 3.26Å; C301-H335 PolarHBondContact SG-CD2 2.89Å; C301-H335 PolarHBondContact SG-NE2 3.35Å
302	Q	71.6	Confident	70.7	Confident	152 Å²	152	75.6 Å²	75.6	71%	0.71	38%	0.383	S	S	*	.	H	α-helix	trans	-61	-35.2	173.5	-73	177.5	7.9	0	0	112	E298 C300 H304	E298-Q302 WeakPolarHBondContact O-CG 3.17Å; E298-Q302 PolarHBondContact O-N 3.32Å; C300-Q302 VanDerWaalsContact C-N 3.32Å; C300-Q302 PolarHBondContact O-N 2.82Å; Q302-H304 PolarHBondContact O-N 2.89Å; Q302-H304 PolarHBondContact O-ND1 2.96Å
303	K	68.3	Low	70.9	Confident	116 Å²	116	70.9 Å²	70.9	50%	0.504	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	2.4	174.1	-65.5	177.3	-174.6	-178.9	0	113.8	E295 T299 C300 C301 K305	E295-K303 IonicContact OE1-NZ 3.55Å; E295-K303 PolarHBondContact OE1-NZ 3.46Å; T299-K303 WeakPolarHBondContact O-CG 3.44Å; T299-K303 PolarHBondContact O-N 2.02Å; C300-K303 CarbonylContact O-C 3.39Å; C300-K303 WeakPolarHBondContact O-CA 3.36Å; C300-K303 WeakPolarHBondContact O-CB 3.3Å; C300-K303 PolarHBondContact O-N 2.05Å; C301-K303 PolarHBondContact O-N 3.11Å; K303-K305 HydrophobicContact CB-CG 4.35Å; K303-K305 PolarHBondContact O-N 2.83Å
304	H	67.1	Low	70.9	Confident	117 Å²	117	70.3 Å²	70.3	54%	0.542	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	24.5	-175.2	-54.2	67.2	0	0	0	114	C300 C301 Q302	C300-H304 PolarHBondContact O-N 3.08Å; C300-H304 VanDerWaalsContact O-N 3.12Å; C301-H304 PolarHBondContact O-N 3.26Å; Q302-H304 PolarHBondContact O-N 2.89Å; Q302-H304 PolarHBondContact O-ND1 2.96Å
305	K	69.5	Low	70.9	Confident	64 Å²	64	66.8 Å²	66.8	28%	0.278	35%	0.346	S	S	.	.			trans	-109.9	162.5	179.5	-60.9	-166.7	-178.8	-142.6	0	110.9	C300 K303 C314 D316	C300-K305 CarbonylContact C-O 3.4Å; C300-K305 PolarHBondContact O-N 3.45Å; C300-K305 VanDerWaalsContact SG-C 3.5Å; C300-K305 VanDerWaalsContact SG-CB 3.59Å; C300-K305 PolarHBondContact SG-O 2.81Å; K303-K305 HydrophobicContact CB-CG 4.35Å; K303-K305 PolarHBondContact O-N 2.83Å; K305-C314 HydrophobicContact CB-CB 3.9Å; K305-C314 HydrophobicContact CD-CB 3.96Å; K305-D316 VanDerWaalsContact CD-OD1 3.23Å; K305-D316 WeakPolarHBondContact CD-OD1 3.34Å; K305-D316 WeakPolarHBondContact CE-OD1 3.38Å; K305-D316 WeakPolarHBondContact CG-OD1 3.18Å; K305-D316 IonicContact NZ-OD1 3.03Å; K305-D316 PolarHBondContact NZ-OD1 3.19Å; K305-D316 IonicContact NZ-OD2 3.31Å; K305-D316 PolarHBondContact NZ-OD2 3.23Å
306	L	68.8	Low	70.7	Confident	54 Å²	54	70.9 Å²	70.9	28%	0.283	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	127	175.9	-171.8	71	0	0	0	109.4	E315	L306-E315 PolarHBondContact N-O 3.13Å; L306-E315 PolarHBondContact O-N 3.46Å
307	F	70.6	Confident	69.9	Low	34 Å²	34	78.9 Å²	78.9	15%	0.149	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.5	174.1	178.9	-110.3	0	0	0	109.6	C293 E295 L297 C300 P309	C293-F307 HydrophobicContact CB-CE2 4.22Å; C293-F307 HydrophobicContact CB-CZ 3.98Å; E295-F307 WeakPolarHBondContact O-CE2 3.49Å; E295-F307 WeakPolarHBondContact O-CZ 2.91Å; L297-F307 HydrophobicContact CB-CD1 4.43Å; L297-F307 HydrophobicContact CD1-CB 3.94Å; C300-F307 HydrophobicContact CB-CB 3.72Å; C300-F307 PolarHBondContact SG-N 3.33Å; F307-P309 HydrophobicContact CE1-CB 4.26Å
308	H	71.9	Confident	69.2	Low	64 Å²	64	77 Å²	77	30%	0.296	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	110.3	176.1	-165.7	-65.8	0	0	0	109.5	D310 T311 C312 S313	H308-D310 VanDerWaalsContact C-N 3.32Å; H308-D310 IonicContact CE1-OD2 3.83Å; H308-D310 PolarHBondContact ND1-N 2.81Å; H308-D310 PolarHBondContact O-N 3.19Å; H308-T311 VanDerWaalsContact CB-OG1 3.26Å; H308-T311 WeakPolarHBondContact CB-OG1 3.44Å; H308-T311 VanDerWaalsContact CG-OG1 3.31Å; H308-T311 PolarHBondContact ND1-OG1 2.02Å; H308-T311 PolarHBondContact O-N 2.99Å; H308-C312 PolarHBondContact O-N 2.73Å; H308-S313 PolarHBondContact N-O 3.36Å
309	P	65.2	Low	68.3	Low	87 Å²	87	75.3 Å²	75.3	57%	0.565	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.6	-169.9	25.3	-33.6	0	0	0	113.4	F307	F307-P309 HydrophobicContact CE1-CB 4.26Å
310	D	65.7	Low	67.2	Low	143 Å²	143	79.7 Å²	79.7	77%	0.765	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-18.7	-177.2	-52	-42.1	0	0	0	113.6	H308	H308-D310 VanDerWaalsContact C-N 3.32Å; H308-D310 IonicContact CE1-OD2 3.83Å; H308-D310 PolarHBondContact ND1-N 2.81Å; H308-D310 PolarHBondContact O-N 3.19Å
311	T	67.7	Low	66.2	Low	68 Å²	68	87.8 Å²	87.8	42%	0.417	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-0.6	-177.7	53.9	0	0	0	0	112.3	H308 S313	H308-T311 VanDerWaalsContact CB-OG1 3.26Å; H308-T311 WeakPolarHBondContact CB-OG1 3.44Å; H308-T311 VanDerWaalsContact CG-OG1 3.31Å; H308-T311 PolarHBondContact ND1-OG1 2.02Å; H308-T311 PolarHBondContact O-N 2.99Å; T311-S313 PolarHBondContact O-N 3.17Å; T311-S313 VanDerWaalsContact O-N 3.07Å; T311-S313 PolarHBondContact OG1-OG 3.41Å
312	C	73	Confident	65.5	Low	12 Å²	12	90.5 Å²	90.5	8%	0.081	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	24.1	-174.6	-71.7	0	0	0	0	114.2	D280 L281 C293 H308	D280-C312 HydrophobicContact CB-CB 3.94Å; D280-C312 WeakPolarHBondContact CB-O 3.39Å; L281-C312 HydrophobicContact CD1-CB 4.42Å; C293-C312 HydrophobicContact CB-CB 3.52Å; C293-C312 WeakPolarHBondContact CB-SG 3.38Å; C293-C312 WeakPolarHBondContact SG-CB 2.91Å; C293-C312 CovalentContact SG-SG 2.03Å; C293-C312 PolarHBondContact SG-SG 3.31Å; H308-C312 PolarHBondContact O-N 2.73Å
313	S	75.9	Confident	64.7	Low	21 Å²	21	91.4 Å²	91.4	15%	0.147	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.6	-169.6	63.5	0	0	0	0	113.3	H308 T311	H308-S313 PolarHBondContact N-O 3.36Å; T311-S313 PolarHBondContact O-N 3.17Å; T311-S313 VanDerWaalsContact O-N 3.07Å; T311-S313 PolarHBondContact OG1-OG 3.41Å
314	C	76.4	Confident	64.1	Low	22 Å²	22	90.7 Å²	90.7	15%	0.149	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	108.2	170.1	-82.1	0	0	0	0	112.8	E295 C300 K305	E295-C314 WeakPolarHBondContact OE2-CB 3.16Å; E295-C314 PolarHBondContact OE2-N 3.07Å; E295-C314 PolarHBondContact OE2-SG 3.36Å; C300-C314 WeakPolarHBondContact CA-SG 2.99Å; C300-C314 HydrophobicContact CB-CB 4.39Å; C300-C314 WeakPolarHBondContact CB-SG 3.35Å; C300-C314 WeakPolarHBondContact SG-CA 3.18Å; C300-C314 WeakPolarHBondContact SG-CB 3.19Å; C300-C314 CovalentContact SG-SG 2.02Å; C300-C314 PolarHBondContact SG-SG 3.35Å; K305-C314 HydrophobicContact CB-CB 3.9Å; K305-C314 HydrophobicContact CD-CB 3.96Å
315	E	74.3	Confident	63.4	Low	82 Å²	82	86.2 Å²	86.2	38%	0.383	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	145.4	-179.6	-61.9	-170.2	172.5	0	0	112.8	L306 R317	L306-E315 PolarHBondContact N-O 3.13Å; L306-E315 PolarHBondContact O-N 3.46Å; E315-R317 VanDerWaalsContact C-N 3.33Å
316	D	67.8	Low	62.7	Low	118 Å²	118	88.5 Å²	88.5	63%	0.631	47%	0.472	S	S	*	.			trans	-82.6	-7.2	-179.4	-68.2	-53.8	0	0	0	113.3	K305 C318	K305-D316 VanDerWaalsContact CD-OD1 3.23Å; K305-D316 WeakPolarHBondContact CD-OD1 3.34Å; K305-D316 WeakPolarHBondContact CE-OD1 3.38Å; K305-D316 WeakPolarHBondContact CG-OD1 3.18Å; K305-D316 IonicContact NZ-OD1 3.03Å; K305-D316 PolarHBondContact NZ-OD1 3.19Å; K305-D316 IonicContact NZ-OD2 3.31Å; K305-D316 PolarHBondContact NZ-OD2 3.23Å; D316-C318 PolarHBondContact O-N 3.25Å; D316-C318 VanDerWaalsContact O-N 3.17Å
317	R	57.5	Low	62.1	Low	209 Å²	209	91.8 Å²	91.8	79%	0.789	49%	0.489	S	S	*	.			trans	-82.8	98.6	-175.5	-74.7	-175	-164.2	-129.9	1.7	111.3	E315 P319	E315-R317 VanDerWaalsContact C-N 3.33Å; R317-P319 WeakPolarHBondContact O-CD 3.48Å
318	C	54.3	Low	61.3	Low	45 Å²	45	93.6 Å²	93.6	30%	0.304	52%	0.517	S	S	.	.			trans	-67.7	113.5	159.1	-88.7	0	0	0	0	110.4	D316 F320 T322 C332	D316-C318 PolarHBondContact O-N 3.25Å; D316-C318 VanDerWaalsContact O-N 3.17Å; C318-F320 PolarHBondContact O-N 3.19Å; C318-T322 HydrophobicContact CB-CG2 4.26Å; C318-C332 WeakPolarHBondContact CA-SG 3.11Å; C318-C332 HydrophobicContact CB-CB 4.4Å; C318-C332 WeakPolarHBondContact CB-SG 3.49Å; C318-C332 WeakPolarHBondContact SG-CA 3.49Å; C318-C332 WeakPolarHBondContact SG-CB 3.35Å; C318-C332 CovalentContact SG-SG 2.02Å; C318-C332 PolarHBondContact SG-SG 3.24Å
319	P	52.1	Low	60.5	Low	94 Å²	94	96.2 Å²	96.2	61%	0.61	53%	0.528	S	S	*	.	S	Bend	trans	-74.2	-16.7	-179.6	-14.1	30.3	0	0	0	113.1	R317	R317-P319 WeakPolarHBondContact O-CD 3.48Å
320	F	51.3	Low	59.9	Low	139 Å²	139	97 Å²	97	61%	0.61	53%	0.531	S	S	*	.	S	Bend	trans	-128.1	120.4	179.5	-60.3	-80.9	0	0	0	108.8	C318	C318-F320 PolarHBondContact O-N 3.19Å
321	H	53	Low	59.4	Low	170 Å²	170	91 Å²	91	79%	0.787	50%	0.501	S	S	*	.			trans	-9.4	120.6	180	-60.2	-74.2	0	0	0	116.5	R323	H321-R323 PolarHBondContact O-N 2.83Å
322	T	53.3	Low	58.8	Low	90 Å²	90	88.2 Å²	88.2	55%	0.552	49%	0.485	S	S	*	.			trans	-56.4	129.9	169.9	48.2	0	0	0	0	110.4	C318	C318-T322 HydrophobicContact CB-CG2 4.26Å
323	R	55.3	Low	57.8	Low	170 Å²	170	90 Å²	90	64%	0.642	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	147.5	172.4	-72.3	-171.7	-178	-171.6	0.5	110.3	H321 C325 A331	H321-R323 PolarHBondContact O-N 2.83Å; R323-C325 PolarHBondContact O-N 2.87Å; R323-A331 PolarHBondContact N-O 2.89Å; R323-A331 VanDerWaalsContact N-O 3.11Å; R323-A331 PolarHBondContact O-N 2.04Å; R323-A331 VanDerWaalsContact O-N 3.08Å
324	P	54.4	Low	56.7	Low	102 Å²	102	96.3 Å²	96.3	66%	0.662	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	117.9	165.9	-8.7	23.2	0	0	0	108.4
325	C	54.2	Low	55.6	Low	23 Å²	23	97 Å²	97	16%	0.155	53%	0.526	C	S	.	.			trans	-73.3	160.4	169.2	-62.5	0	0	0	0	109.7	R323 N327 G328 K329 C336	R323-C325 PolarHBondContact O-N 2.87Å; C325-N327 PolarHBondContact O-N 3.32Å; C325-G328 PolarHBondContact O-N 2.86Å; C325-K329 PolarHBondContact N-O 3.02Å; C325-C336 VanDerWaalsContact CA-SG 3.51Å; C325-C336 HydrophobicContact CB-CB 4.03Å; C325-C336 WeakPolarHBondContact CB-SG 3.44Å; C325-C336 VanDerWaalsContact SG-CA 3.5Å; C325-C336 WeakPolarHBondContact SG-CB 3.05Å; C325-C336 CovalentContact SG-SG 2.05Å; C325-C336 PolarHBondContact SG-SG 3.07Å
326	A	54.4	Low	54.6	Low	112 Å²	112	95.8 Å²	95.8	93%	0.926	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-17	-179.3	0	0	0	0	0	114.8	G328	A326-G328 VanDerWaalsContact C-N 3.31Å
327	N	55.8	Low	53.7	Low	122 Å²	122	101 Å²	101	65%	0.652	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	13.8	174.1	-72	-12	0	0	0	114	C325 K329	C325-N327 PolarHBondContact O-N 3.32Å; N327-K329 PolarHBondContact O-N 2.89Å
328	G	53.9	Low	53.2	Low	72 Å²	72	97.8 Å²	97.8	74%	0.742	53%	0.529	S	S	*	.	S	Bend	trans	73.9	5.9	176.3	0	0	0	0	0	115.5	C325 A326	C325-G328 PolarHBondContact O-N 2.86Å; A326-G328 VanDerWaalsContact C-N 3.31Å
329	K	54.7	Low	52.6	Low	120 Å²	120	101 Å²	101	52%	0.522	55%	0.549	S	S	.	.			trans	-102.2	136.4	176.2	-62.1	-168.8	179.5	-164.9	0	110.8	C325 N327	C325-K329 PolarHBondContact N-O 3.02Å; N327-K329 PolarHBondContact O-N 2.89Å
330	T	53.7	Low	52.2	Low	103 Å²	103	104.4 Å²	104.4	63%	0.632	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.6	121.6	172.3	35.7	0	0	0	0	109.8
331	A	54.7	Low	51.5	Low	16 Å²	16	106.8 Å²	106.8	13%	0.132	57%	0.568	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-143.2	167.4	176.9	0	0	0	0	0	111.2	R323	R323-A331 PolarHBondContact N-O 2.89Å; R323-A331 VanDerWaalsContact N-O 3.11Å; R323-A331 PolarHBondContact O-N 2.04Å; R323-A331 VanDerWaalsContact O-N 3.08Å
332	C	55	Low	50.6	Low	11 Å²	11	108.4 Å²	108.4	7%	0.074	57%	0.572	C	S	.	*			trans	-61.3	137.5	173.5	-120.8	0	0	0	0	110.8	C318 K334 H335	C318-C332 WeakPolarHBondContact CA-SG 3.11Å; C318-C332 HydrophobicContact CB-CB 4.4Å; C318-C332 WeakPolarHBondContact CB-SG 3.49Å; C318-C332 WeakPolarHBondContact SG-CA 3.49Å; C318-C332 WeakPolarHBondContact SG-CB 3.35Å; C318-C332 CovalentContact SG-SG 2.02Å; C318-C332 PolarHBondContact SG-SG 3.24Å; C332-K334 PolarHBondContact O-N 3.02Å; C332-H335 VanDerWaalsContact CB-ND1 3.26Å; C332-H335 WeakPolarHBondContact CB-ND1 3.08Å; C332-H335 WeakPolarHBondContact O-CB 3.21Å; C332-H335 PolarHBondContact O-N 3.03Å
333	A	52.5	Low	49.6	Very low	50 Å²	50	115.9 Å²	115.9	41%	0.413	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.7	-26.3	-173.7	0	0	0	0	0	114.7	H335	A333-H335 VanDerWaalsContact C-N 3.34Å
334	K	51.1	Low	48.4	Very low	152 Å²	152	112.2 Å²	112.2	66%	0.661	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-19.7	176.7	-52.4	-174.1	-175.8	-177.4	0	113.5	C332	C332-K334 PolarHBondContact O-N 3.02Å
335	H	53.9	Low	47.4	Very low	36 Å²	36	112.1 Å²	112.1	17%	0.167	61%	0.605	C	S	.	*	T	Hydrogen-bonded Turn	trans	-96.6	-9.4	-176	-59.5	123.6	0	0	0	114.4	C301 C332 A333 R337	C301-H335 PolarHBondContact SG-CD2 2.89Å; C301-H335 PolarHBondContact SG-NE2 3.35Å; C332-H335 VanDerWaalsContact CB-ND1 3.26Å; C332-H335 WeakPolarHBondContact CB-ND1 3.08Å; C332-H335 WeakPolarHBondContact O-CB 3.21Å; C332-H335 PolarHBondContact O-N 3.03Å; A333-H335 VanDerWaalsContact C-N 3.34Å; H335-R337 PolarHBondContact O-N 2.94Å; H335-R337 VanDerWaalsContact O-N 3.13Å
336	C	52.7	Low	46.3	Very low	57 Å²	57	120.4 Å²	120.4	39%	0.385	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	-3.7	173.6	-63.7	0	0	0	0	113.3	C325	C325-C336 VanDerWaalsContact CA-SG 3.51Å; C325-C336 HydrophobicContact CB-CB 4.03Å; C325-C336 WeakPolarHBondContact CB-SG 3.44Å; C325-C336 VanDerWaalsContact SG-CA 3.5Å; C325-C336 WeakPolarHBondContact SG-CB 3.05Å; C325-C336 CovalentContact SG-SG 2.05Å; C325-C336 PolarHBondContact SG-SG 3.07Å
337	R	48.9	Very low	45.1	Very low	228 Å²	228	118.4 Å²	118.4	86%	0.86	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-4.4	-179.2	-79.3	-166.6	179.5	177.7	0.8	115.4	H335 P339	H335-R337 PolarHBondContact O-N 2.94Å; H335-R337 VanDerWaalsContact O-N 3.13Å; R337-P339 WeakPolarHBondContact O-CD 3.48Å
338	F	48.1	Very low	44.3	Very low	141 Å²	141	118.3 Å²	118.3	62%	0.618	64%	0.637	S	S	*	*			trans	-82.8	108.2	173.5	-73	-80.6	0	0	0	109.2	K340	F338-K340 PolarHBondContact O-N 3.02Å
339	P	41.4	Very low	43.3	Very low	113 Å²	113	123.4 Å²	123.4	73%	0.734	64%	0.642	S	S	*	*			trans	-66	130.1	174.9	-7.7	25.5	0	0	0	107	R337 E341	R337-P339 WeakPolarHBondContact O-CD 3.48Å; P339-E341 VanDerWaalsContact C-N 3.35Å; P339-E341 PolarHBondContact O-N 3.39Å
340	K	44.1	Very low	42.2	Very low	165 Å²	165	122.1 Å²	122.1	72%	0.717	65%	0.648	S	S	*	*			trans	-61.4	104.1	159.4	-78.2	-174.4	173.3	-174	0	106.6	F338 K342	F338-K340 PolarHBondContact O-N 3.02Å; K340-K342 PolarHBondContact O-N 2.84Å
341	E	35.5	Very low	41.3	Very low	189 Å²	189	128.7 Å²	128.7	88%	0.883	66%	0.661	S	S	*	*			trans	-56.1	113.7	158.9	-84.5	-173.6	153.8	0	0	107.2	P339 R343	P339-E341 VanDerWaalsContact C-N 3.35Å; P339-E341 PolarHBondContact O-N 3.39Å; E341-R343 PolarHBondContact O-N 3.38Å
342	K	35	Very low	40.1	Very low	204 Å²	204	137 Å²	137	89%	0.887	70%	0.697	S	S	*	*			trans	-61.8	104.6	169.6	-78.2	178.8	174.3	178.4	0	107	K340 A344	K340-K342 PolarHBondContact O-N 2.84Å; K342-A344 VanDerWaalsContact C-N 3.31Å; K342-A344 PolarHBondContact O-N 3.2Å
343	R	33.3	Very low	39.3	Very low	247 Å²	247	144 Å²	144	93%	0.932	73%	0.734	S	S	*	*			trans	-61.5	100.1	154.3	-91.2	-177.6	178.8	177.4	-0.3	107.1	E341 A345	E341-R343 PolarHBondContact O-N 3.38Å; R343-A345 PolarHBondContact O-N 3.39Å
344	A	29.1	Very low	39.4	Very low	93 Å²	93	151 Å²	151	77%	0.769	77%	0.774	S	S	*	*			trans	-59.2	122.7	160.4	0	0	0	0	0	107.3	K342 Q346	K342-A344 VanDerWaalsContact C-N 3.31Å; K342-A344 PolarHBondContact O-N 3.2Å; A344-Q346 PolarHBondContact O-N 2.04Å
345	A	32.5	Very low	38.8	Very low	101 Å²	101	150.9 Å²	150.9	84%	0.835	78%	0.78	S	S	*	*			trans	-65.8	110.7	175.8	0	0	0	0	0	109.3	R343 G347	R343-A345 PolarHBondContact O-N 3.39Å; A345-G347 PolarHBondContact O-N 3.23Å
346	Q	31.5	Very low	38	Very low	196 Å²	196	156.9 Å²	156.9	92%	0.916	81%	0.812	S	S	*	*			trans	-81.3	102.5	152	-80.2	179.6	-27	0	0	106.8	A344	A344-Q346 PolarHBondContact O-N 2.04Å
347	G	29.9	Very low	37.2	Very low	70 Å²	70	162.5 Å²	162.5	72%	0.722	84%	0.836	S	S	*	*			trans	-89.8	132.2	163.6	0	0	0	0	0	109.4	A345	A345-G347 PolarHBondContact O-N 3.23Å
348	P	38.2	Very low	36.5	Very low	120 Å²	120	158.6 Å²	158.6	78%	0.779	84%	0.835	S	S	*	*			trans	-91.1	118.8	164.7	32.4	-23.6	0	0	0	108.7
349	H	33.3	Very low	35.8	Very low	180 Å²	180	159.8 Å²	159.8	83%	0.833	85%	0.848	S	S	*	*			trans	-150.5	102.5	156.1	-109.5	-64.5	0	0	0	111.7
350	S	31.1	Very low	35.4	Very low	93 Å²	93	162.9 Å²	162.9	65%	0.65	86%	0.856	S	S	*	*			trans	29.3	125.6	134.1	58.8	0	0	0	0	122.1
351	R	34.8	Very low	34.8	Very low	240 Å²	240	162.7 Å²	162.7	91%	0.906	87%	0.866	S	S	*	*			trans	62.5	115.5	139.1	-79.8	-174.6	167.8	-178.2	-3.8	119.5
352	E	30.6	Very low	34.7	Very low	192 Å²	192	160.7 Å²	160.7	90%	0.897	86%	0.864	S	S	*	*				-173.6	130.4	109.8	-104.4	172.8	163	0	0	109.6
353	N	37.3	Very low	34.7	Very low	158 Å²	158	157.1 Å²	157.1	85%	0.845	86%	0.862	S	S	*	*			trans	-142	138.5	161.7	-107.3	4.4	0	0	0	105.9
354	P	55.2	Low	34.9	Very low	195 Å²	195	148.9 Å²	148.9	100%	1.266	86%	0.856	S	S	*	*			trans	-75	0	142	28.5	-23.6	0	0	0	111.4

Retrieved 354 of 354 residues in 477.2 ms (Link to these results)

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