A0A077ZL28_TRITR Loading...

Ribosome releasing factor 2, mitochondrial

AlphaFold DB , UniProt , Accession A0A077ZL28, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 751 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	34.8	Very low	38.2	Very low	195 Å²	195	128.1 Å²	128.1	96%	0.961	63%	0.631	S	S	*	*				0	-40.8	0	-132.9	174.9	-170.9	0	0	111	R4 R5	M1-R4 PolarHBondContact O-N 3.12Å; M1-R5 PolarHBondContact O-N 3.02Å
2	V	36.4	Very low	37.9	Very low	107 Å²	107	123.8 Å²	123.8	65%	0.648	62%	0.623	S	S	*	*	H	α-helix	trans	-58.7	-48.9	171.1	-177.6	0	0	0	0	112.2	R4 R5 L6	V2-R4 VanDerWaalsContact C-N 3.29Å; V2-R4 PolarHBondContact O-N 3.1Å; V2-R5 PolarHBondContact O-N 3.29Å; V2-R5 VanDerWaalsContact O-N 3.16Å; V2-L6 HydrophobicContact CG1-CD1 3.96Å; V2-L6 PolarHBondContact O-N 2.69Å
3	T	38.3	Very low	37.6	Very low	106 Å²	106	127 Å²	127	65%	0.65	63%	0.631	S	S	*	*	H	α-helix	trans	-58.7	-31.3	175.8	22.9	0	0	0	0	114.9
4	R	39	Very low	37	Very low	216 Å²	216	126.1 Å²	126.1	82%	0.815	64%	0.643	S	S	*	*	H	α-helix	trans	-82.4	-26.4	178.4	-105.9	-174.9	-179	178.8	1	113.4	M1 V2	M1-R4 PolarHBondContact O-N 3.12Å; V2-R4 VanDerWaalsContact C-N 3.29Å; V2-R4 PolarHBondContact O-N 3.1Å
5	R	40.7	Very low	36.5	Very low	196 Å²	196	133.3 Å²	133.3	74%	0.74	66%	0.659	S	S	*	*	H	α-helix	trans	-80.1	-33.6	174.6	-81.4	-172.7	173.3	-178.1	-2.3	111.9	M1 V2 L7 S8 A9	M1-R5 PolarHBondContact O-N 3.02Å; V2-R5 PolarHBondContact O-N 3.29Å; V2-R5 VanDerWaalsContact O-N 3.16Å; R5-L7 VanDerWaalsContact C-N 3.32Å; R5-L7 PolarHBondContact O-N 3.09Å; R5-S8 PolarHBondContact O-N 3.09Å; R5-S8 PolarHBondContact O-OG 2.91Å; R5-S8 VanDerWaalsContact O-OG 3.07Å; R5-A9 PolarHBondContact O-N 3Å
6	L	39.4	Very low	36.1	Very low	75 Å²	75	134.1 Å²	134.1	39%	0.393	67%	0.666	S	S	.	*	H	α-helix	trans	-55.8	-44.6	171.3	-85.8	153.9	0	0	0	111.9	V2 S8 V10 I271	V2-L6 HydrophobicContact CG1-CD1 3.96Å; V2-L6 PolarHBondContact O-N 2.69Å; L6-S8 VanDerWaalsContact C-N 3.29Å; L6-S8 PolarHBondContact O-N 3.23Å; L6-V10 WeakPolarHBondContact O-CG2 3.48Å; L6-I271 HydrophobicContact CD2-CG2 4.08Å
7	L	39.2	Very low	35.7	Very low	95 Å²	95	134.9 Å²	134.9	50%	0.497	67%	0.673	S	S	.	*	H	α-helix	trans	-65.9	-20.8	-180	-87.8	154.8	0	0	0	115.5	R5	R5-L7 VanDerWaalsContact C-N 3.32Å; R5-L7 PolarHBondContact O-N 3.09Å
8	S	37.8	Very low	35.4	Very low	83 Å²	83	133.6 Å²	133.6	58%	0.58	68%	0.676	S	S	*	*	H	α-helix	trans	-93.2	-28.1	-178.8	62.6	0	0	0	0	113.9	R5 L6	R5-S8 PolarHBondContact O-N 3.09Å; R5-S8 PolarHBondContact O-OG 2.91Å; R5-S8 VanDerWaalsContact O-OG 3.07Å; L6-S8 VanDerWaalsContact C-N 3.29Å; L6-S8 PolarHBondContact O-N 3.23Å
9	A	38.3	Very low	35.2	Very low	51 Å²	51	133 Å²	133	42%	0.421	68%	0.682	S	S	.	*	H	α-helix	trans	-78.7	-29.6	-179	0	0	0	0	0	112.6	R5 S12	R5-A9 PolarHBondContact O-N 3Å; A9-S12 PolarHBondContact O-OG 3.44Å
10	V	40.4	Very low	34.9	Very low	71 Å²	71	134.6 Å²	134.6	43%	0.43	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-81.5	-22.1	-174.7	-171.8	0	0	0	0	113.4	L6 S12 E254	L6-V10 WeakPolarHBondContact O-CG2 3.48Å; V10-S12 VanDerWaalsContact C-N 3.26Å; V10-S12 PolarHBondContact O-N 3.45Å; V10-E254 HydrophobicContact CG1-CG 4.13Å; V10-E254 WeakPolarHBondContact CG1-OE1 3.35Å; V10-E254 HydrophobicContact CG2-CG 4.48Å
11	R	36.4	Very low	34.4	Very low	214 Å²	214	135.7 Å²	135.7	81%	0.808	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-76.3	-3.8	-177.2	-76.3	-175.8	173.8	-173.5	-0.8	115.3
12	S	34	Very low	33.8	Very low	76 Å²	76	130.9 Å²	130.9	53%	0.531	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-115.2	33.8	-166.5	59.7	0	0	0	0	115.1	A9 V10	A9-S12 PolarHBondContact O-OG 3.44Å; V10-S12 VanDerWaalsContact C-N 3.26Å; V10-S12 PolarHBondContact O-N 3.45Å
13	F	33.8	Very low	33.3	Very low	166 Å²	166	131.2 Å²	131.2	73%	0.728	69%	0.687	S	S	*	*			trans	-150.5	101.4	168.5	-95.3	-77.9	0	0	0	114
14	S	29.1	Very low	32.6	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	69%	0.687	S	S	*	*			trans	-110.1	82.9	163.2	51.2	0	0	0	0	109
15	R	29.4	Very low	31.9	Very low	234 Å²	234	129.8 Å²	129.8	88%	0.883	69%	0.685	S	S	*	*			trans	172.7	98.3	162.2	-95.7	156.2	-157.2	-148.4	7.8	108
16	L	31	Very low	31.2	Very low	147 Å²	147	129.3 Å²	129.3	77%	0.77	69%	0.688	S	S	*	*			trans	-117.7	137.7	166.1	-86.1	164	0	0	0	109
17	D	29.5	Very low	30.5	Very low	148 Å²	148	133.1 Å²	133.1	79%	0.791	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-58.7	152	-170.6	-69.5	-52.4	0	0	0	114
18	P	30.3	Very low	29.9	Very low	110 Å²	110	139.9 Å²	139.9	71%	0.714	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-66	146.8	178.2	28.4	-33.5	0	0	0	111.1	I20	P18-I20 PolarHBondContact O-N 3.34Å
19	P	31.8	Very low	29.3	Very low	123 Å²	123	146.3 Å²	146.3	80%	0.799	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-64.8	132.7	179.6	26.6	-32.6	0	0	0	110.7	N21	P19-N21 PolarHBondContact O-N 3.23Å; P19-N21 VanDerWaalsContact O-N 3.1Å
20	I	28.1	Very low	28.7	Very low	165 Å²	165	151.8 Å²	151.8	85%	0.846	75%	0.748	S	S	*	*			trans	-58.8	113.2	175.4	-65.1	167.7	0	0	0	108.8	P18 C22	P18-I20 PolarHBondContact O-N 3.34Å; I20-C22 PolarHBondContact O-N 2.85Å; I20-C22 VanDerWaalsContact O-N 3.11Å
21	N	24.3	Very low	28.2	Very low	157 Å²	157	152.4 Å²	152.4	84%	0.84	76%	0.761	S	S	*	*			trans	-73.1	95.3	178.7	-150.2	4.4	0	0	0	108.9	P19 P23	P19-N21 PolarHBondContact O-N 3.23Å; P19-N21 VanDerWaalsContact O-N 3.1Å; N21-P23 WeakPolarHBondContact O-CD 3.29Å
22	C	23.6	Very low	28	Very low	95 Å²	95	147.5 Å²	147.5	64%	0.642	76%	0.759	S	S	*	*			trans	-99	107.5	171.3	-161.2	0	0	0	0	108.9	I20 I24	I20-C22 PolarHBondContact O-N 2.85Å; I20-C22 VanDerWaalsContact O-N 3.11Å; C22-I24 VanDerWaalsContact C-N 3.31Å; C22-I24 PolarHBondContact O-N 2.8Å
23	P	24.3	Very low	28.2	Very low	114 Å²	114	147.9 Å²	147.9	74%	0.74	76%	0.758	S	S	*	*			trans	-81.4	81.6	-179.2	33.9	-31.1	0	0	0	108.4	N21 Q25	N21-P23 WeakPolarHBondContact O-CD 3.29Å; P23-Q25 VanDerWaalsContact C-N 3.32Å; P23-Q25 PolarHBondContact O-N 3.34Å; P23-Q25 VanDerWaalsContact O-N 3.1Å
24	I	25.2	Very low	28.1	Very low	130 Å²	130	142 Å²	142	67%	0.667	75%	0.745	S	S	*	*			trans	-79.1	93.9	164.2	-56	176.4	0	0	0	105.9	C22 F26	C22-I24 VanDerWaalsContact C-N 3.31Å; C22-I24 PolarHBondContact O-N 2.8Å; I24-F26 PolarHBondContact O-N 2.87Å
25	Q	23.2	Very low	28.3	Very low	162 Å²	162	140.8 Å²	140.8	76%	0.757	73%	0.734	S	S	*	*			trans	-52.8	108.2	165.2	-82.8	-177.3	-16.6	0	0	108.3	P23 K27	P23-Q25 VanDerWaalsContact C-N 3.32Å; P23-Q25 PolarHBondContact O-N 3.34Å; P23-Q25 VanDerWaalsContact O-N 3.1Å; Q25-K27 PolarHBondContact O-N 2.95Å
26	F	26	Very low	28.7	Very low	185 Å²	185	132 Å²	132	81%	0.811	71%	0.705	S	S	*	*			trans	-62.9	78.8	166.4	-92.3	-91.8	0	0	0	109	I24 R28	I24-F26 PolarHBondContact O-N 2.87Å; F26-R28 PolarHBondContact O-N 2.99Å
27	K	24.1	Very low	28.6	Very low	155 Å²	155	128.5 Å²	128.5	67%	0.674	69%	0.692	S	S	*	*			trans	-71.2	107	158.9	-88.9	-175.7	177.2	175.9	0	106.1	Q25 R29	Q25-K27 PolarHBondContact O-N 2.95Å; K27-R29 PolarHBondContact O-N 3.48Å
28	R	27	Very low	28.5	Very low	238 Å²	238	125.2 Å²	125.2	90%	0.898	68%	0.68	S	S	*	*			trans	-51	81.9	163.6	-72.3	179.8	171.2	-179.4	-4.9	109.1	F26	F26-R28 PolarHBondContact O-N 2.99Å
29	R	25.6	Very low	28.5	Very low	217 Å²	217	125.2 Å²	125.2	82%	0.819	68%	0.683	S	S	*	*			trans	-91.1	103.5	170.1	-84.6	-172.3	168.4	-178.6	-2.6	106.2	K27 A31	K27-R29 PolarHBondContact O-N 3.48Å; R29-A31 PolarHBondContact O-N 2.69Å
30	H	26	Very low	29.2	Very low	166 Å²	166	124 Å²	124	77%	0.769	67%	0.666	S	S	*	*			trans	-54.9	93.1	159.8	-68.6	-71.3	0	0	0	107.9	S32	H30-S32 PolarHBondContact O-N 3.12Å
31	A	29.7	Very low	30.2	Very low	85 Å²	85	120 Å²	120	70%	0.702	64%	0.644	S	S	*	*			trans	-86.1	97.3	175.9	0	0	0	0	0	107.6	R29	R29-A31 PolarHBondContact O-N 2.69Å
32	S	32.3	Very low	31.3	Very low	110 Å²	110	116 Å²	116	77%	0.769	63%	0.632	S	S	*	*			trans	-48.4	133.3	170.3	48.4	0	0	0	0	111.9	H30 G34	H30-S32 PolarHBondContact O-N 3.12Å; S32-G34 PolarHBondContact O-N 3.3Å
33	V	36.9	Very low	32.8	Very low	84 Å²	84	118.8 Å²	118.8	51%	0.509	63%	0.633	S	S	.	*			trans	-54.3	103.5	173.4	-178.6	0	0	0	0	110	I387 V396	V33-I387 HydrophobicContact CG1-CD1 4.07Å; V33-V396 HydrophobicContact CG1-CG1 3.75Å
34	G	33.7	Very low	34.8	Very low	44 Å²	44	116.7 Å²	116.7	45%	0.454	61%	0.614	S	S	.	*			trans	-115.5	147	175.6	0	0	0	0	0	111.5	S32	S32-G34 PolarHBondContact O-N 3.3Å
35	P	33.2	Very low	37.4	Very low	87 Å²	87	112 Å²	112	57%	0.565	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-75.1	133.9	-179.1	30.3	-32.6	0	0	0	111.4	S397	P35-S397 VanDerWaalsContact CB-OG 3.31Å; P35-S397 WeakPolarHBondContact CB-OG 3.37Å
36	I	36.2	Very low	40.3	Very low	51 Å²	51	108.2 Å²	108.2	26%	0.262	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-93.7	146.5	-173.4	-59.4	122.2	0	0	0	113	E40 E44 K364	I36-E40 HydrophobicContact CG2-CB 4.11Å; I36-E40 WeakPolarHBondContact CG2-OE2 3.15Å; I36-E44 WeakPolarHBondContact CD1-OE1 3.16Å; I36-E44 VanDerWaalsContact CG1-OE1 3.26Å; I36-E44 WeakPolarHBondContact CG1-OE1 3.16Å; I36-E44 WeakPolarHBondContact CG2-OE1 3.4Å; I36-K364 PolarHBondContact O-NZ 3.14Å; I36-K364 VanDerWaalsContact O-NZ 3.14Å
37	S	29	Very low	43.2	Very low	73 Å²	73	104.3 Å²	104.3	51%	0.51	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-86.4	149.2	179.5	74.1	0	0	0	0	113.7	S39 E40	S37-S39 VanDerWaalsContact C-N 3.3Å; S37-S39 PolarHBondContact O-N 3.1Å; S37-E40 PolarHBondContact O-N 2.78Å
38	C	28.2	Very low	46.3	Very low	79 Å²	79	97.3 Å²	97.3	53%	0.534	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-4.8	-164.2	-76.6	0	0	0	0	118.2	E41	C38-E41 WeakPolarHBondContact CA-OE1 3.38Å; C38-E41 WeakPolarHBondContact CB-OE1 3.37Å; C38-E41 WeakPolarHBondContact O-CG 3.32Å; C38-E41 PolarHBondContact SG-OE1 2.85Å
39	S	30.6	Very low	49.4	Very low	110 Å²	110	87.2 Å²	87.2	77%	0.769	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.3	177.7	54.2	0	0	0	0	114.3	S37	S37-S39 VanDerWaalsContact C-N 3.3Å; S37-S39 PolarHBondContact O-N 3.1Å
40	E	45.5	Very low	52.6	Low	98 Å²	98	76.9 Å²	76.9	46%	0.458	45%	0.451	S	S	.	.	S	Bend	trans	-97.7	-4	-176.4	-67.4	-177.1	141.2	0	0	113.4	I36 S37 A42 K43 E44	I36-E40 HydrophobicContact CG2-CB 4.11Å; I36-E40 WeakPolarHBondContact CG2-OE2 3.15Å; S37-E40 PolarHBondContact O-N 2.78Å; E40-A42 PolarHBondContact O-N 2.91Å; E40-K43 PolarHBondContact O-N 3.02Å; E40-E44 HydrophobicContact CB-CG 4.35Å; E40-E44 PolarHBondContact O-N 3.16Å
41	E	48.8	Very low	55.8	Low	81 Å²	81	69 Å²	69	38%	0.379	41%	0.414	S	S	.	.	H	α-helix	trans	-52.5	-44.6	-168.5	-68	177	-179.1	0	0	114.5	C38 L45	C38-E41 WeakPolarHBondContact CA-OE1 3.38Å; C38-E41 WeakPolarHBondContact CB-OE1 3.37Å; C38-E41 WeakPolarHBondContact O-CG 3.32Å; C38-E41 PolarHBondContact SG-OE1 2.85Å; E41-L45 VanDerWaalsContact O-CG 3.28Å; E41-L45 WeakPolarHBondContact O-CG 3.34Å; E41-L45 PolarHBondContact O-N 2.87Å
42	A	48.6	Very low	58.8	Low	71 Å²	71	65 Å²	65	59%	0.587	38%	0.381	S	S	*	.	H	α-helix	trans	-74	-30.2	-178.6	0	0	0	0	0	113	E40	E40-A42 PolarHBondContact O-N 2.91Å
43	K	54.4	Low	61.7	Low	154 Å²	154	59.7 Å²	59.7	67%	0.67	34%	0.344	S	S	*	.	H	α-helix	trans	-72.4	-43.3	177.3	-72.6	-176.2	178.9	178.8	0	109.9	E40 L45 N46 F47	E40-K43 PolarHBondContact O-N 3.02Å; K43-L45 PolarHBondContact O-N 3.32Å; K43-N46 PolarHBondContact O-N 3.17Å; K43-F47 WeakPolarHBondContact O-CD2 3.23Å; K43-F47 WeakPolarHBondContact O-CE2 3.17Å
44	E	67.9	Low	64.1	Low	70 Å²	70	55.7 Å²	55.7	33%	0.327	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-37.3	-179.2	-66.3	-166.3	142.4	0	0	113.4	I36 E40 N46 F47 L48	I36-E44 WeakPolarHBondContact CD1-OE1 3.16Å; I36-E44 VanDerWaalsContact CG1-OE1 3.26Å; I36-E44 WeakPolarHBondContact CG1-OE1 3.16Å; I36-E44 WeakPolarHBondContact CG2-OE1 3.4Å; E40-E44 HydrophobicContact CB-CG 4.35Å; E40-E44 PolarHBondContact O-N 3.16Å; E44-N46 VanDerWaalsContact C-N 3.27Å; E44-N46 PolarHBondContact O-N 2.77Å; E44-F47 PolarHBondContact O-N 2.88Å; E44-L48 PolarHBondContact O-N 2.9Å
45	L	79.5	Confident	66.6	Low	31 Å²	31	53.7 Å²	53.7	16%	0.162	30%	0.299	C	S	.	.	H	α-helix	trans	-59.1	-37.9	177.7	-77.1	170.4	0	0	0	112.6	E41 K43 F47 L48 S323 P324 V325 P401	E41-L45 VanDerWaalsContact O-CG 3.28Å; E41-L45 WeakPolarHBondContact O-CG 3.34Å; E41-L45 PolarHBondContact O-N 2.87Å; K43-L45 PolarHBondContact O-N 3.32Å; L45-F47 PolarHBondContact O-N 3.29Å; L45-L48 PolarHBondContact O-N 2.95Å; L45-S323 WeakPolarHBondContact O-CB 3.3Å; L45-P324 HydrophobicContact CD2-CB 4.24Å; L45-P324 HydrophobicContact CD2-CG 4.45Å; L45-V325 HydrophobicContact CB-CG2 3.57Å; L45-V325 HydrophobicContact CD1-CG2 4.46Å; L45-P401 HydrophobicContact CD1-CG 4.09Å; L45-P401 HydrophobicContact CD2-CB 4.11Å; L45-P401 HydrophobicContact CD2-CG 4.07Å; L45-P401 WeakPolarHBondContact CD2-O 3.34Å; L45-P401 HydrophobicContact CG-CG 4.34Å
46	N	83.1	Confident	68.8	Low	84 Å²	84	51.5 Å²	51.5	45%	0.449	28%	0.281	S	S	.	.	H	α-helix	trans	-68.2	-24.9	178.3	-74.3	-23.1	0	0	0	113	K43 E44 R49 V325	K43-N46 PolarHBondContact O-N 3.17Å; E44-N46 VanDerWaalsContact C-N 3.27Å; E44-N46 PolarHBondContact O-N 2.77Å; N46-R49 PolarHBondContact O-NH1 3.46Å; N46-V325 WeakPolarHBondContact OD1-CG2 3.44Å
47	F	86.4	Confident	70.8	Confident	102 Å²	102	51 Å²	51	45%	0.447	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	7.2	179.2	-64.5	-66.3	0	0	0	112.9	K43 E44 L45 N113 R114	K43-F47 WeakPolarHBondContact O-CD2 3.23Å; K43-F47 WeakPolarHBondContact O-CE2 3.17Å; E44-F47 PolarHBondContact O-N 2.88Å; L45-F47 PolarHBondContact O-N 3.29Å; F47-N113 WeakPolarHBondContact CA-OD1 3.41Å; F47-N113 WeakPolarHBondContact CD1-OD1 3.43Å; F47-N113 CarbonylContact O-C 3.51Å; F47-N113 WeakPolarHBondContact O-CA 3.41Å; F47-N113 VanDerWaalsContact O-CB 3.24Å; F47-N113 WeakPolarHBondContact O-CB 3.46Å; F47-N113 PolarHBondContact O-OD1 2.82Å; F47-R114 PolarHBondContact O-N 3.11Å
48	L	90.2	Very high	73.2	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	138.3	179.7	-163.3	147.8	0	0	0	110.6	E44 L45 N50 R114 S323 P324 G402 Q403	E44-L48 PolarHBondContact O-N 2.9Å; L45-L48 PolarHBondContact O-N 2.95Å; L48-N50 WeakPolarHBondContact CD2-ND2 3.49Å; L48-N50 WeakPolarHBondContact CD2-OD1 3.41Å; L48-R114 CarbonylContact C-O 3.56Å; L48-R114 WeakPolarHBondContact CA-O 3.37Å; L48-R114 HydrophobicContact CG-CB 4.5Å; L48-S323 WeakPolarHBondContact O-CA 3.45Å; L48-P324 HydrophobicContact CB-CG 4.2Å; L48-P324 HydrophobicContact CD2-CG 3.5Å; L48-P324 HydrophobicContact CG-CG 4.44Å; L48-P324 WeakPolarHBondContact O-CD 3.42Å; L48-G402 WeakPolarHBondContact CD1-O 3.41Å; L48-G402 WeakPolarHBondContact CD2-O 3.19Å; L48-Q403 HydrophobicContact CD1-CG 3.88Å
49	R	92.2	Very high	75.8	Confident	26 Å²	26	49.6 Å²	49.6	10%	0.098	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.9	174.9	-63.2	-64.2	177.1	-80.7	-2.6	109.5	N46 V51 R114 I115 N116 I317 C318 L321 P322	N46-R49 PolarHBondContact O-NH1 3.46Å; R49-V51 HydrophobicContact CB-CG2 4.21Å; R49-R114 PolarHBondContact N-O 3.33Å; R49-I115 HydrophobicContact CB-CG1 4.39Å; R49-I115 WeakPolarHBondContact O-CA 3.41Å; R49-N116 PolarHBondContact O-N 2.97Å; R49-I317 HydrophobicContact CB-CG2 4.31Å; R49-I317 HydrophobicContact CG-CG2 4.4Å; R49-C318 PolarHBondContact NE-O 3.35Å; R49-C318 PolarHBondContact NH2-O 3.41Å; R49-L321 VanDerWaalsContact CD-O 3.32Å; R49-L321 WeakPolarHBondContact CD-O 3.1Å; R49-L321 PolarHBondContact NE-O 3.33Å; R49-P322 VanDerWaalsContact CD-O 3.29Å; R49-P322 WeakPolarHBondContact CD-O 3.44Å
50	N	92.8	Very high	78.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	116.9	172.2	-53.8	-80.1	0	0	0	108.3	L48 N116 V137 D138 G139 R359 G402 I404	L48-N50 WeakPolarHBondContact CD2-ND2 3.49Å; L48-N50 WeakPolarHBondContact CD2-OD1 3.41Å; N50-N116 WeakPolarHBondContact CA-O 3.36Å; N50-N116 WeakPolarHBondContact OD1-CB 3.09Å; N50-N116 PolarHBondContact OD1-ND2 2.84Å; N50-V137 HydrophobicContact CB-CB 4.33Å; N50-V137 HydrophobicContact CB-CG1 4.45Å; N50-D138 PolarHBondContact ND2-OD2 3.31Å; N50-D138 PolarHBondContact O-N 2.82Å; N50-G139 PolarHBondContact O-N 3.42Å; N50-R359 VanDerWaalsContact ND2-CZ 3.29Å; N50-R359 PolarHBondContact ND2-NH1 3.14Å; N50-R359 PolarHBondContact ND2-NH2 3.28Å; N50-R359 PolarHBondContact OD1-NH1 2.95Å; N50-G402 PolarHBondContact ND2-O 3.06Å; N50-G402 PolarHBondContact OD1-O 3.44Å; N50-I404 HydrophobicContact CB-CD1 4.42Å
51	V	93.6	Very high	80.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.8	-167.8	-174.5	0	0	0	0	109.3	R49 N116 L117 I118 G139 L141 I317 L321	R49-V51 HydrophobicContact CB-CG2 4.21Å; V51-N116 PolarHBondContact N-O 2.68Å; V51-L117 HydrophobicContact CB-CD1 3.95Å; V51-L117 HydrophobicContact CG1-CD1 4.04Å; V51-L117 CarbonylContact O-C 3.59Å; V51-L117 WeakPolarHBondContact O-CA 3.4Å; V51-I118 PolarHBondContact O-N 3.29Å; V51-G139 WeakPolarHBondContact CA-O 3.44Å; V51-L141 HydrophobicContact CG1-CB 3.79Å; V51-I317 HydrophobicContact CG2-CG2 3.93Å; V51-L321 HydrophobicContact CB-CD1 4.38Å; V51-L321 HydrophobicContact CG1-CD1 3.78Å; V51-L321 HydrophobicContact CG2-CD1 3.63Å
52	A	92.7	Very high	82.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	140.1	167.4	0	0	0	0	0	110.3	I118 T120 L134 V137 G139 A140 L141	A52-I118 CarbonylContact C-O 3.5Å; A52-I118 WeakPolarHBondContact CA-O 3.37Å; A52-T120 HydrophobicContact CB-CG2 4.02Å; A52-L134 HydrophobicContact CB-CD2 3.84Å; A52-V137 HydrophobicContact CB-CB 4.28Å; A52-V137 HydrophobicContact CB-CG1 3.97Å; A52-V137 HydrophobicContact CB-CG2 3.63Å; A52-G139 PolarHBondContact N-O 3.44Å; A52-G139 VanDerWaalsContact N-O 3.07Å; A52-A140 CarbonylContact O-C 3.51Å; A52-A140 WeakPolarHBondContact O-CA 2.98Å; A52-L141 PolarHBondContact O-N 2.95Å
53	L	91.5	Very high	83.9	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131.2	169.5	-64.4	-173.2	0	0	0	110.6	K61 T65 L117 I118 D119 T120 L141 I143	L53-K61 HydrophobicContact CB-CD 4.2Å; L53-K61 HydrophobicContact CD1-CB 4.45Å; L53-T65 WeakPolarHBondContact CD1-OG1 3.4Å; L53-L117 HydrophobicContact CD1-CD2 4.1Å; L53-L117 HydrophobicContact CD1-CG 4.43Å; L53-L117 HydrophobicContact CD2-CD1 3.72Å; L53-L117 HydrophobicContact CD2-CG 4.46Å; L53-L117 HydrophobicContact CG-CD1 3.86Å; L53-L117 HydrophobicContact CG-CD2 4.29Å; L53-L117 HydrophobicContact CG-CG 4.14Å; L53-I118 PolarHBondContact N-O 3.07Å; L53-D119 HydrophobicContact CD1-CB 4.48Å; L53-T120 PolarHBondContact O-OG1 3.4Å; L53-L141 CarbonylContact C-O 3.5Å; L53-L141 WeakPolarHBondContact CA-O 3.14Å; L53-L141 HydrophobicContact CD2-CB 3.82Å; L53-L141 HydrophobicContact CD2-CD2 3.55Å; L53-L141 HydrophobicContact CD2-CG 3.84Å; L53-I143 HydrophobicContact CD1-CD1 4.33Å; L53-I143 HydrophobicContact CD2-CD1 4.03Å
54	I	89.3	Confident	85.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.3	175.8	-61	175.1	0	0	0	108	L134 A140 L141 I142 I143 T154 V157 A161	I54-L134 HydrophobicContact CD1-CD2 3.91Å; I54-L134 HydrophobicContact CG1-CD2 4.19Å; I54-A140 HydrophobicContact CD1-CB 3.63Å; I54-A140 HydrophobicContact CG1-CB 4.3Å; I54-L141 PolarHBondContact N-O 3.08Å; I54-I142 HydrophobicContact CB-CG1 4.36Å; I54-I142 CarbonylContact O-C 3.41Å; I54-I142 VanDerWaalsContact O-CA 3.28Å; I54-I142 WeakPolarHBondContact O-CA 3.43Å; I54-I143 PolarHBondContact O-N 2.91Å; I54-T154 HydrophobicContact CG2-CG2 4.28Å; I54-V157 HydrophobicContact CB-CG1 4.06Å; I54-V157 HydrophobicContact CD1-CG1 3.97Å; I54-V157 HydrophobicContact CG1-CG1 3.69Å; I54-V157 HydrophobicContact CG2-CB 3.72Å; I54-V157 HydrophobicContact CG2-CG1 3.42Å; I54-V157 VanDerWaalsContact CG2-CG1 3.42Å; I54-A161 HydrophobicContact CD1-CB 3.75Å
55	A	85.8	Confident	86.8	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.008	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	171.5	172.5	0	0	0	0	0	111.7	A59 K61 I143	A55-A59 HydrophobicContact CB-CB 3.72Å; A55-K61 VanDerWaalsContact C-NZ 3.26Å; A55-K61 HydrophobicContact CB-CD 3.44Å; A55-K61 VanDerWaalsContact CB-CD 3.44Å; A55-K61 HydrophobicContact CB-CG 3.22Å; A55-K61 PolarHBondContact O-NZ 3.05Å; A55-I143 HydrophobicContact CB-CB 3.92Å; A55-I143 WeakPolarHBondContact CB-O 3.42Å
56	H	79.5	Confident	87.2	Confident	41 Å²	41	24 Å²	24	19%	0.19	12%	0.124	C	C	.	.			trans	-69.6	170	164.7	-164.9	48.4	0	0	0	112.4	A59 K61 E151 Q153 T154	H56-A59 HydrophobicContact CB-CB 4.38Å; H56-K61 PolarHBondContact O-NZ 2.81Å; H56-E151 HydrophobicContact CB-CB 4.14Å; H56-E151 WeakPolarHBondContact CB-OE2 3.4Å; H56-E151 IonicContact CD2-OE1 2.71Å; H56-E151 PolarHBondContact CD2-OE1 3.18Å; H56-E151 IonicContact CD2-OE2 3.09Å; H56-E151 PolarHBondContact CD2-OE2 2.86Å; H56-E151 IonicContact CG-OE1 3.29Å; H56-E151 IonicContact CG-OE2 3.2Å; H56-E151 VanDerWaalsContact CG-OE2 3.22Å; H56-E151 IonicContact NE2-OE1 3.27Å; H56-Q153 PolarHBondContact CE1-OE1 3.35Å; H56-Q153 WeakPolarHBondContact ND1-CB 3.4Å; H56-Q153 PolarHBondContact ND1-OE1 3.39Å; H56-T154 PolarHBondContact N-OG1 3.32Å
57	I	76.8	Confident	87.5	Confident	41 Å²	41	21.5 Å²	21.5	21%	0.21	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	143.3	165.7	-59.7	163.2	0	0	0	107.6	A59 I99	I57-A59 PolarHBondContact O-N 2.64Å; I57-I99 HydrophobicContact CD1-CG2 4.49Å; I57-I99 HydrophobicContact CG1-CG2 4.47Å; I57-I99 HydrophobicContact CG2-CG2 4.07Å
58	D	79.2	Confident	87.7	Confident	122 Å²	122	16.6 Å²	16.6	65%	0.652	9%	0.087	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	0.2	-177.9	-61.6	-24.8	0	0	0	117.6	G60 K174	D58-G60 PolarHBondContact O-N 3.45Å; D58-K174 WeakPolarHBondContact O-CE 3.36Å; D58-K174 PolarHBondContact O-NZ 2.84Å
59	A	84.6	Confident	87.6	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.008	9%	0.085	C	C	.	.	S	Bend	trans	-62	-14.8	173.5	0	0	0	0	0	113.2	A55 H56 I57 I143 N173	A55-A59 HydrophobicContact CB-CB 3.72Å; H56-A59 HydrophobicContact CB-CB 4.38Å; I57-A59 PolarHBondContact O-N 2.64Å; A59-I143 HydrophobicContact CB-CG2 4.41Å; A59-N173 PolarHBondContact O-ND2 3.32Å
60	G	84	Confident	87.4	Confident	11 Å²	11	18 Å²	18	11%	0.113	9%	0.092	C	C	.	.			trans	93.2	36.5	176.9	0	0	0	0	0	114	D58 T64	D58-G60 PolarHBondContact O-N 3.45Å; G60-T64 VanDerWaalsContact O-CB 3.32Å; G60-T64 WeakPolarHBondContact O-CB 3.4Å; G60-T64 PolarHBondContact O-N 2.87Å; G60-T64 PolarHBondContact O-OG1 3.05Å
61	K	87.2	Confident	87.1	Confident	12 Å²	12	18.8 Å²	18.8	5%	0.052	10%	0.099	C	C	.	.	H	α-helix	trans	-55.8	-62.8	174.2	-73.9	-169.7	-70.1	-79.1	0	111.7	L53 A55 H56 T63 T64 T65 T120 I143	L53-K61 HydrophobicContact CB-CD 4.2Å; L53-K61 HydrophobicContact CD1-CB 4.45Å; A55-K61 VanDerWaalsContact C-NZ 3.26Å; A55-K61 HydrophobicContact CB-CD 3.44Å; A55-K61 VanDerWaalsContact CB-CD 3.44Å; A55-K61 HydrophobicContact CB-CG 3.22Å; A55-K61 PolarHBondContact O-NZ 3.05Å; H56-K61 PolarHBondContact O-NZ 2.81Å; K61-T63 VanDerWaalsContact C-N 3.29Å; K61-T63 PolarHBondContact O-N 3.27Å; K61-T64 WeakPolarHBondContact O-CA 3.47Å; K61-T64 WeakPolarHBondContact O-CB 3.24Å; K61-T64 PolarHBondContact O-N 2.97Å; K61-T65 PolarHBondContact O-N 3.39Å; K61-T65 PolarHBondContact O-OG1 2.97Å; K61-T120 VanDerWaalsContact CE-O 3.25Å; K61-T120 WeakPolarHBondContact CE-O 3.35Å; K61-I143 HydrophobicContact CB-CD1 4.48Å; K61-I143 HydrophobicContact CG-CD1 4.18Å
62	T	84.5	Confident	86.7	Confident	14 Å²	14	20 Å²	20	9%	0.086	11%	0.107	C	C	.	.	H	α-helix	trans	-55.4	-46	-179.3	-40.9	0	0	0	0	111.1	T64 T65 E66 V81 T86 C88 D89	T62-T64 VanDerWaalsContact C-N 3.3Å; T62-T64 PolarHBondContact O-N 2.89Å; T62-T65 WeakPolarHBondContact O-CB 3.36Å; T62-T65 PolarHBondContact O-N 2.78Å; T62-T65 VanDerWaalsContact O-N 3.14Å; T62-E66 WeakPolarHBondContact O-CG 3.3Å; T62-E66 PolarHBondContact O-N 2.89Å; T62-V81 HydrophobicContact CG2-CG2 4.28Å; T62-T86 HydrophobicContact CG2-CG2 3.96Å; T62-C88 HydrophobicContact CG2-CB 4.27Å; T62-D89 WeakPolarHBondContact CG2-OD2 3.37Å; T62-D89 PolarHBondContact OG1-OD2 2.8Å; T62-D89 VanDerWaalsContact OG1-OD2 3.12Å
63	T	87.9	Confident	86.2	Confident	38 Å²	38	22.4 Å²	22.4	23%	0.233	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-41.2	177.5	-44.7	0	0	0	0	112.2	K61 E66 R67 A304	K61-T63 VanDerWaalsContact C-N 3.29Å; K61-T63 PolarHBondContact O-N 3.27Å; T63-E66 PolarHBondContact O-N 2.83Å; T63-R67 VanDerWaalsContact O-CG 3.3Å; T63-R67 WeakPolarHBondContact O-CG 3.23Å; T63-R67 PolarHBondContact O-N 2.87Å; T63-R67 VanDerWaalsContact O-N 3.07Å; T63-A304 HydrophobicContact CG2-CB 4.2Å
64	T	91.4	Very high	85.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.4	-42.1	177.2	-57.5	0	0	0	0	110.8	G60 K61 T62 R67 M68 I143 F171 A304 L313	G60-T64 VanDerWaalsContact O-CB 3.32Å; G60-T64 WeakPolarHBondContact O-CB 3.4Å; G60-T64 PolarHBondContact O-N 2.87Å; G60-T64 PolarHBondContact O-OG1 3.05Å; K61-T64 WeakPolarHBondContact O-CA 3.47Å; K61-T64 WeakPolarHBondContact O-CB 3.24Å; K61-T64 PolarHBondContact O-N 2.97Å; T62-T64 VanDerWaalsContact C-N 3.3Å; T62-T64 PolarHBondContact O-N 2.89Å; T64-R67 PolarHBondContact O-N 2.93Å; T64-M68 HydrophobicContact CG2-CE 3.76Å; T64-M68 WeakPolarHBondContact O-CG 3.4Å; T64-M68 PolarHBondContact O-N 3.38Å; T64-I143 HydrophobicContact CG2-CD1 3.84Å; T64-F171 HydrophobicContact CG2-CD1 4.28Å; T64-F171 HydrophobicContact CG2-CE1 4.27Å; T64-A304 WeakPolarHBondContact OG1-CB 3.44Å; T64-L313 HydrophobicContact CG2-CD2 3.97Å
65	T	89.9	Confident	85.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.6	-50.5	173.8	-51.3	0	0	0	0	111.8	L53 K61 T62 R67 M68 L69 C88 V106 L117 D119	L53-T65 WeakPolarHBondContact CD1-OG1 3.4Å; K61-T65 PolarHBondContact O-N 3.39Å; K61-T65 PolarHBondContact O-OG1 2.97Å; T62-T65 WeakPolarHBondContact O-CB 3.36Å; T62-T65 PolarHBondContact O-N 2.78Å; T62-T65 VanDerWaalsContact O-N 3.14Å; T65-R67 VanDerWaalsContact C-N 3.27Å; T65-R67 PolarHBondContact O-N 3.27Å; T65-M68 WeakPolarHBondContact O-CB 3.34Å; T65-M68 PolarHBondContact O-N 2.99Å; T65-L69 HydrophobicContact CG2-CD1 4.38Å; T65-L69 WeakPolarHBondContact O-CG 3.3Å; T65-L69 PolarHBondContact O-N 3.43Å; T65-C88 WeakPolarHBondContact CG2-SG 3.42Å; T65-V106 HydrophobicContact CG2-CG2 4.1Å; T65-L117 HydrophobicContact CG2-CD2 3.61Å; T65-D119 PolarHBondContact OG1-OD2 3.2Å
66	E	88.8	Confident	84.8	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-40.1	178.5	-69.3	-54.7	131.7	0	0	112	T62 T63 L69 Y70 T86 V87	T62-E66 WeakPolarHBondContact O-CG 3.3Å; T62-E66 PolarHBondContact O-N 2.89Å; T63-E66 PolarHBondContact O-N 2.83Å; E66-L69 PolarHBondContact O-N 3.37Å; E66-Y70 WeakPolarHBondContact O-CB 3.42Å; E66-Y70 PolarHBondContact O-N 3.39Å; E66-T86 HydrophobicContact CG-CG2 3.86Å; E66-V87 WeakPolarHBondContact OE1-CB 3.33Å; E66-V87 PolarHBondContact OE1-N 2.98Å
67	R	89.5	Confident	84.7	Confident	31 Å²	31	39 Å²	39	12%	0.117	22%	0.217	C	C	.	.	H	α-helix	trans	-67.4	-36.5	176.2	-66	-22.3	-168.2	-176.8	4.8	112.6	T63 T64 T65 Y70 A71 M78 A304 Q305 V310	T63-R67 VanDerWaalsContact O-CG 3.3Å; T63-R67 WeakPolarHBondContact O-CG 3.23Å; T63-R67 PolarHBondContact O-N 2.87Å; T63-R67 VanDerWaalsContact O-N 3.07Å; T64-R67 PolarHBondContact O-N 2.93Å; T65-R67 VanDerWaalsContact C-N 3.27Å; T65-R67 PolarHBondContact O-N 3.27Å; R67-Y70 PolarHBondContact O-N 2.89Å; R67-A71 WeakPolarHBondContact O-CB 3.49Å; R67-A71 PolarHBondContact O-N 3.45Å; R67-M78 VanDerWaalsContact CZ-CE 3.48Å; R67-M78 VanDerWaalsContact NH1-CB 3.3Å; R67-M78 PolarHBondContact NH1-SD 3.25Å; R67-A304 WeakPolarHBondContact CD-O 3.46Å; R67-A304 HydrophobicContact CG-CB 4.24Å; R67-A304 WeakPolarHBondContact CG-O 3.39Å; R67-A304 PolarHBondContact NE-O 3.36Å; R67-Q305 PolarHBondContact NH2-O 3.24Å; R67-V310 HydrophobicContact CB-CB 4.42Å; R67-V310 HydrophobicContact CB-CG1 3.91Å; R67-V310 HydrophobicContact CB-CG2 3.85Å; R67-V310 HydrophobicContact CG-CG2 4.37Å
68	M	90.8	Very high	84.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-42.6	173.7	-71.9	177	-178.3	0	0	111.7	T64 T65 Y70 A71 S72 F108 L117 L141 V310 L313 L314 I317	T64-M68 HydrophobicContact CG2-CE 3.76Å; T64-M68 WeakPolarHBondContact O-CG 3.4Å; T64-M68 PolarHBondContact O-N 3.38Å; T65-M68 WeakPolarHBondContact O-CB 3.34Å; T65-M68 PolarHBondContact O-N 2.99Å; M68-Y70 VanDerWaalsContact C-N 3.34Å; M68-Y70 PolarHBondContact O-N 3.34Å; M68-A71 PolarHBondContact O-N 3.04Å; M68-S72 WeakPolarHBondContact O-CB 3.46Å; M68-S72 PolarHBondContact O-N 2.81Å; M68-S72 PolarHBondContact O-OG 3.45Å; M68-S72 VanDerWaalsContact O-OG 3.07Å; M68-F108 HydrophobicContact CB-CE2 4.43Å; M68-F108 HydrophobicContact CB-CZ 3.99Å; M68-F108 HydrophobicContact SD-CZ 4.47Å; M68-L117 HydrophobicContact SD-CD2 4.16Å; M68-L141 HydrophobicContact CE-CD2 3.5Å; M68-L141 VanDerWaalsContact CE-CD2 3.5Å; M68-V310 HydrophobicContact CG-CG1 3.98Å; M68-L313 HydrophobicContact CE-CD2 3.24Å; M68-L313 HydrophobicContact CE-CG 3.69Å; M68-L314 HydrophobicContact CB-CD2 3.96Å; M68-L314 HydrophobicContact CG-CD2 3.74Å; M68-L314 HydrophobicContact CG-CG 4.15Å; M68-L314 HydrophobicContact SD-CD2 4.11Å; M68-I317 HydrophobicContact CE-CD1 3.87Å; M68-I317 HydrophobicContact SD-CD1 4.38Å
69	L	88.8	Confident	84.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-40.9	176.9	-67.1	179.7	0	0	0	112	T65 E66 S72 T74 T75 V87 V106 F108 F389	T65-L69 HydrophobicContact CG2-CD1 4.38Å; T65-L69 WeakPolarHBondContact O-CG 3.3Å; T65-L69 PolarHBondContact O-N 3.43Å; E66-L69 PolarHBondContact O-N 3.37Å; L69-S72 PolarHBondContact O-OG 3.49Å; L69-T74 PolarHBondContact O-N 2.93Å; L69-T74 VanDerWaalsContact O-N 3.13Å; L69-T75 VanDerWaalsContact C-OG1 3.27Å; L69-T75 HydrophobicContact CB-CG2 4.06Å; L69-T75 PolarHBondContact O-N 3.22Å; L69-T75 PolarHBondContact O-OG1 3.39Å; L69-V87 HydrophobicContact CD1-CB 3.89Å; L69-V87 HydrophobicContact CD1-CG1 4.08Å; L69-V87 HydrophobicContact CD1-CG2 4.04Å; L69-V106 HydrophobicContact CD1-CG1 4.46Å; L69-V106 HydrophobicContact CD2-CB 4.29Å; L69-V106 HydrophobicContact CD2-CG2 4.2Å; L69-F108 HydrophobicContact CD2-CB 4.26Å; L69-F108 HydrophobicContact CD2-CD1 3.47Å; L69-F108 VanDerWaalsContact CD2-CD1 3.47Å; L69-F108 HydrophobicContact CD2-CE1 3.99Å; L69-F108 HydrophobicContact CD2-CG 4Å; L69-F389 HydrophobicContact CD1-CZ 4.43Å; L69-F389 HydrophobicContact CD2-CE2 3.73Å; L69-F389 HydrophobicContact CD2-CZ 4.08Å
70	Y	87.2	Confident	83.6	Confident	64 Å²	64	36.2 Å²	36.2	25%	0.251	20%	0.203	S	C	.	.	H	α-helix	trans	-68.8	-46.6	175	178.9	-111.1	0	0	0	111.9	E66 R67 M68 S72 G73 T75 K76 M78 E232	E66-Y70 WeakPolarHBondContact O-CB 3.42Å; E66-Y70 PolarHBondContact O-N 3.39Å; R67-Y70 PolarHBondContact O-N 2.89Å; M68-Y70 VanDerWaalsContact C-N 3.34Å; M68-Y70 PolarHBondContact O-N 3.34Å; Y70-S72 VanDerWaalsContact C-N 3.33Å; Y70-S72 PolarHBondContact O-N 2.88Å; Y70-G73 WeakPolarHBondContact O-CA 3.5Å; Y70-G73 PolarHBondContact O-N 3.36Å; Y70-T75 WeakPolarHBondContact CA-OG1 3.31Å; Y70-T75 PolarHBondContact N-OG1 3.13Å; Y70-K76 WeakPolarHBondContact CE2-O 3.49Å; Y70-M78 HydrophobicContact CD1-CE 3.69Å; Y70-M78 HydrophobicContact CD1-CG 3.64Å; Y70-M78 HydrophobicContact CD1-SD 4.31Å; Y70-M78 HydrophobicContact CD2-CG 3.77Å; Y70-M78 HydrophobicContact CE1-CE 3.7Å; Y70-M78 HydrophobicContact CE1-CG 3.78Å; Y70-M78 HydrophobicContact CE1-SD 4.1Å; Y70-M78 HydrophobicContact CE2-CG 3.93Å; Y70-M78 HydrophobicContact CG-CG 3.61Å; Y70-E232 PolarHBondContact OH-OE2 3.33Å
71	A	86.1	Confident	82.9	Confident	17 Å²	17	38.2 Å²	38.2	14%	0.14	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-37.4	-179.4	0	0	0	0	0	112.4	R67 M68 G73 W110 V310 L314	R67-A71 WeakPolarHBondContact O-CB 3.49Å; R67-A71 PolarHBondContact O-N 3.45Å; M68-A71 PolarHBondContact O-N 3.04Å; A71-G73 PolarHBondContact O-N 2.85Å; A71-W110 WeakPolarHBondContact O-CZ3 3.21Å; A71-V310 HydrophobicContact CB-CG1 4.29Å; A71-L314 HydrophobicContact CB-CD1 3.91Å
72	S	85.8	Confident	82.1	Confident	24 Å²	24	44.6 Å²	44.6	17%	0.168	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.3	172.9	64.2	0	0	0	0	113.8	M68 L69 Y70 T74	M68-S72 WeakPolarHBondContact O-CB 3.46Å; M68-S72 PolarHBondContact O-N 2.81Å; M68-S72 PolarHBondContact O-OG 3.45Å; M68-S72 VanDerWaalsContact O-OG 3.07Å; L69-S72 PolarHBondContact O-OG 3.49Å; Y70-S72 VanDerWaalsContact C-N 3.33Å; Y70-S72 PolarHBondContact O-N 2.88Å; S72-T74 PolarHBondContact OG-OG1 2.8Å
73	G	82.8	Confident	81.2	Confident	52 Å²	52	50.5 Å²	50.5	54%	0.536	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	11.3	-175.2	0	0	0	0	0	113.6	Y70 A71	Y70-G73 WeakPolarHBondContact O-CA 3.5Å; Y70-G73 PolarHBondContact O-N 3.36Å; A71-G73 PolarHBondContact O-N 2.85Å
74	T	81.1	Confident	80.2	Confident	62 Å²	62	49.4 Å²	49.4	38%	0.38	27%	0.27	S	S	.	.	S	Bend	trans	-73.6	-42.3	178.9	-48.7	0	0	0	0	110.6	L69 S72 F108 F389	L69-T74 PolarHBondContact O-N 2.93Å; L69-T74 VanDerWaalsContact O-N 3.13Å; S72-T74 PolarHBondContact OG-OG1 2.8Å; T74-F108 HydrophobicContact CG2-CB 4.31Å; T74-F108 WeakPolarHBondContact OG1-CB 3.42Å; T74-F389 HydrophobicContact CG2-CD2 4.2Å; T74-F389 HydrophobicContact CG2-CE1 4.36Å; T74-F389 HydrophobicContact CG2-CE2 3.28Å; T74-F389 HydrophobicContact CG2-CZ 3.39Å
75	T	79.9	Confident	79.4	Confident	21 Å²	21	52.9 Å²	52.9	13%	0.129	29%	0.292	C	S	.	.			trans	-98.4	139.1	167.3	56.3	0	0	0	0	110.3	L69 Y70 N77 V87 F389	L69-T75 VanDerWaalsContact C-OG1 3.27Å; L69-T75 HydrophobicContact CB-CG2 4.06Å; L69-T75 PolarHBondContact O-N 3.22Å; L69-T75 PolarHBondContact O-OG1 3.39Å; Y70-T75 WeakPolarHBondContact CA-OG1 3.31Å; Y70-T75 PolarHBondContact N-OG1 3.13Å; T75-N77 PolarHBondContact OG1-O 3.04Å; T75-V87 HydrophobicContact CG2-CG2 4.13Å; T75-F389 HydrophobicContact CG2-CE1 4.21Å; T75-F389 HydrophobicContact CG2-CZ 3.92Å
76	K	75.7	Confident	78.6	Confident	175 Å²	175	53.3 Å²	53.3	76%	0.761	29%	0.294	S	S	*	.	S	Bend	trans	-81.1	-28.8	175.3	-67.8	-176.6	-179.2	177.7	0	112.6	Y70	Y70-K76 WeakPolarHBondContact CE2-O 3.49Å
77	N	76.5	Confident	77.7	Confident	133 Å²	133	54.7 Å²	54.7	71%	0.711	30%	0.303	S	S	*	.	S	Bend	trans	-112.9	144.5	-177	-61	-12.8	0	0	0	108.6	T75 G79	T75-N77 PolarHBondContact OG1-O 3.04Å; N77-G79 PolarHBondContact O-N 2.98Å
78	M	73.6	Confident	76.9	Confident	43 Å²	43	53.2 Å²	53.2	21%	0.212	30%	0.297	C	S	.	.			trans	-72.6	117.9	170.8	-80.5	-175.8	138	0	0	110.1	R67 Y70 E232 N307	R67-M78 VanDerWaalsContact CZ-CE 3.48Å; R67-M78 VanDerWaalsContact NH1-CB 3.3Å; R67-M78 PolarHBondContact NH1-SD 3.25Å; Y70-M78 HydrophobicContact CD1-CE 3.69Å; Y70-M78 HydrophobicContact CD1-CG 3.64Å; Y70-M78 HydrophobicContact CD1-SD 4.31Å; Y70-M78 HydrophobicContact CD2-CG 3.77Å; Y70-M78 HydrophobicContact CE1-CE 3.7Å; Y70-M78 HydrophobicContact CE1-CG 3.78Å; Y70-M78 HydrophobicContact CE1-SD 4.1Å; Y70-M78 HydrophobicContact CE2-CG 3.93Å; Y70-M78 HydrophobicContact CG-CG 3.61Å; M78-E232 HydrophobicContact SD-CG 4.42Å; M78-E232 VanDerWaalsContact SD-OE1 3.33Å; M78-N307 HydrophobicContact CE-CB 3.78Å
79	G	70.8	Confident	76	Confident	6 Å²	6	53.5 Å²	53.5	6%	0.062	30%	0.298	C	S	.	.			trans	-68.9	142.8	167.8	0	0	0	0	0	110.9	N77	N77-G79 PolarHBondContact O-N 2.98Å
80	N	74.1	Confident	75.2	Confident	56 Å²	56	55.7 Å²	55.7	30%	0.299	31%	0.308	S	S	.	.			trans	-124.3	133.1	174.4	-170.1	-0.7	0	0	0	109.7	D82 E83 G84 T85	N80-D82 PolarHBondContact OD1-N 2.92Å; N80-E83 HydrophobicContact CB-CB 4.18Å; N80-E83 HydrophobicContact CB-CG 4.15Å; N80-E83 PolarHBondContact O-N 3.46Å; N80-G84 PolarHBondContact O-N 2.93Å; N80-T85 PolarHBondContact N-OG1 3.28Å; N80-T85 PolarHBondContact O-N 3.42Å; N80-T85 VanDerWaalsContact O-N 3.07Å; N80-T85 PolarHBondContact O-OG1 3.05Å
81	V	69.1	Low	74.5	Confident	52 Å²	52	53.8 Å²	53.8	32%	0.315	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-43.6	179.5	-178	0	0	0	0	109.8	T62 E83 G84 T86	T62-V81 HydrophobicContact CG2-CG2 4.28Å; V81-E83 PolarHBondContact O-N 3.09Å; V81-G84 PolarHBondContact O-N 2.97Å; V81-T86 HydrophobicContact CB-CG2 4.33Å; V81-T86 HydrophobicContact CG2-CG2 3.86Å
82	D	69.2	Low	73.8	Confident	146 Å²	146	56.4 Å²	56.4	78%	0.781	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-29.4	-177.6	-59.7	-31.5	0	0	0	112.7	N80	N80-D82 PolarHBondContact OD1-N 2.92Å
83	E	67.3	Low	73.3	Confident	139 Å²	139	55.6 Å²	55.6	65%	0.65	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.3	177.3	-62.6	176.3	-171.2	0	0	112.4	N80 V81 T85	N80-E83 HydrophobicContact CB-CB 4.18Å; N80-E83 HydrophobicContact CB-CG 4.15Å; N80-E83 PolarHBondContact O-N 3.46Å; V81-E83 PolarHBondContact O-N 3.09Å; E83-T85 HydrophobicContact CB-CG2 3.92Å; E83-T85 PolarHBondContact O-N 3.06Å
84	G	65.6	Low	72.8	Confident	15 Å²	15	53.1 Å²	53.1	16%	0.155	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	25.8	-174.3	0	0	0	0	0	113.5	N80 V81 T86 R95	N80-G84 PolarHBondContact O-N 2.93Å; V81-G84 PolarHBondContact O-N 2.97Å; G84-T86 VanDerWaalsContact C-N 3.33Å; G84-R95 PolarHBondContact O-NH1 2.95Å; G84-R95 PolarHBondContact O-NH2 2.78Å
85	T	74.4	Confident	72.5	Confident	73 Å²	73	55.6 Å²	55.6	45%	0.448	29%	0.286	S	S	.	.			trans	-94.4	12.1	-177.8	54.6	0	0	0	0	113	N80 E83	N80-T85 PolarHBondContact N-OG1 3.28Å; N80-T85 PolarHBondContact O-N 3.42Å; N80-T85 VanDerWaalsContact O-N 3.07Å; N80-T85 PolarHBondContact O-OG1 3.05Å; E83-T85 HydrophobicContact CB-CG2 3.92Å; E83-T85 PolarHBondContact O-N 3.06Å
86	T	72.8	Confident	72.2	Confident	8 Å²	8	60.4 Å²	60.4	5%	0.049	31%	0.307	C	S	.	.			trans	-73.4	148.8	-178.9	60.4	0	0	0	0	112	T62 E66 V81 G84 D89	T62-T86 HydrophobicContact CG2-CG2 3.96Å; E66-T86 HydrophobicContact CG-CG2 3.86Å; V81-T86 HydrophobicContact CB-CG2 4.33Å; V81-T86 HydrophobicContact CG2-CG2 3.86Å; G84-T86 VanDerWaalsContact C-N 3.33Å; T86-D89 WeakPolarHBondContact OG1-CB 3.42Å
87	V	70.5	Confident	71.9	Confident	32 Å²	32	56.7 Å²	56.7	19%	0.194	29%	0.289	C	S	.	.	S	Bend	trans	-79.3	-32.6	178.1	177.8	0	0	0	0	111.3	E66 L69 T75 V106 F389	E66-V87 WeakPolarHBondContact OE1-CB 3.33Å; E66-V87 PolarHBondContact OE1-N 2.98Å; L69-V87 HydrophobicContact CD1-CB 3.89Å; L69-V87 HydrophobicContact CD1-CG1 4.08Å; L69-V87 HydrophobicContact CD1-CG2 4.04Å; T75-V87 HydrophobicContact CG2-CG2 4.13Å; V87-V106 HydrophobicContact CG1-CG1 4.24Å; V87-F389 HydrophobicContact CG1-CE1 4.34Å
88	C	72.4	Confident	71.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-87	-43.2	-173.4	-59.8	0	0	0	0	113.5	T62 T65 F90 A104 D119	T62-C88 HydrophobicContact CG2-CB 4.27Å; T65-C88 WeakPolarHBondContact CG2-SG 3.42Å; C88-F90 VanDerWaalsContact C-N 3.32Å; C88-F90 VanDerWaalsContact O-CD1 3.26Å; C88-F90 WeakPolarHBondContact O-CD1 3.38Å; C88-F90 PolarHBondContact O-N 3.15Å; C88-A104 HydrophobicContact CB-CB 3.89Å; C88-D119 HydrophobicContact CB-CB 4.49Å
89	D	73	Confident	71	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.027	27%	0.269	C	S	.	.			trans	-86.2	77.7	176.6	-56.6	-32.2	0	0	0	109	T62 T86 E94 R95 T100	T62-D89 WeakPolarHBondContact CG2-OD2 3.37Å; T62-D89 PolarHBondContact OG1-OD2 2.8Å; T62-D89 VanDerWaalsContact OG1-OD2 3.12Å; T86-D89 WeakPolarHBondContact OG1-CB 3.42Å; D89-E94 WeakPolarHBondContact CA-OE2 3.45Å; D89-E94 HydrophobicContact CB-CB 4.01Å; D89-R95 PolarHBondContact O-NE 3.29Å; D89-R95 PolarHBondContact O-NH2 3.07Å; D89-R95 VanDerWaalsContact O-NH2 3.1Å; D89-T100 PolarHBondContact OD1-OG1 3.27Å
90	F	71.6	Confident	70.9	Confident	47 Å²	47	51.5 Å²	51.5	21%	0.206	27%	0.269	C	S	.	.			trans	-90.2	-18.4	-179.2	64.7	-93.4	0	0	0	112.6	C88 E94 M347 H391	C88-F90 VanDerWaalsContact C-N 3.32Å; C88-F90 VanDerWaalsContact O-CD1 3.26Å; C88-F90 WeakPolarHBondContact O-CD1 3.38Å; C88-F90 PolarHBondContact O-N 3.15Å; F90-E94 PolarHBondContact N-OE2 3.48Å; F90-M347 HydrophobicContact CE2-SD 4.43Å; F90-M347 HydrophobicContact CZ-SD 4.1Å; F90-H391 HydrophobicContact CB-CB 4.34Å
91	M	72.5	Confident	70.7	Confident	24 Å²	24	49.4 Å²	49.4	12%	0.118	26%	0.258	C	S	.	.	S	Bend	trans	-76.7	140.2	175.3	-63.9	-174.3	172.7	0	0	110.2	Q93 E94 R95 A102	M91-Q93 PolarHBondContact O-N 2.87Å; M91-E94 HydrophobicContact CB-CB 4.34Å; M91-E94 HydrophobicContact CB-CG 3.84Å; M91-E94 WeakPolarHBondContact CB-OE2 3.47Å; M91-E94 PolarHBondContact N-OE2 3.13Å; M91-E94 PolarHBondContact O-N 3.2Å; M91-R95 PolarHBondContact O-N 2.92Å; M91-A102 HydrophobicContact CE-CB 3.58Å; M91-A102 HydrophobicContact SD-CB 3.97Å
92	V	71.2	Confident	71.1	Confident	71 Å²	71	47.4 Å²	47.4	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-65.3	-34	-179.6	-170.8	0	0	0	0	110.6	E94 R95 E96	V92-E94 VanDerWaalsContact C-N 3.32Å; V92-E94 PolarHBondContact O-N 2.92Å; V92-R95 PolarHBondContact O-N 3.42Å; V92-E96 HydrophobicContact CG1-CG 4.35Å; V92-E96 WeakPolarHBondContact O-CG 3.45Å; V92-E96 PolarHBondContact O-N 3Å
93	Q	75.2	Confident	71.6	Confident	7 Å²	7	40.6 Å²	40.6	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-38.3	177.4	-59.9	90.2	-21.1	0	0	112.5	M91 R95 R97 I101 D512	M91-Q93 PolarHBondContact O-N 2.87Å; Q93-R95 VanDerWaalsContact C-N 3.32Å; Q93-R97 WeakPolarHBondContact O-CB 3.38Å; Q93-R97 WeakPolarHBondContact O-CG 3.4Å; Q93-R97 PolarHBondContact O-N 3.42Å; Q93-I101 HydrophobicContact CB-CD1 3.65Å; Q93-D512 WeakPolarHBondContact CG-OD2 3.33Å; Q93-D512 PolarHBondContact NE2-OD2 3.3Å
94	E	72.1	Confident	72.2	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-42.7	178	-67.2	175.2	144.5	0	0	110.3	D89 F90 M91 V92 G98 I99 I101 A102	D89-E94 WeakPolarHBondContact CA-OE2 3.45Å; D89-E94 HydrophobicContact CB-CB 4.01Å; F90-E94 PolarHBondContact N-OE2 3.48Å; M91-E94 HydrophobicContact CB-CB 4.34Å; M91-E94 HydrophobicContact CB-CG 3.84Å; M91-E94 WeakPolarHBondContact CB-OE2 3.47Å; M91-E94 PolarHBondContact N-OE2 3.13Å; M91-E94 PolarHBondContact O-N 3.2Å; V92-E94 VanDerWaalsContact C-N 3.32Å; V92-E94 PolarHBondContact O-N 2.92Å; E94-G98 VanDerWaalsContact O-CA 3.31Å; E94-G98 WeakPolarHBondContact O-CA 3.39Å; E94-G98 PolarHBondContact O-N 2.9Å; E94-I99 WeakPolarHBondContact CA-O 3.39Å; E94-I99 WeakPolarHBondContact CB-O 3.27Å; E94-I99 VanDerWaalsContact CG-O 3.32Å; E94-I99 WeakPolarHBondContact CG-O 3.27Å; E94-I99 PolarHBondContact O-N 2.94Å; E94-I101 HydrophobicContact CG-CB 3.86Å; E94-I101 HydrophobicContact CG-CD1 4Å; E94-I101 HydrophobicContact CG-CG1 3.9Å; E94-I101 PolarHBondContact OE1-N 3.24Å; E94-A102 PolarHBondContact OE1-N 3.08Å
95	R	75.7	Confident	73.2	Confident	114 Å²	114	34 Å²	34	43%	0.43	18%	0.178	S	C	.	.	H	α-helix	trans	-68	-42.5	178.3	-62.2	175.2	-175.6	-169.5	-6.5	112.8	G84 D89 M91 V92 Q93	G84-R95 PolarHBondContact O-NH1 2.95Å; G84-R95 PolarHBondContact O-NH2 2.78Å; D89-R95 PolarHBondContact O-NE 3.29Å; D89-R95 PolarHBondContact O-NH2 3.07Å; D89-R95 VanDerWaalsContact O-NH2 3.1Å; M91-R95 PolarHBondContact O-N 2.92Å; V92-R95 PolarHBondContact O-N 3.42Å; Q93-R95 VanDerWaalsContact C-N 3.32Å
96	E	73.5	Confident	73.8	Confident	122 Å²	122	30.7 Å²	30.7	57%	0.57	16%	0.158	S	C	*	.	H	α-helix	trans	-69.9	-36.9	-179.3	-76.7	178.1	-172.1	0	0	113	V92 R516	V92-E96 HydrophobicContact CG1-CG 4.35Å; V92-E96 WeakPolarHBondContact O-CG 3.45Å; V92-E96 PolarHBondContact O-N 3Å; E96-R516 IonicContact OE1-CZ 3.21Å; E96-R516 IonicContact OE1-NH1 3.05Å; E96-R516 PolarHBondContact OE1-NH1 3.15Å; E96-R516 IonicContact OE1-NH2 2.99Å; E96-R516 PolarHBondContact OE1-NH2 2.89Å; E96-R516 IonicContact OE2-CZ 2.74Å; E96-R516 IonicContact OE2-NH1 3.66Å; E96-R516 PolarHBondContact OE2-NH1 2.94Å; E96-R516 IonicContact OE2-NH2 3.13Å; E96-R516 PolarHBondContact OE2-NH2 2.92Å
97	R	69.7	Low	74.5	Confident	97 Å²	97	31.2 Å²	31.2	37%	0.366	16%	0.162	S	C	.	.	H	α-helix	trans	-92.5	-13.7	-178.5	-64	-179.1	177.7	-170.7	-2.1	113.2	Q93 I99	Q93-R97 WeakPolarHBondContact O-CB 3.38Å; Q93-R97 WeakPolarHBondContact O-CG 3.4Å; Q93-R97 PolarHBondContact O-N 3.42Å; R97-I99 VanDerWaalsContact C-N 3.31Å; R97-I99 HydrophobicContact CB-CD1 4.26Å; R97-I99 HydrophobicContact CB-CG1 3.82Å; R97-I99 PolarHBondContact O-N 3.4Å
98	G	61	Low	75.4	Confident	38 Å²	38	29.8 Å²	29.8	39%	0.392	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	26	-175.7	0	0	0	0	0	113.8	E94	E94-G98 VanDerWaalsContact O-CA 3.31Å; E94-G98 WeakPolarHBondContact O-CA 3.39Å; E94-G98 PolarHBondContact O-N 2.9Å
99	I	69.3	Low	76.2	Confident	23 Å²	23	33.5 Å²	33.5	12%	0.118	17%	0.173	C	C	.	.	S	Bend	trans	-130	142	-178.4	62.5	174.3	0	0	0	110.8	I57 E94 R97 I101	I57-I99 HydrophobicContact CD1-CG2 4.49Å; I57-I99 HydrophobicContact CG1-CG2 4.47Å; I57-I99 HydrophobicContact CG2-CG2 4.07Å; E94-I99 WeakPolarHBondContact CA-O 3.39Å; E94-I99 WeakPolarHBondContact CB-O 3.27Å; E94-I99 VanDerWaalsContact CG-O 3.32Å; E94-I99 WeakPolarHBondContact CG-O 3.27Å; E94-I99 PolarHBondContact O-N 2.94Å; R97-I99 VanDerWaalsContact C-N 3.31Å; R97-I99 HydrophobicContact CB-CD1 4.26Å; R97-I99 HydrophobicContact CB-CG1 3.82Å; R97-I99 PolarHBondContact O-N 3.4Å; I99-I101 HydrophobicContact CD1-CG1 4.35Å; I99-I101 HydrophobicContact CG1-CG1 4.16Å
100	T	69.7	Low	77	Confident	11 Å²	11	34.6 Å²	34.6	7%	0.067	18%	0.177	C	C	.	.			trans	-76.3	125.3	169.2	-48.4	0	0	0	0	109.3	D89 P121	D89-T100 PolarHBondContact OD1-OG1 3.27Å; T100-P121 WeakPolarHBondContact O-CA 3.47Å; T100-P121 WeakPolarHBondContact O-CB 3.48Å
101	I	69.7	Low	77.6	Confident	13 Å²	13	36 Å²	36	7%	0.067	19%	0.186	C	C	.	.			trans	-105.5	-44.3	-177.2	-66.1	168.8	0	0	0	109.7	Q93 E94 I99 P121 F126 I509	Q93-I101 HydrophobicContact CB-CD1 3.65Å; E94-I101 HydrophobicContact CG-CB 3.86Å; E94-I101 HydrophobicContact CG-CD1 4Å; E94-I101 HydrophobicContact CG-CG1 3.9Å; E94-I101 PolarHBondContact OE1-N 3.24Å; I99-I101 HydrophobicContact CD1-CG1 4.35Å; I99-I101 HydrophobicContact CG1-CG1 4.16Å; I101-P121 WeakPolarHBondContact O-CG 3.18Å; I101-F126 HydrophobicContact CG1-CE2 4.18Å; I101-F126 HydrophobicContact CG1-CZ 4.4Å; I101-F126 HydrophobicContact CG2-CD1 4.32Å; I101-F126 HydrophobicContact CG2-CE1 3.98Å; I101-F126 HydrophobicContact CG2-CE2 4.35Å; I101-F126 HydrophobicContact CG2-CZ 4.07Å; I101-I509 HydrophobicContact CD1-CD1 3.92Å; I101-I509 HydrophobicContact CD1-CG1 4.36Å; I101-I509 HydrophobicContact CG1-CD1 4.23Å; I101-I509 HydrophobicContact CG2-CD1 4.17Å; I101-I509 HydrophobicContact CG2-CG2 4.29Å
102	A	76.6	Confident	78.1	Confident	10 Å²	10	40.7 Å²	40.7	8%	0.083	22%	0.22	C	C	.	.	S	Bend	trans	-113.7	143.5	-178.1	0	0	0	0	0	111.1	M91 E94 A104	M91-A102 HydrophobicContact CE-CB 3.58Å; M91-A102 HydrophobicContact SD-CB 3.97Å; E94-A102 PolarHBondContact OE1-N 3.08Å; A102-A104 PolarHBondContact O-N 3.5Å
103	A	79.2	Confident	78.8	Confident	3 Å²	3	38.2 Å²	38.2	3%	0.025	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-73.9	116.4	-176.5	0	0	0	0	0	112	I118 D119 E129 S133 K345	A103-I118 HydrophobicContact CB-CG2 3.81Å; A103-D119 CarbonylContact C-O 3.55Å; A103-D119 WeakPolarHBondContact CA-O 3.45Å; A103-D119 WeakPolarHBondContact CB-O 3.29Å; A103-E129 HydrophobicContact CB-CG 3.94Å; A103-E129 PolarHBondContact N-OE1 3.28Å; A103-E129 VanDerWaalsContact N-OE1 3.09Å; A103-S133 WeakPolarHBondContact CB-OG 3.38Å; A103-K345 PolarHBondContact O-NZ 3.2Å
104	A	81.3	Confident	79.5	Confident	3 Å²	3	40.5 Å²	40.5	3%	0.025	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	128	-179.8	0	0	0	0	0	110.9	C88 A102 I118 D119	C88-A104 HydrophobicContact CB-CB 3.89Å; A102-A104 PolarHBondContact O-N 3.5Å; A104-I118 CarbonylContact O-C 3.47Å; A104-I118 WeakPolarHBondContact O-CA 3.43Å; A104-D119 HydrophobicContact CB-CB 4.39Å; A104-D119 PolarHBondContact N-O 3.38Å; A104-D119 VanDerWaalsContact N-O 3.17Å; A104-D119 PolarHBondContact O-N 3.05Å
105	A	85.7	Confident	80.4	Confident	11 Å²	11	40.4 Å²	40.4	9%	0.091	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	123.5	174.4	0	0	0	0	0	110.5	L117 F357 P388 G390	A105-L117 WeakPolarHBondContact CA-O 3.44Å; A105-F357 HydrophobicContact CB-CE1 4.31Å; A105-P388 HydrophobicContact CB-CB 4.22Å; A105-P388 HydrophobicContact CB-CG 3.84Å; A105-G390 PolarHBondContact O-N 2.92Å
106	V	87.2	Confident	81.2	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.024	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.4	174.9	-62	0	0	0	0	110.3	T65 L69 V87 F108 L117	T65-V106 HydrophobicContact CG2-CG2 4.1Å; L69-V106 HydrophobicContact CD1-CG1 4.46Å; L69-V106 HydrophobicContact CD2-CB 4.29Å; L69-V106 HydrophobicContact CD2-CG2 4.2Å; V87-V106 HydrophobicContact CG1-CG1 4.24Å; V106-F108 HydrophobicContact CG2-CD1 4.31Å; V106-F108 HydrophobicContact CG2-CE1 4.23Å; V106-L117 HydrophobicContact CG2-CB 3.72Å; V106-L117 HydrophobicContact CG2-CD2 4.07Å; V106-L117 HydrophobicContact CG2-CG 4.38Å; V106-L117 PolarHBondContact N-O 3.05Å; V106-L117 PolarHBondContact O-N 3.45Å
107	C	87.2	Confident	82	Confident	19 Å²	19	29.6 Å²	29.6	13%	0.128	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.8	176.2	175.3	0	0	0	0	110.1	I115 N116 I387 P388 F389	C107-I115 WeakPolarHBondContact CA-O 3.3Å; C107-N116 PolarHBondContact SG-OD1 3.36Å; C107-I387 HydrophobicContact CB-CG2 3.66Å; C107-P388 PolarHBondContact N-O 3.39Å; C107-F389 WeakPolarHBondContact O-CD2 3.47Å
108	F	89.2	Confident	83	Confident	3 Å²	3	25.1 Å²	25.1	1%	0.013	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	159.8	175.9	59.6	-87.1	0	0	0	111.4	M68 L69 T74 V106 I115 L117 L314	M68-F108 HydrophobicContact CB-CE2 4.43Å; M68-F108 HydrophobicContact CB-CZ 3.99Å; M68-F108 HydrophobicContact SD-CZ 4.47Å; L69-F108 HydrophobicContact CD2-CB 4.26Å; L69-F108 HydrophobicContact CD2-CD1 3.47Å; L69-F108 VanDerWaalsContact CD2-CD1 3.47Å; L69-F108 HydrophobicContact CD2-CE1 3.99Å; L69-F108 HydrophobicContact CD2-CG 4Å; T74-F108 HydrophobicContact CG2-CB 4.31Å; T74-F108 WeakPolarHBondContact OG1-CB 3.42Å; V106-F108 HydrophobicContact CG2-CD1 4.31Å; V106-F108 HydrophobicContact CG2-CE1 4.23Å; F108-I115 HydrophobicContact CD2-CB 4.39Å; F108-I115 HydrophobicContact CE1-CB 4.4Å; F108-I115 HydrophobicContact CE1-CG2 4.16Å; F108-I115 HydrophobicContact CE2-CB 4Å; F108-I115 HydrophobicContact CE2-CD1 3.86Å; F108-I115 HydrophobicContact CE2-CG1 4.45Å; F108-I115 HydrophobicContact CE2-CG2 4.29Å; F108-I115 HydrophobicContact CZ-CB 4.01Å; F108-I115 HydrophobicContact CZ-CD1 4.3Å; F108-I115 HydrophobicContact CZ-CG2 3.81Å; F108-I115 PolarHBondContact N-O 3.39Å; F108-I115 PolarHBondContact O-N 3.15Å; F108-L117 HydrophobicContact CE1-CB 4.1Å; F108-L117 HydrophobicContact CE1-CD2 4.32Å; F108-L314 HydrophobicContact CE2-CD2 3.7Å; F108-L314 HydrophobicContact CZ-CD2 4.04Å
109	D	89.3	Confident	84.3	Confident	78 Å²	78	23.3 Å²	23.3	42%	0.417	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	137.4	-178	-62	-37.1	0	0	0	110.4	N113 R114	D109-N113 CarbonylContact C-O 3.59Å; D109-N113 VanDerWaalsContact CA-O 3.31Å; D109-N113 WeakPolarHBondContact CA-O 3.48Å; D109-R114 IonicContact OD1-CZ 2.78Å; D109-R114 IonicContact OD1-NE 3.96Å; D109-R114 PolarHBondContact OD1-NE 3.26Å; D109-R114 IonicContact OD1-NH2 3.52Å; D109-R114 IonicContact OD2-NH2 3.95Å
110	W	89.3	Confident	85	Confident	28 Å²	28	22.2 Å²	22.2	11%	0.106	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	125.3	176.2	-178.7	-106.3	0	0	0	110.7	A71 C112 N113 I115 H311 L314 D315	A71-W110 WeakPolarHBondContact O-CZ3 3.21Å; W110-C112 VanDerWaalsContact C-N 3.32Å; W110-C112 PolarHBondContact O-N 3.4Å; W110-N113 PolarHBondContact N-O 3.12Å; W110-N113 WeakPolarHBondContact O-CA 3.25Å; W110-N113 VanDerWaalsContact O-CB 3.32Å; W110-N113 WeakPolarHBondContact O-CB 3.24Å; W110-N113 PolarHBondContact O-N 3.23Å; W110-I115 HydrophobicContact CB-CD1 3.89Å; W110-H311 AromaticContact CH2-CD2 3.73Å; W110-L314 HydrophobicContact CD2-CB 3.92Å; W110-L314 HydrophobicContact CD2-CD1 3.83Å; W110-L314 HydrophobicContact CD2-CG 4.45Å; W110-L314 HydrophobicContact CE3-CD1 3.86Å; W110-L314 HydrophobicContact CG-CB 3.94Å; W110-L314 HydrophobicContact CG-CD1 4.33Å; W110-L314 HydrophobicContact CH2-CD1 4.41Å; W110-L314 HydrophobicContact CZ2-CB 4.24Å; W110-L314 HydrophobicContact CZ2-CD1 4.39Å; W110-L314 HydrophobicContact CZ3-CD1 4.16Å; W110-D315 PolarHBondContact NE1-OD1 3.21Å
111	N	84.5	Confident	85.3	Confident	76 Å²	76	21.8 Å²	21.8	41%	0.406	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	50.2	177.6	-77.4	-16.1	0	0	0	114.2	N113 D315	N111-N113 PolarHBondContact O-N 3.34Å; N111-N113 VanDerWaalsContact O-N 3.1Å; N111-N113 PolarHBondContact O-ND2 3.17Å; N111-D315 PolarHBondContact ND2-OD1 2.99Å
112	C	83	Confident	85.1	Confident	123 Å²	123	21.5 Å²	21.5	83%	0.831	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	3.6	-176	-56.4	0	0	0	0	115.6	W110	W110-C112 VanDerWaalsContact C-N 3.32Å; W110-C112 PolarHBondContact O-N 3.4Å
113	N	86.9	Confident	84.6	Confident	18 Å²	18	23.2 Å²	23.2	10%	0.096	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	145.6	171.7	-61.4	-86.5	0	0	0	110.6	F47 D109 W110 N111 C318	F47-N113 WeakPolarHBondContact CA-OD1 3.41Å; F47-N113 WeakPolarHBondContact CD1-OD1 3.43Å; F47-N113 CarbonylContact O-C 3.51Å; F47-N113 WeakPolarHBondContact O-CA 3.41Å; F47-N113 VanDerWaalsContact O-CB 3.24Å; F47-N113 WeakPolarHBondContact O-CB 3.46Å; F47-N113 PolarHBondContact O-OD1 2.82Å; D109-N113 CarbonylContact C-O 3.59Å; D109-N113 VanDerWaalsContact CA-O 3.31Å; D109-N113 WeakPolarHBondContact CA-O 3.48Å; W110-N113 PolarHBondContact N-O 3.12Å; W110-N113 WeakPolarHBondContact O-CA 3.25Å; W110-N113 VanDerWaalsContact O-CB 3.32Å; W110-N113 WeakPolarHBondContact O-CB 3.24Å; W110-N113 PolarHBondContact O-N 3.23Å; N111-N113 PolarHBondContact O-N 3.34Å; N111-N113 VanDerWaalsContact O-N 3.1Å; N111-N113 PolarHBondContact O-ND2 3.17Å; N113-C318 HydrophobicContact CB-CB 4.49Å
114	R	88.9	Confident	83.8	Confident	55 Å²	55	24.9 Å²	24.9	21%	0.208	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.8	169.9	179.6	161.3	-69.6	168	3.1	109.7	F47 L48 R49 D109	F47-R114 PolarHBondContact O-N 3.11Å; L48-R114 CarbonylContact C-O 3.56Å; L48-R114 WeakPolarHBondContact CA-O 3.37Å; L48-R114 HydrophobicContact CG-CB 4.5Å; R49-R114 PolarHBondContact N-O 3.33Å; D109-R114 IonicContact OD1-CZ 2.78Å; D109-R114 IonicContact OD1-NE 3.96Å; D109-R114 PolarHBondContact OD1-NE 3.26Å; D109-R114 IonicContact OD1-NH2 3.52Å; D109-R114 IonicContact OD2-NH2 3.95Å
115	I	91.4	Very high	83.1	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.6	177.7	-57.9	174.9	0	0	0	108.1	R49 C107 F108 W110 L117 L314 I317	R49-I115 HydrophobicContact CB-CG1 4.39Å; R49-I115 WeakPolarHBondContact O-CA 3.41Å; C107-I115 WeakPolarHBondContact CA-O 3.3Å; F108-I115 HydrophobicContact CD2-CB 4.39Å; F108-I115 HydrophobicContact CE1-CB 4.4Å; F108-I115 HydrophobicContact CE1-CG2 4.16Å; F108-I115 HydrophobicContact CE2-CB 4Å; F108-I115 HydrophobicContact CE2-CD1 3.86Å; F108-I115 HydrophobicContact CE2-CG1 4.45Å; F108-I115 HydrophobicContact CE2-CG2 4.29Å; F108-I115 HydrophobicContact CZ-CB 4.01Å; F108-I115 HydrophobicContact CZ-CD1 4.3Å; F108-I115 HydrophobicContact CZ-CG2 3.81Å; F108-I115 PolarHBondContact N-O 3.39Å; F108-I115 PolarHBondContact O-N 3.15Å; W110-I115 HydrophobicContact CB-CD1 3.89Å; I115-L117 HydrophobicContact CG2-CB 4.49Å; I115-L314 HydrophobicContact CD1-CD2 4Å; I115-I317 HydrophobicContact CD1-CG2 4.02Å; I115-I317 HydrophobicContact CG1-CG2 4.39Å
116	N	91.8	Very high	82.4	Confident	8 Å²	8	26.7 Å²	26.7	4%	0.043	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	105.9	166.9	-58	-35.2	0	0	0	107.4	R49 N50 V51 C107 I404	R49-N116 PolarHBondContact O-N 2.97Å; N50-N116 WeakPolarHBondContact CA-O 3.36Å; N50-N116 WeakPolarHBondContact OD1-CB 3.09Å; N50-N116 PolarHBondContact OD1-ND2 2.84Å; V51-N116 PolarHBondContact N-O 2.68Å; C107-N116 PolarHBondContact SG-OD1 3.36Å; N116-I404 HydrophobicContact CB-CD1 4.15Å
117	L	91.8	Very high	81.5	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	133	-179.7	-170	72.9	0	0	0	109.3	V51 L53 T65 M68 A105 V106 F108 I115	V51-L117 HydrophobicContact CB-CD1 3.95Å; V51-L117 HydrophobicContact CG1-CD1 4.04Å; V51-L117 CarbonylContact O-C 3.59Å; V51-L117 WeakPolarHBondContact O-CA 3.4Å; L53-L117 HydrophobicContact CD1-CD2 4.1Å; L53-L117 HydrophobicContact CD1-CG 4.43Å; L53-L117 HydrophobicContact CD2-CD1 3.72Å; L53-L117 HydrophobicContact CD2-CG 4.46Å; L53-L117 HydrophobicContact CG-CD1 3.86Å; L53-L117 HydrophobicContact CG-CD2 4.29Å; L53-L117 HydrophobicContact CG-CG 4.14Å; T65-L117 HydrophobicContact CG2-CD2 3.61Å; M68-L117 HydrophobicContact SD-CD2 4.16Å; A105-L117 WeakPolarHBondContact CA-O 3.44Å; V106-L117 HydrophobicContact CG2-CB 3.72Å; V106-L117 HydrophobicContact CG2-CD2 4.07Å; V106-L117 HydrophobicContact CG2-CG 4.38Å; V106-L117 PolarHBondContact N-O 3.05Å; V106-L117 PolarHBondContact O-N 3.45Å; F108-L117 HydrophobicContact CE1-CB 4.1Å; F108-L117 HydrophobicContact CE1-CD2 4.32Å; I115-L117 HydrophobicContact CG2-CB 4.49Å
118	I	90.4	Very high	80.9	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	114.3	169.6	-53.6	-175	0	0	0	107.8	V51 A52 L53 A103 A104 T120 V136 V137 F344 I404	V51-I118 PolarHBondContact O-N 3.29Å; A52-I118 CarbonylContact C-O 3.5Å; A52-I118 WeakPolarHBondContact CA-O 3.37Å; L53-I118 PolarHBondContact N-O 3.07Å; A103-I118 HydrophobicContact CB-CG2 3.81Å; A104-I118 CarbonylContact O-C 3.47Å; A104-I118 WeakPolarHBondContact O-CA 3.43Å; I118-T120 HydrophobicContact CG2-CG2 4.2Å; I118-V136 HydrophobicContact CD1-CG1 4.24Å; I118-V137 HydrophobicContact CB-CG1 4.41Å; I118-V137 HydrophobicContact CD1-CG1 3.61Å; I118-V137 HydrophobicContact CG1-CG1 3.97Å; I118-F344 HydrophobicContact CD1-CE2 4.2Å; I118-F344 HydrophobicContact CD1-CZ 4.44Å; I118-I404 HydrophobicContact CD1-CD1 4.06Å; I118-I404 HydrophobicContact CG1-CD1 4.43Å
119	D	87.3	Confident	80.4	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.1	171	-156	-8.1	0	0	0	108.6	L53 T65 C88 A103 A104	L53-D119 HydrophobicContact CD1-CB 4.48Å; T65-D119 PolarHBondContact OG1-OD2 3.2Å; C88-D119 HydrophobicContact CB-CB 4.49Å; A103-D119 CarbonylContact C-O 3.55Å; A103-D119 WeakPolarHBondContact CA-O 3.45Å; A103-D119 WeakPolarHBondContact CB-O 3.29Å; A104-D119 HydrophobicContact CB-CB 4.39Å; A104-D119 PolarHBondContact N-O 3.38Å; A104-D119 VanDerWaalsContact N-O 3.17Å; A104-D119 PolarHBondContact O-N 3.05Å
120	T	83.7	Confident	80	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.134	C	C	.	.			trans	-107.3	147.1	-174.5	76.5	0	0	0	0	111.8	A52 L53 K61 I118	A52-T120 HydrophobicContact CB-CG2 4.02Å; L53-T120 PolarHBondContact O-OG1 3.4Å; K61-T120 VanDerWaalsContact CE-O 3.25Å; K61-T120 WeakPolarHBondContact CE-O 3.35Å; I118-T120 HydrophobicContact CG2-CG2 4.2Å
121	P	77.5	Confident	79.5	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.006	14%	0.139	C	C	.	.			trans	-56.2	140.8	174.1	-28.5	37.9	0	0	0	113.1	T100 I101 F126 E129 V130	T100-P121 WeakPolarHBondContact O-CA 3.47Å; T100-P121 WeakPolarHBondContact O-CB 3.48Å; I101-P121 WeakPolarHBondContact O-CG 3.18Å; P121-F126 HydrophobicContact CB-CB 3.67Å; P121-F126 HydrophobicContact CB-CD2 4.09Å; P121-F126 HydrophobicContact CB-CG 4.27Å; P121-F126 HydrophobicContact CG-CB 3.91Å; P121-E129 HydrophobicContact CG-CB 4.11Å; P121-E129 HydrophobicContact CG-CG 3.93Å; P121-V130 HydrophobicContact CB-CG2 4.26Å; P121-V130 WeakPolarHBondContact O-CG2 3.35Å
122	G	64.5	Low	79.4	Confident	7 Å²	7	22 Å²	22	7%	0.072	12%	0.121	C	C	.	.			trans	-89.4	-14.4	172	0	0	0	0	0	114.3	Q153	G122-Q153 PolarHBondContact O-OE1 3.14Å
123	H	67	Low	79.6	Confident	46 Å²	46	16.3 Å²	16.3	21%	0.213	8%	0.082	C	C	.	.	S	Bend	trans	-84.8	145.9	-172.1	-155.9	-85.2	0	0	0	112.3	D125 F126	H123-D125 VanDerWaalsContact C-N 3.3Å; H123-D125 IonicContact CE1-OD2 2.8Å; H123-D125 PolarHBondContact CE1-OD2 2.77Å; H123-D125 PolarHBondContact ND1-N 2.92Å; H123-D125 IonicContact ND1-OD2 3.89Å; H123-D125 PolarHBondContact ND1-OD2 3.33Å; H123-D125 VanDerWaalsContact ND1-OD2 3.14Å; H123-D125 PolarHBondContact O-N 2.95Å; H123-F126 HydrophobicContact CB-CD2 3.85Å; H123-F126 HydrophobicContact CB-CE2 4Å; H123-F126 PolarHBondContact O-N 3.25Å
124	V	62.6	Low	79.5	Confident	38 Å²	38	15.4 Å²	15.4	23%	0.23	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-65.2	-33	-176.3	-177.9	0	0	0	0	112.4	F126 T127 Q153	V124-F126 PolarHBondContact O-N 3.18Å; V124-T127 HydrophobicContact CG1-CG2 4.38Å; V124-T127 WeakPolarHBondContact O-CB 3.26Å; V124-T127 WeakPolarHBondContact O-CG2 3.42Å; V124-T127 PolarHBondContact O-N 3.48Å; V124-T127 PolarHBondContact O-OG1 3.38Å; V124-Q153 HydrophobicContact CG2-CG 4.48Å
125	D	65.4	Low	79.2	Confident	37 Å²	37	14.9 Å²	14.9	20%	0.198	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-66.9	-19.7	-179.6	-60.1	-34.8	0	0	0	113.7	H123 L505	H123-D125 VanDerWaalsContact C-N 3.3Å; H123-D125 IonicContact CE1-OD2 2.8Å; H123-D125 PolarHBondContact CE1-OD2 2.77Å; H123-D125 PolarHBondContact ND1-N 2.92Å; H123-D125 IonicContact ND1-OD2 3.89Å; H123-D125 PolarHBondContact ND1-OD2 3.33Å; H123-D125 VanDerWaalsContact ND1-OD2 3.14Å; H123-D125 PolarHBondContact O-N 2.95Å; D125-L505 HydrophobicContact CB-CD2 4.46Å; D125-L505 WeakPolarHBondContact OD2-CB 3.16Å; D125-L505 VanDerWaalsContact OD2-CD2 3.27Å; D125-L505 WeakPolarHBondContact OD2-CD2 3.37Å
126	F	72.1	Confident	79	Confident	15 Å²	15	15 Å²	15	7%	0.066	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-105.5	26.5	176.8	-47.7	-61.2	0	0	0	112.5	I101 P121 H123 V124 I128 E129 V130 L505 I509	I101-F126 HydrophobicContact CG1-CE2 4.18Å; I101-F126 HydrophobicContact CG1-CZ 4.4Å; I101-F126 HydrophobicContact CG2-CD1 4.32Å; I101-F126 HydrophobicContact CG2-CE1 3.98Å; I101-F126 HydrophobicContact CG2-CE2 4.35Å; I101-F126 HydrophobicContact CG2-CZ 4.07Å; P121-F126 HydrophobicContact CB-CB 3.67Å; P121-F126 HydrophobicContact CB-CD2 4.09Å; P121-F126 HydrophobicContact CB-CG 4.27Å; P121-F126 HydrophobicContact CG-CB 3.91Å; H123-F126 HydrophobicContact CB-CD2 3.85Å; H123-F126 HydrophobicContact CB-CE2 4Å; H123-F126 PolarHBondContact O-N 3.25Å; V124-F126 PolarHBondContact O-N 3.18Å; F126-I128 PolarHBondContact O-N 2.76Å; F126-I128 VanDerWaalsContact O-N 3.14Å; F126-E129 HydrophobicContact CB-CB 4.17Å; F126-E129 WeakPolarHBondContact O-CB 3.27Å; F126-E129 PolarHBondContact O-N 3.19Å; F126-V130 PolarHBondContact O-N 3.39Å; F126-V130 VanDerWaalsContact O-N 3.13Å; F126-L505 HydrophobicContact CE2-CD2 4.32Å; F126-L505 HydrophobicContact CZ-CD2 4.22Å; F126-I509 HydrophobicContact CE1-CD1 3.68Å; F126-I509 HydrophobicContact CE2-CD1 4.15Å; F126-I509 HydrophobicContact CZ-CD1 3.14Å
127	T	68.4	Low	79	Confident	26 Å²	26	14.8 Å²	14.8	16%	0.16	8%	0.075	C	C	.	.	H	α-helix	trans	-52.6	-34.5	176.8	37.9	0	0	0	0	113	V124 V130 E131	V124-T127 HydrophobicContact CG1-CG2 4.38Å; V124-T127 WeakPolarHBondContact O-CB 3.26Å; V124-T127 WeakPolarHBondContact O-CG2 3.42Å; V124-T127 PolarHBondContact O-N 3.48Å; V124-T127 PolarHBondContact O-OG1 3.38Å; T127-V130 WeakPolarHBondContact O-CB 3.5Å; T127-V130 PolarHBondContact O-N 3.14Å; T127-E131 WeakPolarHBondContact O-CG 3.2Å; T127-E131 PolarHBondContact O-N 3.11Å
128	I	74.7	Confident	78.9	Confident	6 Å²	6	15 Å²	15	3%	0.031	8%	0.076	C	C	.	.	H	α-helix	trans	-66.4	-39.9	176.2	-69.1	177.1	0	0	0	111.7	F126 V130 E131 K132 L452 P453 M502	F126-I128 PolarHBondContact O-N 2.76Å; F126-I128 VanDerWaalsContact O-N 3.14Å; I128-V130 VanDerWaalsContact C-N 3.28Å; I128-V130 PolarHBondContact O-N 2.64Å; I128-E131 PolarHBondContact O-N 3.31Å; I128-K132 HydrophobicContact CG2-CD 4.01Å; I128-K132 HydrophobicContact CG2-CG 4.35Å; I128-K132 WeakPolarHBondContact O-CB 3.38Å; I128-K132 WeakPolarHBondContact O-CG 3.2Å; I128-K132 PolarHBondContact O-N 2.84Å; I128-L452 HydrophobicContact CD1-CD2 4.3Å; I128-L452 HydrophobicContact CG2-CD2 4.3Å; I128-P453 HydrophobicContact CD1-CG 3.85Å; I128-P453 HydrophobicContact CG1-CG 4.37Å; I128-M502 HydrophobicContact CD1-CE 4.4Å; I128-M502 HydrophobicContact CD1-SD 3.26Å; I128-M502 WeakPolarHBondContact CD1-SD 3.22Å; I128-M502 HydrophobicContact CG1-SD 3.89Å
129	E	78.3	Confident	79	Confident	26 Å²	26	15 Å²	15	12%	0.121	8%	0.076	C	C	.	.	H	α-helix	trans	-64.8	-37.1	176.7	-167.6	68.4	-179	0	0	111.1	A103 P121 F126 K132 S133	A103-E129 HydrophobicContact CB-CG 3.94Å; A103-E129 PolarHBondContact N-OE1 3.28Å; A103-E129 VanDerWaalsContact N-OE1 3.09Å; P121-E129 HydrophobicContact CG-CB 4.11Å; P121-E129 HydrophobicContact CG-CG 3.93Å; F126-E129 HydrophobicContact CB-CB 4.17Å; F126-E129 WeakPolarHBondContact O-CB 3.27Å; F126-E129 PolarHBondContact O-N 3.19Å; E129-K132 IonicContact OE2-NZ 3.98Å; E129-S133 WeakPolarHBondContact O-CB 3.26Å; E129-S133 PolarHBondContact O-N 3.39Å; E129-S133 PolarHBondContact O-OG 2.88Å
130	V	80.4	Confident	79.3	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.006	8%	0.076	C	C	.	.	H	α-helix	trans	-64.8	-48.3	172.5	179.5	0	0	0	0	110.9	P121 F126 T127 I128 K132 S133 L134 V157 Q160	P121-V130 HydrophobicContact CB-CG2 4.26Å; P121-V130 WeakPolarHBondContact O-CG2 3.35Å; F126-V130 PolarHBondContact O-N 3.39Å; F126-V130 VanDerWaalsContact O-N 3.13Å; T127-V130 WeakPolarHBondContact O-CB 3.5Å; T127-V130 PolarHBondContact O-N 3.14Å; I128-V130 VanDerWaalsContact C-N 3.28Å; I128-V130 PolarHBondContact O-N 2.64Å; V130-K132 PolarHBondContact O-N 2.66Å; V130-S133 PolarHBondContact O-N 2.88Å; V130-S133 VanDerWaalsContact O-N 3.14Å; V130-L134 HydrophobicContact CG1-CD1 3.73Å; V130-L134 HydrophobicContact CG1-CG 4.04Å; V130-L134 WeakPolarHBondContact O-CB 3.42Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 3.15Å; V130-L134 PolarHBondContact O-N 3.16Å; V130-V157 HydrophobicContact CG1-CB 4.36Å; V130-V157 HydrophobicContact CG1-CG1 3.49Å; V130-V157 VanDerWaalsContact CG1-CG1 3.49Å; V130-V157 HydrophobicContact CG1-CG2 4.13Å; V130-Q160 VanDerWaalsContact CG1-OE1 3.26Å
131	E	79.4	Confident	79.8	Confident	46 Å²	46	14.9 Å²	14.9	22%	0.215	8%	0.076	C	C	.	.	H	α-helix	trans	-62.2	-42.1	178.3	-74.4	-171.5	-176.8	0	0	112.9	T127 I128 S133 R135 Q160 F164	T127-E131 WeakPolarHBondContact O-CG 3.2Å; T127-E131 PolarHBondContact O-N 3.11Å; I128-E131 PolarHBondContact O-N 3.31Å; E131-S133 VanDerWaalsContact C-N 3.28Å; E131-S133 PolarHBondContact O-N 3.46Å; E131-R135 WeakPolarHBondContact O-CB 3.43Å; E131-R135 PolarHBondContact O-N 2.94Å; E131-Q160 HydrophobicContact CG-CG 4.27Å; E131-Q160 PolarHBondContact OE1-NE2 2.89Å; E131-Q160 VanDerWaalsContact OE1-NE2 3.09Å; E131-F164 HydrophobicContact CB-CE2 4.44Å; E131-F164 HydrophobicContact CG-CE2 4.43Å
132	K	82.7	Confident	80.6	Confident	6 Å²	6	14.9 Å²	14.9	3%	0.026	8%	0.076	C	C	.	.	H	α-helix	trans	-56.5	-44	173	-73.4	165	-177.6	169	0	111	I128 E129 V130 T415 D483	I128-K132 HydrophobicContact CG2-CD 4.01Å; I128-K132 HydrophobicContact CG2-CG 4.35Å; I128-K132 WeakPolarHBondContact O-CB 3.38Å; I128-K132 WeakPolarHBondContact O-CG 3.2Å; I128-K132 PolarHBondContact O-N 2.84Å; E129-K132 IonicContact OE2-NZ 3.98Å; V130-K132 PolarHBondContact O-N 2.66Å; K132-T415 HydrophobicContact CD-CG2 3.56Å; K132-T415 HydrophobicContact CG-CG2 3.81Å; K132-D483 IonicContact NZ-OD1 2.64Å
133	S	85.8	Confident	82	Confident	2 Å²	2	14.5 Å²	14.5	1%	0.014	7%	0.072	C	C	.	.	H	α-helix	trans	-71.8	-49	-177.5	-61.5	0	0	0	0	112.8	A103 E129 V130 E131 R135 V136	A103-S133 WeakPolarHBondContact CB-OG 3.38Å; E129-S133 WeakPolarHBondContact O-CB 3.26Å; E129-S133 PolarHBondContact O-N 3.39Å; E129-S133 PolarHBondContact O-OG 2.88Å; V130-S133 PolarHBondContact O-N 2.88Å; V130-S133 VanDerWaalsContact O-N 3.14Å; E131-S133 VanDerWaalsContact C-N 3.28Å; E131-S133 PolarHBondContact O-N 3.46Å; S133-R135 PolarHBondContact O-N 2.46Å; S133-V136 PolarHBondContact O-N 2.63Å; S133-V136 VanDerWaalsContact O-N 3.13Å
134	L	86.1	Confident	83.2	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-59.6	-32	-179.4	-71.3	179.1	0	0	0	112.1	A52 I54 V130 V136 V137 V157 Q160 A161 F164 L166	A52-L134 HydrophobicContact CB-CD2 3.84Å; I54-L134 HydrophobicContact CD1-CD2 3.91Å; I54-L134 HydrophobicContact CG1-CD2 4.19Å; V130-L134 HydrophobicContact CG1-CD1 3.73Å; V130-L134 HydrophobicContact CG1-CG 4.04Å; V130-L134 WeakPolarHBondContact O-CB 3.42Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 3.15Å; V130-L134 PolarHBondContact O-N 3.16Å; L134-V136 VanDerWaalsContact C-N 3.28Å; L134-V136 PolarHBondContact O-N 3.48Å; L134-V137 VanDerWaalsContact O-CG2 3.29Å; L134-V137 WeakPolarHBondContact O-CG2 3.12Å; L134-V157 HydrophobicContact CD1-CG1 4.27Å; L134-Q160 HydrophobicContact CD1-CB 3.74Å; L134-A161 HydrophobicContact CD1-CB 4.15Å; L134-A161 HydrophobicContact CD2-CB 4.28Å; L134-F164 HydrophobicContact CB-CD2 3.89Å; L134-F164 HydrophobicContact CB-CE2 4.26Å; L134-L166 HydrophobicContact CB-CD1 4.01Å; L134-L166 HydrophobicContact CD2-CD1 3.84Å; L134-L166 HydrophobicContact CG-CD1 4.47Å; L134-L166 WeakPolarHBondContact O-CD1 3.48Å
135	R	82.9	Confident	84.6	Confident	44 Å²	44	11 Å²	11	17%	0.166	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-24.2	-179.7	-176.9	171.3	172.4	-156.8	-7.8	114.7	E131 S133 F164 L342 Y361 L447 A448	E131-R135 WeakPolarHBondContact O-CB 3.43Å; E131-R135 PolarHBondContact O-N 2.94Å; S133-R135 PolarHBondContact O-N 2.46Å; R135-F164 HydrophobicContact CB-CD1 4.33Å; R135-F164 HydrophobicContact CB-CE1 3.96Å; R135-F164 HydrophobicContact CB-CZ 4.19Å; R135-F164 HydrophobicContact CG-CD1 4.45Å; R135-F164 HydrophobicContact CG-CE1 4.06Å; R135-L342 HydrophobicContact CG-CD2 4.19Å; R135-Y361 PolarHBondContact O-OH 3.28Å; R135-L447 PolarHBondContact NH2-O 3.14Å; R135-A448 PolarHBondContact NH1-O 3.21Å; R135-A448 PolarHBondContact NH2-O 3.15Å
136	V	86.8	Confident	85.8	Confident	1 Å²	1	9.3 Å²	9.3	1%	0.006	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-21.7	-173.6	159.7	0	0	0	0	113.1	I118 S133 L134 L342 F344 R359 I404	I118-V136 HydrophobicContact CD1-CG1 4.24Å; S133-V136 PolarHBondContact O-N 2.63Å; S133-V136 VanDerWaalsContact O-N 3.13Å; L134-V136 VanDerWaalsContact C-N 3.28Å; L134-V136 PolarHBondContact O-N 3.48Å; V136-L342 HydrophobicContact CG2-CD2 4.09Å; V136-F344 HydrophobicContact CB-CD1 4.37Å; V136-F344 HydrophobicContact CB-CG 4.29Å; V136-F344 HydrophobicContact CG1-CD1 4.08Å; V136-F344 HydrophobicContact CG1-CE1 3.95Å; V136-F344 HydrophobicContact CG1-CG 4.42Å; V136-F344 HydrophobicContact CG1-CZ 4.2Å; V136-F344 HydrophobicContact CG2-CB 3.5Å; V136-F344 HydrophobicContact CG2-CD1 3.66Å; V136-F344 HydrophobicContact CG2-CD2 4.16Å; V136-F344 HydrophobicContact CG2-CE1 4.38Å; V136-F344 HydrophobicContact CG2-CG 3.52Å; V136-R359 HydrophobicContact CB-CB 4.33Å; V136-R359 HydrophobicContact CG1-CB 3.65Å; V136-R359 HydrophobicContact CG1-CG 3.96Å; V136-R359 HydrophobicContact CG2-CB 3.96Å; V136-I404 HydrophobicContact CG1-CD1 3.65Å; V136-I404 HydrophobicContact CG1-CG1 4.02Å
137	V	90.8	Very high	86.5	Confident	5 Å²	5	10.6 Å²	10.6	3%	0.03	6%	0.056	C	C	.	.			trans	-86.7	161.6	-179	-62.8	0	0	0	0	111.8	N50 A52 I118 L134 L166	N50-V137 HydrophobicContact CB-CB 4.33Å; N50-V137 HydrophobicContact CB-CG1 4.45Å; A52-V137 HydrophobicContact CB-CB 4.28Å; A52-V137 HydrophobicContact CB-CG1 3.97Å; A52-V137 HydrophobicContact CB-CG2 3.63Å; I118-V137 HydrophobicContact CB-CG1 4.41Å; I118-V137 HydrophobicContact CD1-CG1 3.61Å; I118-V137 HydrophobicContact CG1-CG1 3.97Å; L134-V137 VanDerWaalsContact O-CG2 3.29Å; L134-V137 WeakPolarHBondContact O-CG2 3.12Å; V137-L166 HydrophobicContact CG2-CD1 3.98Å; V137-L166 HydrophobicContact CG2-CD2 4.4Å; V137-L166 WeakPolarHBondContact O-CD2 3.29Å
138	D	90.6	Very high	87.2	Confident	5 Å²	5	11.8 Å²	11.8	3%	0.027	7%	0.068	C	C	.	.	S	Bend	trans	-100.4	-23	179.3	-62.4	-58.2	0	0	0	111.9	N50 P167 P322 P324 N327 R359	N50-D138 PolarHBondContact ND2-OD2 3.31Å; N50-D138 PolarHBondContact O-N 2.82Å; D138-P167 WeakPolarHBondContact O-CD 3.19Å; D138-P322 HydrophobicContact CB-CG 4.15Å; D138-P322 WeakPolarHBondContact O-CG 3.44Å; D138-P324 WeakPolarHBondContact OD2-CA 3.5Å; D138-P324 WeakPolarHBondContact OD2-CG 3.35Å; D138-N327 WeakPolarHBondContact CA-ND2 3.47Å; D138-N327 PolarHBondContact O-ND2 3.39Å; D138-N327 WeakPolarHBondContact OD1-CB 3.4Å; D138-R359 IonicContact OD1-NH2 3.71Å; D138-R359 IonicContact OD2-CZ 3.16Å; D138-R359 IonicContact OD2-NH2 2.79Å; D138-R359 PolarHBondContact OD2-NH2 3.2Å
139	G	92.1	Very high	87.7	Confident	1 Å²	1	11.6 Å²	11.6	1%	0.01	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	174.1	173.9	0	0	0	0	0	112.2	N50 V51 A52 P167	N50-G139 PolarHBondContact O-N 3.42Å; V51-G139 WeakPolarHBondContact CA-O 3.44Å; A52-G139 PolarHBondContact N-O 3.44Å; A52-G139 VanDerWaalsContact N-O 3.07Å; G139-P167 CarbonylContact C-O 3.55Å; G139-P167 WeakPolarHBondContact CA-O 3.27Å
140	A	93.1	Very high	87.9	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148.2	178.3	0	0	0	0	0	111.8	A52 I54 P167 A168 L169	A52-A140 CarbonylContact O-C 3.51Å; A52-A140 WeakPolarHBondContact O-CA 2.98Å; I54-A140 HydrophobicContact CD1-CB 3.63Å; I54-A140 HydrophobicContact CG1-CB 4.3Å; A140-P167 PolarHBondContact N-O 3.1Å; A140-A168 HydrophobicContact CB-CB 4.14Å; A140-A168 CarbonylContact O-C 3.49Å; A140-A168 WeakPolarHBondContact O-CA 3.49Å; A140-L169 PolarHBondContact O-N 3.06Å
141	L	95	Very high	87.9	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.2	168.5	168.9	61	0	0	0	108.4	V51 A52 L53 I54 M68 I143 L169 F171 L313 I317	V51-L141 HydrophobicContact CG1-CB 3.79Å; A52-L141 PolarHBondContact O-N 2.95Å; L53-L141 CarbonylContact C-O 3.5Å; L53-L141 WeakPolarHBondContact CA-O 3.14Å; L53-L141 HydrophobicContact CD2-CB 3.82Å; L53-L141 HydrophobicContact CD2-CD2 3.55Å; L53-L141 HydrophobicContact CD2-CG 3.84Å; I54-L141 PolarHBondContact N-O 3.08Å; M68-L141 HydrophobicContact CE-CD2 3.5Å; M68-L141 VanDerWaalsContact CE-CD2 3.5Å; L141-I143 HydrophobicContact CD2-CG1 4.49Å; L141-I143 HydrophobicContact CG-CG1 4.2Å; L141-L169 CarbonylContact C-O 3.59Å; L141-L169 WeakPolarHBondContact CA-O 3.44Å; L141-L169 HydrophobicContact CD1-CB 4.47Å; L141-L169 HydrophobicContact CD1-CD2 3.53Å; L141-L169 WeakPolarHBondContact CD1-O 3.12Å; L141-F171 HydrophobicContact CD1-CB 3.94Å; L141-L313 HydrophobicContact CD1-CD1 3.78Å; L141-L313 HydrophobicContact CD2-CD1 4.1Å; L141-L313 HydrophobicContact CD2-CD2 4.09Å; L141-L313 HydrophobicContact CD2-CG 4.36Å; L141-I317 HydrophobicContact CD2-CD1 4.17Å
142	I	94.1	Very high	87.4	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.3	177.2	-52.9	173.3	0	0	0	108.3	I54 L144 T154 W158 A168 L169 V170 F171 M193	I54-I142 HydrophobicContact CB-CG1 4.36Å; I54-I142 CarbonylContact O-C 3.41Å; I54-I142 VanDerWaalsContact O-CA 3.28Å; I54-I142 WeakPolarHBondContact O-CA 3.43Å; I142-L144 HydrophobicContact CG2-CD2 3.9Å; I142-L144 HydrophobicContact CG2-CG 4.09Å; I142-T154 HydrophobicContact CG2-CG2 3.77Å; I142-W158 HydrophobicContact CD1-CD2 4.03Å; I142-W158 HydrophobicContact CD1-CE3 3.39Å; I142-W158 HydrophobicContact CD1-CH2 4.43Å; I142-W158 HydrophobicContact CD1-CZ3 3.65Å; I142-W158 HydrophobicContact CG1-CE3 4.28Å; I142-A168 HydrophobicContact CD1-CB 4.03Å; I142-A168 HydrophobicContact CG1-CB 4.27Å; I142-L169 PolarHBondContact N-O 3.44Å; I142-V170 HydrophobicContact CB-CG2 4.2Å; I142-V170 HydrophobicContact CD1-CG2 4.19Å; I142-V170 CarbonylContact O-C 3.21Å; I142-V170 WeakPolarHBondContact O-CA 3.41Å; I142-F171 PolarHBondContact O-N 3.09Å; I142-M193 HydrophobicContact CD1-CE 4.39Å; I142-M193 HydrophobicContact CD1-SD 4.47Å; I142-M193 HydrophobicContact CG2-CE 4.37Å
143	I	93.7	Very high	86.8	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.4	175.4	-60.7	170.2	0	0	0	107.7	L53 I54 A55 A59 K61 T64 L141 F171 N173	L53-I143 HydrophobicContact CD1-CD1 4.33Å; L53-I143 HydrophobicContact CD2-CD1 4.03Å; I54-I143 PolarHBondContact O-N 2.91Å; A55-I143 HydrophobicContact CB-CB 3.92Å; A55-I143 WeakPolarHBondContact CB-O 3.42Å; A59-I143 HydrophobicContact CB-CG2 4.41Å; K61-I143 HydrophobicContact CB-CD1 4.48Å; K61-I143 HydrophobicContact CG-CD1 4.18Å; T64-I143 HydrophobicContact CG2-CD1 3.84Å; L141-I143 HydrophobicContact CD2-CG1 4.49Å; L141-I143 HydrophobicContact CG-CG1 4.2Å; I143-F171 WeakPolarHBondContact CA-O 3.5Å; I143-N173 HydrophobicContact CG2-CB 3.82Å
144	L	93.1	Very high	86.5	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.6	178.5	-59.7	177.9	0	0	0	109.7	I142 A146 V150 T154 V170 F171 L172 N173 I189	I142-L144 HydrophobicContact CG2-CD2 3.9Å; I142-L144 HydrophobicContact CG2-CG 4.09Å; L144-A146 PolarHBondContact O-N 2.96Å; L144-V150 HydrophobicContact CD1-CG2 3.79Å; L144-V150 HydrophobicContact CD2-CG2 4.26Å; L144-T154 HydrophobicContact CD2-CG2 3.67Å; L144-V170 HydrophobicContact CD1-CG1 3.74Å; L144-V170 HydrophobicContact CG-CG1 4.18Å; L144-F171 PolarHBondContact N-O 3.2Å; L144-L172 HydrophobicContact CB-CD2 3.96Å; L144-L172 HydrophobicContact CD1-CD2 3.93Å; L144-L172 HydrophobicContact CG-CD2 4.45Å; L144-N173 PolarHBondContact O-N 2.92Å; L144-I189 HydrophobicContact CD1-CD1 3.88Å; L144-I189 HydrophobicContact CD1-CG1 3.86Å
145	D	91.1	Very high	86	Confident	10 Å²	10	15.9 Å²	15.9	5%	0.053	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.6	166.4	-175.9	-30.3	0	0	0	108.2	S147 A148 G149 K174 K177	D145-S147 VanDerWaalsContact CG-OG 3.22Å; D145-S147 PolarHBondContact O-N 3.17Å; D145-S147 WeakPolarHBondContact OD1-CB 3.21Å; D145-S147 PolarHBondContact OD1-N 3.19Å; D145-S147 PolarHBondContact OD1-OG 2.82Å; D145-S147 PolarHBondContact OD2-OG 2.89Å; D145-A148 HydrophobicContact CB-CB 4.23Å; D145-A148 PolarHBondContact O-N 2.82Å; D145-G149 PolarHBondContact O-N 2.86Å; D145-K174 IonicContact OD2-NZ 3.95Å; D145-K177 IonicContact OD1-NZ 3.79Å; D145-K177 IonicContact OD2-NZ 2.7Å; D145-K177 PolarHBondContact OD2-NZ 2.73Å
146	A	90.4	Very high	85.4	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.008	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.8	-178.8	0	0	0	0	0	114.1	L144 L172 N173 A180 N181 C185	L144-A146 PolarHBondContact O-N 2.96Å; A146-L172 HydrophobicContact CB-CB 4.33Å; A146-N173 WeakPolarHBondContact CB-O 3.5Å; A146-N173 PolarHBondContact N-O 2.79Å; A146-A180 HydrophobicContact CB-CB 3.91Å; A146-A180 WeakPolarHBondContact O-CA 3.16Å; A146-N181 PolarHBondContact O-N 2.97Å; A146-C185 VanDerWaalsContact C-SG 3.59Å; A146-C185 VanDerWaalsContact CA-SG 3.59Å; A146-C185 PolarHBondContact O-SG 2.71Å
147	S	86.6	Confident	84.9	Confident	43 Å²	43	15 Å²	15	30%	0.301	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-28	174.2	65.4	0	0	0	0	113.9	D145 K177	D145-S147 VanDerWaalsContact CG-OG 3.22Å; D145-S147 PolarHBondContact O-N 3.17Å; D145-S147 WeakPolarHBondContact OD1-CB 3.21Å; D145-S147 PolarHBondContact OD1-N 3.19Å; D145-S147 PolarHBondContact OD1-OG 2.82Å; D145-S147 PolarHBondContact OD2-OG 2.89Å; S147-K177 WeakPolarHBondContact OG-CD 3.5Å; S147-K177 WeakPolarHBondContact OG-CE 3.04Å; S147-K177 PolarHBondContact OG-NZ 3Å
148	A	83.3	Confident	84.5	Confident	51 Å²	51	15 Å²	15	42%	0.421	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-29.7	-175.2	0	0	0	0	0	113	D145 E151	D145-A148 HydrophobicContact CB-CB 4.23Å; D145-A148 PolarHBondContact O-N 2.82Å; A148-E151 HydrophobicContact CB-CG 4.17Å
149	G	85.1	Confident	83.7	Confident	2 Å²	2	18.2 Å²	18.2	2%	0.021	11%	0.109	C	C	.	.			trans	76.6	-144.1	-174.1	0	0	0	0	0	112.7	D145 E151	D145-G149 PolarHBondContact O-N 2.86Å; G149-E151 PolarHBondContact O-N 2.92Å
150	V	83.5	Confident	82.8	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.006	11%	0.11	C	C	.	.	S	Bend	trans	-82.5	117.7	-179.8	175.7	0	0	0	0	110.2	L144 S188 I189 K192 M193	L144-V150 HydrophobicContact CD1-CG2 3.79Å; L144-V150 HydrophobicContact CD2-CG2 4.26Å; V150-S188 PolarHBondContact N-OG 2.95Å; V150-S188 VanDerWaalsContact N-OG 3.07Å; V150-I189 HydrophobicContact CG2-CB 4.37Å; V150-I189 HydrophobicContact CG2-CG1 3.64Å; V150-K192 HydrophobicContact CB-CB 4.33Å; V150-K192 HydrophobicContact CB-CD 4.03Å; V150-K192 HydrophobicContact CG1-CB 4.06Å; V150-K192 HydrophobicContact CG1-CD 4.16Å; V150-K192 WeakPolarHBondContact O-CD 3.16Å; V150-K192 PolarHBondContact O-NZ 2.85Å; V150-M193 HydrophobicContact CB-CE 4.44Å; V150-M193 HydrophobicContact CG1-CE 3.71Å; V150-M193 HydrophobicContact CG1-CG 4.27Å; V150-M193 HydrophobicContact CG2-CE 3.84Å; V150-M193 HydrophobicContact CG2-CG 4.42Å; V150-M193 HydrophobicContact CG2-SD 4.32Å
151	E	79.7	Confident	82.2	Confident	50 Å²	50	18.4 Å²	18.4	23%	0.234	11%	0.11	C	C	.	.			trans	-98.7	160.2	178.8	-64.5	172.8	112.7	0	0	111.8	H56 A148 G149 Q153 T154 L155	H56-E151 HydrophobicContact CB-CB 4.14Å; H56-E151 WeakPolarHBondContact CB-OE2 3.4Å; H56-E151 IonicContact CD2-OE1 2.71Å; H56-E151 PolarHBondContact CD2-OE1 3.18Å; H56-E151 IonicContact CD2-OE2 3.09Å; H56-E151 PolarHBondContact CD2-OE2 2.86Å; H56-E151 IonicContact CG-OE1 3.29Å; H56-E151 IonicContact CG-OE2 3.2Å; H56-E151 VanDerWaalsContact CG-OE2 3.22Å; H56-E151 IonicContact NE2-OE1 3.27Å; A148-E151 HydrophobicContact CB-CG 4.17Å; G149-E151 PolarHBondContact O-N 2.92Å; E151-Q153 PolarHBondContact O-N 3.14Å; E151-T154 WeakPolarHBondContact O-CB 3.26Å; E151-T154 PolarHBondContact O-N 3.19Å; E151-T154 VanDerWaalsContact O-N 3.11Å; E151-L155 PolarHBondContact O-N 3.46Å
152	V	68.3	Low	81.5	Confident	39 Å²	39	21.4 Å²	21.4	24%	0.236	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-38.4	-169.3	178.7	0	0	0	0	113.2	T154 L155 A156 T665 S723	V152-T154 VanDerWaalsContact C-N 3.35Å; V152-L155 WeakPolarHBondContact O-CB 3.27Å; V152-L155 PolarHBondContact O-N 2.78Å; V152-A156 PolarHBondContact O-N 3.35Å; V152-T665 HydrophobicContact CG2-CG2 3.76Å; V152-S723 VanDerWaalsContact CB-OG 3.29Å; V152-S723 WeakPolarHBondContact CB-OG 3.1Å; V152-S723 WeakPolarHBondContact CG1-OG 3.41Å; V152-S723 WeakPolarHBondContact CG2-OG 3.33Å
153	Q	70.3	Confident	80.5	Confident	37 Å²	37	27.4 Å²	27.4	17%	0.173	16%	0.16	C	C	.	.	H	α-helix	trans	-67.9	-37.4	175.7	-61.9	174.9	-7.2	0	0	111.6	H56 G122 V124 E151 L155 A156 V157	H56-Q153 PolarHBondContact CE1-OE1 3.35Å; H56-Q153 WeakPolarHBondContact ND1-CB 3.4Å; H56-Q153 PolarHBondContact ND1-OE1 3.39Å; G122-Q153 PolarHBondContact O-OE1 3.14Å; V124-Q153 HydrophobicContact CG2-CG 4.48Å; E151-Q153 PolarHBondContact O-N 3.14Å; Q153-L155 VanDerWaalsContact C-N 3.28Å; Q153-L155 PolarHBondContact O-N 2.64Å; Q153-A156 PolarHBondContact O-N 3.45Å; Q153-V157 PolarHBondContact O-N 3.48Å; Q153-V157 VanDerWaalsContact O-N 3.11Å
154	T	79.6	Confident	79.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.9	-41.1	173.5	-53.7	0	0	0	0	110.8	I54 H56 I142 L144 E151 V152 W158 M193	I54-T154 HydrophobicContact CG2-CG2 4.28Å; H56-T154 PolarHBondContact N-OG1 3.32Å; I142-T154 HydrophobicContact CG2-CG2 3.77Å; L144-T154 HydrophobicContact CD2-CG2 3.67Å; E151-T154 WeakPolarHBondContact O-CB 3.26Å; E151-T154 PolarHBondContact O-N 3.19Å; E151-T154 VanDerWaalsContact O-N 3.11Å; V152-T154 VanDerWaalsContact C-N 3.35Å; T154-W158 WeakPolarHBondContact O-CB 3.39Å; T154-W158 PolarHBondContact O-N 2.79Å; T154-M193 HydrophobicContact CG2-CE 4.02Å
155	L	77.1	Confident	79.3	Confident	44 Å²	44	35.6 Å²	35.6	23%	0.23	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-40.2	175.6	-172.8	64.2	0	0	0	112.2	E151 V152 Q153 V157 W158 N159 K192 M193	E151-L155 PolarHBondContact O-N 3.46Å; V152-L155 WeakPolarHBondContact O-CB 3.27Å; V152-L155 PolarHBondContact O-N 2.78Å; Q153-L155 VanDerWaalsContact C-N 3.28Å; Q153-L155 PolarHBondContact O-N 2.64Å; L155-V157 PolarHBondContact O-N 3.24Å; L155-W158 PolarHBondContact O-N 2.83Å; L155-N159 WeakPolarHBondContact O-CB 3.36Å; L155-N159 PolarHBondContact O-N 3.48Å; L155-N159 PolarHBondContact O-ND2 2.97Å; L155-K192 WeakPolarHBondContact CD1-O 3.48Å; L155-M193 HydrophobicContact CD1-CG 4.31Å
156	A	69.1	Low	79.1	Confident	16 Å²	16	35.4 Å²	35.4	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-45.5	178.4	0	0	0	0	0	112.4	V152 Q153 Q160	V152-A156 PolarHBondContact O-N 3.35Å; Q153-A156 PolarHBondContact O-N 3.45Å; A156-Q160 PolarHBondContact O-N 3.25Å
157	V	77.1	Confident	79.2	Confident	10 Å²	10	35.4 Å²	35.4	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-72.1	-37.1	176.4	178.7	0	0	0	0	111.3	I54 V130 L134 Q153 L155 N159 Q160 A161	I54-V157 HydrophobicContact CB-CG1 4.06Å; I54-V157 HydrophobicContact CD1-CG1 3.97Å; I54-V157 HydrophobicContact CG1-CG1 3.69Å; I54-V157 HydrophobicContact CG2-CB 3.72Å; I54-V157 HydrophobicContact CG2-CG1 3.42Å; I54-V157 VanDerWaalsContact CG2-CG1 3.42Å; V130-V157 HydrophobicContact CG1-CB 4.36Å; V130-V157 HydrophobicContact CG1-CG1 3.49Å; V130-V157 VanDerWaalsContact CG1-CG1 3.49Å; V130-V157 HydrophobicContact CG1-CG2 4.13Å; L134-V157 HydrophobicContact CD1-CG1 4.27Å; Q153-V157 PolarHBondContact O-N 3.48Å; Q153-V157 VanDerWaalsContact O-N 3.11Å; L155-V157 PolarHBondContact O-N 3.24Å; V157-N159 VanDerWaalsContact C-N 3.34Å; V157-N159 PolarHBondContact O-N 3.42Å; V157-Q160 WeakPolarHBondContact O-CB 3.37Å; V157-Q160 PolarHBondContact O-N 3.12Å; V157-Q160 VanDerWaalsContact O-N 3.15Å; V157-A161 PolarHBondContact O-N 3.38Å
158	W	81.9	Confident	79.5	Confident	6 Å²	6	33.5 Å²	33.5	2%	0.023	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-45.9	174	175.1	-116.6	0	0	0	111.7	I142 T154 L155 Q160 A161 V162 A168 M193 I195 L297	I142-W158 HydrophobicContact CD1-CD2 4.03Å; I142-W158 HydrophobicContact CD1-CE3 3.39Å; I142-W158 HydrophobicContact CD1-CH2 4.43Å; I142-W158 HydrophobicContact CD1-CZ3 3.65Å; I142-W158 HydrophobicContact CG1-CE3 4.28Å; T154-W158 WeakPolarHBondContact O-CB 3.39Å; T154-W158 PolarHBondContact O-N 2.79Å; L155-W158 PolarHBondContact O-N 2.83Å; W158-Q160 VanDerWaalsContact C-N 3.26Å; W158-Q160 PolarHBondContact O-N 2.63Å; W158-A161 HydrophobicContact CE3-CB 4.11Å; W158-A161 HydrophobicContact CZ3-CB 4.28Å; W158-A161 CarbonylContact O-C 3.57Å; W158-A161 WeakPolarHBondContact O-CA 3.43Å; W158-A161 WeakPolarHBondContact O-CB 3.28Å; W158-A161 PolarHBondContact O-N 3.39Å; W158-V162 HydrophobicContact CD2-CG2 4.03Å; W158-V162 VanDerWaalsContact CE2-CG2 3.49Å; W158-V162 HydrophobicContact CG-CG2 4.46Å; W158-V162 HydrophobicContact CH2-CG2 4.21Å; W158-V162 HydrophobicContact CZ2-CG2 3.6Å; W158-V162 WeakPolarHBondContact O-CG2 3.47Å; W158-V162 PolarHBondContact O-N 3.15Å; W158-A168 HydrophobicContact CH2-CB 3.81Å; W158-A168 HydrophobicContact CZ3-CB 3.43Å; W158-A168 VanDerWaalsContact CZ3-CB 3.43Å; W158-M193 HydrophobicContact CB-CE 4.24Å; W158-M193 HydrophobicContact CD2-SD 4.43Å; W158-M193 HydrophobicContact CG-CE 4.14Å; W158-M193 HydrophobicContact CG-CG 4.5Å; W158-M193 HydrophobicContact CG-SD 4.23Å; W158-I195 HydrophobicContact CH2-CD1 4.5Å; W158-I195 HydrophobicContact CZ2-CD1 3.45Å; W158-I195 VanDerWaalsContact CZ2-CD1 3.45Å; W158-L297 HydrophobicContact CH2-CD2 3.92Å; W158-L297 HydrophobicContact CZ2-CD1 4.38Å; W158-L297 HydrophobicContact CZ2-CD2 4.35Å
159	N	73.8	Confident	80.1	Confident	72 Å²	72	31 Å²	31	39%	0.385	16%	0.161	S	C	.	.	H	α-helix	trans	-60.5	-35.6	177	-70.8	-18	0	0	0	112.1	L155 V157 V162 N163	L155-N159 WeakPolarHBondContact O-CB 3.36Å; L155-N159 PolarHBondContact O-N 3.48Å; L155-N159 PolarHBondContact O-ND2 2.97Å; V157-N159 VanDerWaalsContact C-N 3.34Å; V157-N159 PolarHBondContact O-N 3.42Å; N159-V162 PolarHBondContact O-N 3.16Å; N159-N163 VanDerWaalsContact O-CG 3.31Å; N159-N163 PolarHBondContact O-N 2.99Å; N159-N163 VanDerWaalsContact O-N 3.12Å; N159-N163 PolarHBondContact O-ND2 2.85Å
160	Q	72.9	Confident	80.6	Confident	5 Å²	5	31 Å²	31	2%	0.023	16%	0.16	C	C	.	.	H	α-helix	trans	-65.7	-42.8	171.3	-68.6	176.6	-20.2	0	0	111.8	V130 E131 L134 A156 V157 W158 V162 N163 F164	V130-Q160 VanDerWaalsContact CG1-OE1 3.26Å; E131-Q160 HydrophobicContact CG-CG 4.27Å; E131-Q160 PolarHBondContact OE1-NE2 2.89Å; E131-Q160 VanDerWaalsContact OE1-NE2 3.09Å; L134-Q160 HydrophobicContact CD1-CB 3.74Å; A156-Q160 PolarHBondContact O-N 3.25Å; V157-Q160 WeakPolarHBondContact O-CB 3.37Å; V157-Q160 PolarHBondContact O-N 3.12Å; V157-Q160 VanDerWaalsContact O-N 3.15Å; W158-Q160 VanDerWaalsContact C-N 3.26Å; W158-Q160 PolarHBondContact O-N 2.63Å; Q160-V162 VanDerWaalsContact C-N 3.3Å; Q160-V162 PolarHBondContact O-N 3.3Å; Q160-N163 WeakPolarHBondContact O-CB 3.35Å; Q160-N163 PolarHBondContact O-N 2.75Å; Q160-N163 VanDerWaalsContact O-N 3.14Å; Q160-F164 WeakPolarHBondContact O-CD2 3.47Å; Q160-F164 PolarHBondContact O-N 2.85Å
161	A	81.1	Confident	81.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-36.4	176.7	0	0	0	0	0	112.4	I54 L134 V157 W158 F164 K165 L166	I54-A161 HydrophobicContact CD1-CB 3.75Å; L134-A161 HydrophobicContact CD1-CB 4.15Å; L134-A161 HydrophobicContact CD2-CB 4.28Å; V157-A161 PolarHBondContact O-N 3.38Å; W158-A161 HydrophobicContact CE3-CB 4.11Å; W158-A161 HydrophobicContact CZ3-CB 4.28Å; W158-A161 CarbonylContact O-C 3.57Å; W158-A161 WeakPolarHBondContact O-CA 3.43Å; W158-A161 WeakPolarHBondContact O-CB 3.28Å; W158-A161 PolarHBondContact O-N 3.39Å; A161-F164 CarbonylContact O-C 3.55Å; A161-F164 PolarHBondContact O-N 2.81Å; A161-K165 PolarHBondContact O-N 3.01Å; A161-K165 VanDerWaalsContact O-N 3.12Å; A161-L166 HydrophobicContact CB-CB 4.5Å; A161-L166 HydrophobicContact CB-CD1 4.16Å; A161-L166 PolarHBondContact O-N 2.8Å; A161-L166 VanDerWaalsContact O-N 3.11Å
162	V	79.5	Confident	81.9	Confident	62 Å²	62	28.5 Å²	28.5	38%	0.376	15%	0.149	S	C	.	.	H	α-helix	trans	-62.1	-42	172.8	172.8	0	0	0	0	111	W158 N159 Q160 F164 K165	W158-V162 HydrophobicContact CD2-CG2 4.03Å; W158-V162 VanDerWaalsContact CE2-CG2 3.49Å; W158-V162 HydrophobicContact CG-CG2 4.46Å; W158-V162 HydrophobicContact CH2-CG2 4.21Å; W158-V162 HydrophobicContact CZ2-CG2 3.6Å; W158-V162 WeakPolarHBondContact O-CG2 3.47Å; W158-V162 PolarHBondContact O-N 3.15Å; N159-V162 PolarHBondContact O-N 3.16Å; Q160-V162 VanDerWaalsContact C-N 3.3Å; Q160-V162 PolarHBondContact O-N 3.3Å; V162-F164 VanDerWaalsContact C-N 3.27Å; V162-F164 PolarHBondContact O-N 3.37Å; V162-K165 WeakPolarHBondContact O-CA 3.28Å; V162-K165 PolarHBondContact O-N 3.22Å
163	N	74.1	Confident	83.1	Confident	126 Å²	126	26.8 Å²	26.8	67%	0.674	14%	0.138	S	C	*	.	H	α-helix	trans	-59.8	-37.4	175.8	-68.8	-21.3	0	0	0	112.3	N159 Q160 K165	N159-N163 VanDerWaalsContact O-CG 3.31Å; N159-N163 PolarHBondContact O-N 2.99Å; N159-N163 VanDerWaalsContact O-N 3.12Å; N159-N163 PolarHBondContact O-ND2 2.85Å; Q160-N163 WeakPolarHBondContact O-CB 3.35Å; Q160-N163 PolarHBondContact O-N 2.75Å; Q160-N163 VanDerWaalsContact O-N 3.14Å; N163-K165 VanDerWaalsContact C-N 3.25Å; N163-K165 PolarHBondContact O-N 2.84Å
164	F	77.4	Confident	84.1	Confident	67 Å²	67	27.4 Å²	27.4	29%	0.294	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.6	174.3	-68.4	-67.8	0	0	0	114	E131 L134 R135 Q160 A161 V162 L166	E131-F164 HydrophobicContact CB-CE2 4.44Å; E131-F164 HydrophobicContact CG-CE2 4.43Å; L134-F164 HydrophobicContact CB-CD2 3.89Å; L134-F164 HydrophobicContact CB-CE2 4.26Å; R135-F164 HydrophobicContact CB-CD1 4.33Å; R135-F164 HydrophobicContact CB-CE1 3.96Å; R135-F164 HydrophobicContact CB-CZ 4.19Å; R135-F164 HydrophobicContact CG-CD1 4.45Å; R135-F164 HydrophobicContact CG-CE1 4.06Å; Q160-F164 WeakPolarHBondContact O-CD2 3.47Å; Q160-F164 PolarHBondContact O-N 2.85Å; A161-F164 CarbonylContact O-C 3.55Å; A161-F164 PolarHBondContact O-N 2.81Å; V162-F164 VanDerWaalsContact C-N 3.27Å; V162-F164 PolarHBondContact O-N 3.37Å; F164-L166 VanDerWaalsContact C-N 3.3Å; F164-L166 HydrophobicContact CB-CD1 4.28Å; F164-L166 HydrophobicContact CB-CG 3.96Å; F164-L166 PolarHBondContact O-N 3.36Å
165	K	83.1	Confident	84.6	Confident	105 Å²	105	28.2 Å²	28.2	46%	0.457	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	36.2	-179.2	-58.3	177.7	177.1	-179.6	0	112.7	A161 V162 N163 P167 R294 R330	A161-K165 PolarHBondContact O-N 3.01Å; A161-K165 VanDerWaalsContact O-N 3.12Å; V162-K165 WeakPolarHBondContact O-CA 3.28Å; V162-K165 PolarHBondContact O-N 3.22Å; N163-K165 VanDerWaalsContact C-N 3.25Å; N163-K165 PolarHBondContact O-N 2.84Å; K165-P167 WeakPolarHBondContact O-CD 3.31Å; K165-R294 WeakPolarHBondContact O-CD 3.4Å; K165-R294 PolarHBondContact O-NH1 3.06Å; K165-R330 VanDerWaalsContact CD-NH2 3.31Å
166	L	87.4	Confident	85.1	Confident	6 Å²	6	27.8 Å²	27.8	3%	0.031	14%	0.143	C	C	.	.			trans	-76.9	129	-179.6	-63.2	175.1	0	0	0	111.6	L134 V137 A161 F164 R294	L134-L166 HydrophobicContact CB-CD1 4.01Å; L134-L166 HydrophobicContact CD2-CD1 3.84Å; L134-L166 HydrophobicContact CG-CD1 4.47Å; L134-L166 WeakPolarHBondContact O-CD1 3.48Å; V137-L166 HydrophobicContact CG2-CD1 3.98Å; V137-L166 HydrophobicContact CG2-CD2 4.4Å; V137-L166 WeakPolarHBondContact O-CD2 3.29Å; A161-L166 HydrophobicContact CB-CB 4.5Å; A161-L166 HydrophobicContact CB-CD1 4.16Å; A161-L166 PolarHBondContact O-N 2.8Å; A161-L166 VanDerWaalsContact O-N 3.11Å; F164-L166 VanDerWaalsContact C-N 3.3Å; F164-L166 HydrophobicContact CB-CD1 4.28Å; F164-L166 HydrophobicContact CB-CG 3.96Å; F164-L166 PolarHBondContact O-N 3.36Å; L166-R294 WeakPolarHBondContact O-CD 3.24Å
167	P	92.4	Very high	85.8	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.013	16%	0.156	C	C	.	.			trans	-62.4	143.6	161.9	-25	38.8	0	0	0	110.9	D138 G139 A140 K165 T291 P322	D138-P167 WeakPolarHBondContact O-CD 3.19Å; G139-P167 CarbonylContact C-O 3.55Å; G139-P167 WeakPolarHBondContact CA-O 3.27Å; A140-P167 PolarHBondContact N-O 3.1Å; K165-P167 WeakPolarHBondContact O-CD 3.31Å; P167-T291 HydrophobicContact CB-CG2 4.24Å; P167-T291 WeakPolarHBondContact CB-O 3.36Å; P167-P322 HydrophobicContact CB-CG 4.26Å; P167-P322 HydrophobicContact CG-CG 3.93Å
168	A	93.4	Very high	85.8	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.017	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.3	-177.9	0	0	0	0	0	113.7	A140 I142 W158 L297 P298	A140-A168 HydrophobicContact CB-CB 4.14Å; A140-A168 CarbonylContact O-C 3.49Å; A140-A168 WeakPolarHBondContact O-CA 3.49Å; I142-A168 HydrophobicContact CD1-CB 4.03Å; I142-A168 HydrophobicContact CG1-CB 4.27Å; W158-A168 HydrophobicContact CH2-CB 3.81Å; W158-A168 HydrophobicContact CZ3-CB 3.43Å; W158-A168 VanDerWaalsContact CZ3-CB 3.43Å; A168-L297 HydrophobicContact CB-CD2 3.84Å; A168-L297 WeakPolarHBondContact O-CD2 3.42Å; A168-P298 WeakPolarHBondContact O-CD 3.22Å
169	L	94.8	Very high	85.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.5	174.8	-174.8	128.2	0	0	0	108.5	A140 L141 I142 P298 L300 L313 A316 Y320 L321	A140-L169 PolarHBondContact O-N 3.06Å; L141-L169 CarbonylContact C-O 3.59Å; L141-L169 WeakPolarHBondContact CA-O 3.44Å; L141-L169 HydrophobicContact CD1-CB 4.47Å; L141-L169 HydrophobicContact CD1-CD2 3.53Å; L141-L169 WeakPolarHBondContact CD1-O 3.12Å; I142-L169 PolarHBondContact N-O 3.44Å; L169-P298 HydrophobicContact CD1-CB 4.18Å; L169-L300 HydrophobicContact CD1-CD1 3.82Å; L169-L300 HydrophobicContact CD2-CD1 3.68Å; L169-L300 HydrophobicContact CG-CD1 3.97Å; L169-L313 HydrophobicContact CD2-CD1 3.45Å; L169-L313 VanDerWaalsContact CD2-CD1 3.45Å; L169-A316 HydrophobicContact CD1-CB 3.86Å; L169-Y320 HydrophobicContact CD1-CD2 3.9Å; L169-L321 HydrophobicContact CB-CD2 4.02Å; L169-L321 HydrophobicContact CB-CG 4.34Å
170	V	95.5	Very high	86.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.3	-178.8	-179.1	0	0	0	0	110.2	I142 L144 L172 I189 L297 P298 V299 L300	I142-V170 HydrophobicContact CB-CG2 4.2Å; I142-V170 HydrophobicContact CD1-CG2 4.19Å; I142-V170 CarbonylContact O-C 3.21Å; I142-V170 WeakPolarHBondContact O-CA 3.41Å; L144-V170 HydrophobicContact CD1-CG1 3.74Å; L144-V170 HydrophobicContact CG-CG1 4.18Å; V170-L172 HydrophobicContact CG1-CD2 3.99Å; V170-I189 HydrophobicContact CG1-CD1 4Å; V170-L297 HydrophobicContact CG2-CB 4.07Å; V170-L297 HydrophobicContact CG2-CD1 4.22Å; V170-P298 PolarHBondContact N-O 2.88Å; V170-V299 HydrophobicContact CB-CB 4.5Å; V170-V299 HydrophobicContact CB-CG1 4.36Å; V170-V299 HydrophobicContact CB-CG2 4.12Å; V170-V299 HydrophobicContact CG1-CG1 4.25Å; V170-V299 WeakPolarHBondContact O-CA 3.37Å; V170-L300 PolarHBondContact O-N 3.1Å
171	F	95.8	Very high	86.8	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.4	170.9	-178.2	-116.9	0	0	0	110.4	T64 L141 I142 I143 L144 N173 L300 L313	T64-F171 HydrophobicContact CG2-CD1 4.28Å; T64-F171 HydrophobicContact CG2-CE1 4.27Å; L141-F171 HydrophobicContact CD1-CB 3.94Å; I142-F171 PolarHBondContact O-N 3.09Å; I143-F171 WeakPolarHBondContact CA-O 3.5Å; L144-F171 PolarHBondContact N-O 3.2Å; F171-N173 HydrophobicContact CD1-CB 4.01Å; F171-N173 HydrophobicContact CE1-CB 3.87Å; F171-N173 PolarHBondContact O-N 3.32Å; F171-L300 WeakPolarHBondContact CA-O 3.2Å; F171-L300 HydrophobicContact CD2-CB 4.32Å; F171-L313 HydrophobicContact CB-CD1 4.02Å; F171-L313 HydrophobicContact CB-CD2 4.14Å; F171-L313 HydrophobicContact CD1-CD2 3.86Å; F171-L313 HydrophobicContact CD2-CB 4.42Å; F171-L313 HydrophobicContact CD2-CD1 4.18Å; F171-L313 HydrophobicContact CD2-CD2 3.83Å; F171-L313 HydrophobicContact CD2-CG 4.38Å; F171-L313 HydrophobicContact CE1-CD2 4.17Å; F171-L313 HydrophobicContact CE2-CD2 4.14Å; F171-L313 HydrophobicContact CG-CD1 4.24Å; F171-L313 HydrophobicContact CG-CD2 3.68Å; F171-L313 HydrophobicContact CZ-CD2 4.3Å
172	L	95.1	Very high	87.2	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	102.2	171.8	-52.3	-178.1	0	0	0	108.6	L144 A146 V170 I182 C185 I189 V299 L300 F301 G302	L144-L172 HydrophobicContact CB-CD2 3.96Å; L144-L172 HydrophobicContact CD1-CD2 3.93Å; L144-L172 HydrophobicContact CG-CD2 4.45Å; A146-L172 HydrophobicContact CB-CB 4.33Å; V170-L172 HydrophobicContact CG1-CD2 3.99Å; L172-I182 HydrophobicContact CD1-CB 4.43Å; L172-I182 HydrophobicContact CD1-CG1 4.33Å; L172-I182 HydrophobicContact CD1-CG2 4.01Å; L172-C185 HydrophobicContact CD1-CB 3.94Å; L172-C185 HydrophobicContact CD2-CB 3.87Å; L172-I189 HydrophobicContact CD2-CD1 4.47Å; L172-V299 HydrophobicContact CD1-CG1 3.85Å; L172-V299 HydrophobicContact CD2-CG1 4.29Å; L172-V299 HydrophobicContact CG-CG1 3.75Å; L172-L300 PolarHBondContact N-O 2.93Å; L172-F301 HydrophobicContact CB-CB 3.92Å; L172-F301 CarbonylContact O-C 3.58Å; L172-F301 VanDerWaalsContact O-CA 3.29Å; L172-F301 WeakPolarHBondContact O-CA 3.46Å; L172-G302 PolarHBondContact O-N 3.25Å
173	N	94.4	Very high	87.7	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	169.3	-178.9	-167.5	22.8	0	0	0	111.5	A59 I143 L144 A146 F171 I175 G302 A304	A59-N173 PolarHBondContact O-ND2 3.32Å; I143-N173 HydrophobicContact CG2-CB 3.82Å; L144-N173 PolarHBondContact O-N 2.92Å; A146-N173 WeakPolarHBondContact CB-O 3.5Å; A146-N173 PolarHBondContact N-O 2.79Å; F171-N173 HydrophobicContact CD1-CB 4.01Å; F171-N173 HydrophobicContact CE1-CB 3.87Å; F171-N173 PolarHBondContact O-N 3.32Å; N173-I175 VanDerWaalsContact C-N 3.28Å; N173-I175 PolarHBondContact O-N 2.85Å; N173-G302 CarbonylContact C-O 3.48Å; N173-G302 WeakPolarHBondContact CA-O 3.33Å; N173-A304 WeakPolarHBondContact OD1-CB 3.44Å; N173-A304 PolarHBondContact OD1-N 3.43Å
174	K	90.9	Very high	88.4	Confident	49 Å²	49	45.4 Å²	45.4	21%	0.213	24%	0.24	C	C	.	.			trans	57.3	36.4	177.9	-53.9	-171.6	-174	176.9	0	114	D58 D145 D176 K177 G302	D58-K174 WeakPolarHBondContact O-CE 3.36Å; D58-K174 PolarHBondContact O-NZ 2.84Å; D145-K174 IonicContact OD2-NZ 3.95Å; K174-D176 WeakPolarHBondContact CA-OD1 3.41Å; K174-D176 PolarHBondContact O-N 3.31Å; K174-K177 HydrophobicContact CB-CB 4.36Å; K174-K177 VanDerWaalsContact O-CB 3.26Å; K174-K177 WeakPolarHBondContact O-CB 3.29Å; K174-K177 PolarHBondContact O-N 2.97Å; K174-G302 PolarHBondContact N-O 3Å
175	I	90.6	Very high	89	Confident	17 Å²	17	42.3 Å²	42.3	9%	0.087	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.6	176	-157.3	160.5	0	0	0	113.5	N173 K177 A180 I182 V211 F301 G302	N173-I175 VanDerWaalsContact C-N 3.28Å; N173-I175 PolarHBondContact O-N 2.85Å; I175-K177 VanDerWaalsContact C-N 3.32Å; I175-A180 HydrophobicContact CG1-CB 4.29Å; I175-I182 HydrophobicContact CD1-CD1 3.67Å; I175-I182 HydrophobicContact CD1-CG1 3.92Å; I175-V211 HydrophobicContact CD1-CB 4.2Å; I175-V211 HydrophobicContact CD1-CG1 4.34Å; I175-V211 HydrophobicContact CD1-CG2 3.61Å; I175-V211 HydrophobicContact CG1-CB 4.38Å; I175-V211 HydrophobicContact CG1-CG2 3.82Å; I175-F301 HydrophobicContact CD1-CB 4Å; I175-F301 HydrophobicContact CD1-CD2 3.57Å; I175-F301 HydrophobicContact CD1-CE2 4.36Å; I175-F301 HydrophobicContact CD1-CG 3.95Å; I175-G302 WeakPolarHBondContact CG2-O 3.43Å; I175-G302 PolarHBondContact N-O 3.48Å
176	D	86.3	Confident	89.5	Confident	36 Å²	36	38.3 Å²	38.3	19%	0.193	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-7	175.5	64.8	-59.1	0	0	0	114.3	K174 S303 R306	K174-D176 WeakPolarHBondContact CA-OD1 3.41Å; K174-D176 PolarHBondContact O-N 3.31Å; D176-S303 VanDerWaalsContact CG-OG 3.24Å; D176-S303 WeakPolarHBondContact OD1-CB 3.36Å; D176-S303 PolarHBondContact OD1-OG 2.92Å; D176-R306 IonicContact OD2-CZ 3.46Å; D176-R306 IonicContact OD2-NE 2.84Å; D176-R306 PolarHBondContact OD2-NE 2.96Å; D176-R306 IonicContact OD2-NH2 3.42Å; D176-R306 PolarHBondContact OD2-NH2 2.92Å
177	K	84.6	Confident	89.7	Confident	97 Å²	97	40.1 Å²	40.1	42%	0.422	22%	0.224	S	C	.	.	S	Bend	trans	-76.7	139.7	177.8	-169.6	179.1	176.2	-164.3	0	110.7	D145 S147 K174 I175 G179 A180	D145-K177 IonicContact OD1-NZ 3.79Å; D145-K177 IonicContact OD2-NZ 2.7Å; D145-K177 PolarHBondContact OD2-NZ 2.73Å; S147-K177 WeakPolarHBondContact OG-CD 3.5Å; S147-K177 WeakPolarHBondContact OG-CE 3.04Å; S147-K177 PolarHBondContact OG-NZ 3Å; K174-K177 HydrophobicContact CB-CB 4.36Å; K174-K177 VanDerWaalsContact O-CB 3.26Å; K174-K177 WeakPolarHBondContact O-CB 3.29Å; K174-K177 PolarHBondContact O-N 2.97Å; I175-K177 VanDerWaalsContact C-N 3.32Å; K177-G179 PolarHBondContact O-N 3.2Å; K177-A180 WeakPolarHBondContact O-CB 3.46Å; K177-A180 PolarHBondContact O-N 3.04Å; K177-A180 VanDerWaalsContact O-N 3.09Å
178	H	77.9	Confident	89.4	Confident	183 Å²	183	40.6 Å²	40.6	85%	0.847	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	121.6	170.8	-69.7	-69.7	0	0	0	110
179	G	79.3	Confident	89.2	Confident	60 Å²	60	40.5 Å²	40.5	62%	0.619	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	102.2	-2.2	-175.6	0	0	0	0	0	114.9	K177 N181	K177-G179 PolarHBondContact O-N 3.2Å; G179-N181 PolarHBondContact O-N 3.41Å
180	A	83.3	Confident	89	Confident	32 Å²	32	46.8 Å²	46.8	26%	0.264	25%	0.25	S	C	.	.			trans	-60.2	124.3	172.3	0	0	0	0	0	111.1	A146 I175 K177	A146-A180 HydrophobicContact CB-CB 3.91Å; A146-A180 WeakPolarHBondContact O-CA 3.16Å; I175-A180 HydrophobicContact CG1-CB 4.29Å; K177-A180 WeakPolarHBondContact O-CB 3.46Å; K177-A180 PolarHBondContact O-N 3.04Å; K177-A180 VanDerWaalsContact O-N 3.09Å
181	N	86.7	Confident	88.5	Confident	57 Å²	57	52 Å²	52	31%	0.305	27%	0.274	S	S	.	.			trans	-140.6	107.5	-179.7	-176.7	-22.5	0	0	0	110.2	A146 G179 D183 N184 C185	A146-N181 PolarHBondContact O-N 2.97Å; G179-N181 PolarHBondContact O-N 3.41Å; N181-D183 VanDerWaalsContact C-N 3.34Å; N181-D183 PolarHBondContact O-N 2.76Å; N181-D183 PolarHBondContact OD1-N 3.4Å; N181-N184 HydrophobicContact CB-CB 4.04Å; N181-N184 VanDerWaalsContact ND2-CG 3.31Å; N181-N184 PolarHBondContact ND2-ND2 2.94Å; N181-N184 PolarHBondContact ND2-OD1 2.88Å; N181-N184 PolarHBondContact O-N 2.92Å; N181-N184 PolarHBondContact OD1-N 3.17Å; N181-N184 VanDerWaalsContact OD1-N 3.16Å; N181-C185 PolarHBondContact O-N 2.63Å; N181-C185 VanDerWaalsContact O-N 3.14Å; N181-C185 PolarHBondContact O-SG 3.37Å; N181-C185 VanDerWaalsContact O-SG 3.35Å
182	I	89.9	Confident	87.8	Confident	19 Å²	19	55.2 Å²	55.2	10%	0.097	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-44.6	-179.5	-65.2	169.1	0	0	0	110.8	L172 I175 N184 C185 L186 L199 P203 F301	L172-I182 HydrophobicContact CD1-CB 4.43Å; L172-I182 HydrophobicContact CD1-CG1 4.33Å; L172-I182 HydrophobicContact CD1-CG2 4.01Å; I175-I182 HydrophobicContact CD1-CD1 3.67Å; I175-I182 HydrophobicContact CD1-CG1 3.92Å; I182-N184 VanDerWaalsContact C-N 3.34Å; I182-N184 PolarHBondContact O-N 3.38Å; I182-C185 WeakPolarHBondContact O-CB 3.35Å; I182-C185 PolarHBondContact O-N 2.88Å; I182-C185 VanDerWaalsContact O-N 3.13Å; I182-L186 HydrophobicContact CG2-CD1 3.85Å; I182-L186 HydrophobicContact CG2-CG 4.09Å; I182-L186 VanDerWaalsContact O-CG 3.32Å; I182-L186 WeakPolarHBondContact O-CG 3.26Å; I182-L186 PolarHBondContact O-N 3.11Å; I182-L199 HydrophobicContact CG2-CD1 4.28Å; I182-L199 HydrophobicContact CG2-CD2 4.46Å; I182-P203 HydrophobicContact CD1-CB 3.99Å; I182-P203 HydrophobicContact CD1-CG 3.86Å; I182-F301 HydrophobicContact CD1-CB 4.48Å; I182-F301 HydrophobicContact CD1-CD1 3.78Å; I182-F301 HydrophobicContact CD1-CD2 4.32Å; I182-F301 HydrophobicContact CD1-CE1 4.06Å; I182-F301 HydrophobicContact CD1-CG 3.93Å; I182-F301 HydrophobicContact CD1-CZ 4.47Å
183	D	89.9	Confident	87.2	Confident	112 Å²	112	55.8 Å²	55.8	60%	0.599	29%	0.291	S	S	*	.	H	α-helix	trans	-65.6	-38.6	-175.1	-63.5	-41.6	0	0	0	111.9	N181 L186 S187	N181-D183 VanDerWaalsContact C-N 3.34Å; N181-D183 PolarHBondContact O-N 2.76Å; N181-D183 PolarHBondContact OD1-N 3.4Å; D183-L186 PolarHBondContact O-N 3.44Å; D183-S187 WeakPolarHBondContact O-CB 3.38Å; D183-S187 PolarHBondContact O-N 3.38Å; D183-S187 PolarHBondContact O-OG 3.45Å
184	N	88.4	Confident	86.7	Confident	106 Å²	106	60.7 Å²	60.7	57%	0.567	33%	0.326	S	S	*	.	H	α-helix	trans	-64.6	-41.3	173.4	-73.8	3.2	0	0	0	111.2	N181 I182 S187 S188	N181-N184 HydrophobicContact CB-CB 4.04Å; N181-N184 VanDerWaalsContact ND2-CG 3.31Å; N181-N184 PolarHBondContact ND2-ND2 2.94Å; N181-N184 PolarHBondContact ND2-OD1 2.88Å; N181-N184 PolarHBondContact O-N 2.92Å; N181-N184 PolarHBondContact OD1-N 3.17Å; N181-N184 VanDerWaalsContact OD1-N 3.16Å; I182-N184 VanDerWaalsContact C-N 3.34Å; I182-N184 PolarHBondContact O-N 3.38Å; N184-S187 PolarHBondContact O-N 2.77Å; N184-S188 VanDerWaalsContact O-CB 3.29Å; N184-S188 WeakPolarHBondContact O-CB 3.48Å; N184-S188 PolarHBondContact O-N 2.93Å
185	C	90.2	Very high	86.4	Confident	2 Å²	2	60 Å²	60	1%	0.014	32%	0.324	C	S	.	.	H	α-helix	trans	-64.5	-42.5	175.4	-66.1	0	0	0	0	112.4	A146 L172 N181 I182 S187 S188 I189	A146-C185 VanDerWaalsContact C-SG 3.59Å; A146-C185 VanDerWaalsContact CA-SG 3.59Å; A146-C185 PolarHBondContact O-SG 2.71Å; L172-C185 HydrophobicContact CD1-CB 3.94Å; L172-C185 HydrophobicContact CD2-CB 3.87Å; N181-C185 PolarHBondContact O-N 2.63Å; N181-C185 VanDerWaalsContact O-N 3.14Å; N181-C185 PolarHBondContact O-SG 3.37Å; N181-C185 VanDerWaalsContact O-SG 3.35Å; I182-C185 WeakPolarHBondContact O-CB 3.35Å; I182-C185 PolarHBondContact O-N 2.88Å; I182-C185 VanDerWaalsContact O-N 3.13Å; C185-S187 VanDerWaalsContact C-N 3.34Å; C185-S187 PolarHBondContact O-N 2.74Å; C185-S188 WeakPolarHBondContact O-CB 3.36Å; C185-S188 PolarHBondContact O-N 3.46Å; C185-I189 VanDerWaalsContact O-CG1 3.29Å; C185-I189 WeakPolarHBondContact O-CG1 3.44Å; C185-I189 PolarHBondContact O-N 3.2Å
186	L	92.2	Very high	86.3	Confident	22 Å²	22	62 Å²	62	12%	0.115	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-43.2	176.6	-67.2	174.4	0	0	0	111.2	I182 D183 S188 I189 R190 P197 L199 V299	I182-L186 HydrophobicContact CG2-CD1 3.85Å; I182-L186 HydrophobicContact CG2-CG 4.09Å; I182-L186 VanDerWaalsContact O-CG 3.32Å; I182-L186 WeakPolarHBondContact O-CG 3.26Å; I182-L186 PolarHBondContact O-N 3.11Å; D183-L186 PolarHBondContact O-N 3.44Å; L186-S188 VanDerWaalsContact C-N 3.35Å; L186-I189 PolarHBondContact O-N 2.78Å; L186-R190 PolarHBondContact O-N 3.42Å; L186-P197 HydrophobicContact CB-CG 4.19Å; L186-P197 HydrophobicContact CD2-CB 3.72Å; L186-P197 HydrophobicContact CD2-CG 3.96Å; L186-P197 WeakPolarHBondContact O-CG 3.43Å; L186-L199 HydrophobicContact CD1-CB 4.37Å; L186-L199 HydrophobicContact CD1-CD2 4.29Å; L186-V299 HydrophobicContact CD2-CB 4.18Å; L186-V299 HydrophobicContact CD2-CG1 4.07Å; L186-V299 HydrophobicContact CD2-CG2 3.94Å
187	S	91.6	Very high	86.7	Confident	44 Å²	44	60.5 Å²	60.5	31%	0.308	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-43.9	175.1	-53.5	0	0	0	0	110.8	D183 N184 C185 I189 R190 E191	D183-S187 WeakPolarHBondContact O-CB 3.38Å; D183-S187 PolarHBondContact O-N 3.38Å; D183-S187 PolarHBondContact O-OG 3.45Å; N184-S187 PolarHBondContact O-N 2.77Å; C185-S187 VanDerWaalsContact C-N 3.34Å; C185-S187 PolarHBondContact O-N 2.74Å; S187-I189 PolarHBondContact O-N 3.28Å; S187-R190 PolarHBondContact O-N 2.86Å; S187-R190 VanDerWaalsContact O-N 3.14Å; S187-E191 WeakPolarHBondContact O-CB 3.37Å; S187-E191 WeakPolarHBondContact O-CG 3.48Å; S187-E191 PolarHBondContact O-N 3.33Å
188	S	87.3	Confident	87	Confident	12 Å²	12	55.9 Å²	55.9	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-39.3	176.1	-173.2	0	0	0	0	113.2	V150 N184 C185 L186 K192	V150-S188 PolarHBondContact N-OG 2.95Å; V150-S188 VanDerWaalsContact N-OG 3.07Å; N184-S188 VanDerWaalsContact O-CB 3.29Å; N184-S188 WeakPolarHBondContact O-CB 3.48Å; N184-S188 PolarHBondContact O-N 2.93Å; C185-S188 WeakPolarHBondContact O-CB 3.36Å; C185-S188 PolarHBondContact O-N 3.46Å; L186-S188 VanDerWaalsContact C-N 3.35Å; S188-K192 VanDerWaalsContact O-CB 3.26Å; S188-K192 WeakPolarHBondContact O-CB 3.38Å; S188-K192 WeakPolarHBondContact O-CG 3.18Å; S188-K192 PolarHBondContact O-N 2.83Å
189	I	90	Very high	87.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-46.8	173.9	-66.9	162	0	0	0	110.2	L144 V150 V170 L172 C185 L186 S187 M193 P197 L297 V299	L144-I189 HydrophobicContact CD1-CD1 3.88Å; L144-I189 HydrophobicContact CD1-CG1 3.86Å; V150-I189 HydrophobicContact CG2-CB 4.37Å; V150-I189 HydrophobicContact CG2-CG1 3.64Å; V170-I189 HydrophobicContact CG1-CD1 4Å; L172-I189 HydrophobicContact CD2-CD1 4.47Å; C185-I189 VanDerWaalsContact O-CG1 3.29Å; C185-I189 WeakPolarHBondContact O-CG1 3.44Å; C185-I189 PolarHBondContact O-N 3.2Å; L186-I189 PolarHBondContact O-N 2.78Å; S187-I189 PolarHBondContact O-N 3.28Å; I189-M193 HydrophobicContact CG2-CB 4.47Å; I189-M193 HydrophobicContact CG2-SD 4.2Å; I189-M193 WeakPolarHBondContact O-CA 3.27Å; I189-M193 VanDerWaalsContact O-CB 3.26Å; I189-M193 WeakPolarHBondContact O-CB 3.22Å; I189-M193 PolarHBondContact O-N 2.87Å; I189-P197 HydrophobicContact CB-CB 4.34Å; I189-P197 HydrophobicContact CB-CG 4.39Å; I189-P197 HydrophobicContact CD1-CB 4.36Å; I189-P197 HydrophobicContact CG2-CB 3.99Å; I189-P197 HydrophobicContact CG2-CG 4.32Å; I189-L297 HydrophobicContact CG2-CD1 4.08Å; I189-V299 HydrophobicContact CD1-CG2 4.31Å
190	R	89.9	Confident	88.3	Confident	131 Å²	131	46 Å²	46	49%	0.494	25%	0.248	S	C	.	.	H	α-helix	trans	-61.5	-47.6	-179.2	-172.5	-179.8	-67.8	128.6	-0.1	111.8	L186 S187 S194	L186-R190 PolarHBondContact O-N 3.42Å; S187-R190 PolarHBondContact O-N 2.86Å; S187-R190 VanDerWaalsContact O-N 3.14Å; R190-S194 WeakPolarHBondContact O-CA 3.43Å; R190-S194 PolarHBondContact O-N 2.86Å
191	E	85	Confident	88.6	Confident	109 Å²	109	44.8 Å²	44.8	51%	0.509	24%	0.237	S	C	.	.	H	α-helix	trans	-70	-50.7	-178.3	-70.5	167.1	-160.8	0	0	112	S187	S187-E191 WeakPolarHBondContact O-CB 3.37Å; S187-E191 WeakPolarHBondContact O-CG 3.48Å; S187-E191 PolarHBondContact O-N 3.33Å
192	K	81	Confident	88.7	Confident	69 Å²	69	44.1 Å²	44.1	30%	0.3	23%	0.231	S	C	.	.	H	α-helix	trans	-85.6	-32.4	-170.9	-59.9	-173.8	-174.3	175.9	0	113.8	V150 L155 S188	V150-K192 HydrophobicContact CB-CB 4.33Å; V150-K192 HydrophobicContact CB-CD 4.03Å; V150-K192 HydrophobicContact CG1-CB 4.06Å; V150-K192 HydrophobicContact CG1-CD 4.16Å; V150-K192 WeakPolarHBondContact O-CD 3.16Å; V150-K192 PolarHBondContact O-NZ 2.85Å; L155-K192 WeakPolarHBondContact CD1-O 3.48Å; S188-K192 VanDerWaalsContact O-CB 3.26Å; S188-K192 WeakPolarHBondContact O-CB 3.38Å; S188-K192 WeakPolarHBondContact O-CG 3.18Å; S188-K192 PolarHBondContact O-N 2.83Å
193	M	82.6	Confident	88.6	Confident	11 Å²	11	44.3 Å²	44.3	5%	0.054	23%	0.234	C	C	.	.	H	α-helix	trans	-99	-6.5	-179.8	-59.7	-175.2	168.1	0	0	113.4	I142 V150 T154 L155 W158 I189 I195 L297	I142-M193 HydrophobicContact CD1-CE 4.39Å; I142-M193 HydrophobicContact CD1-SD 4.47Å; I142-M193 HydrophobicContact CG2-CE 4.37Å; V150-M193 HydrophobicContact CB-CE 4.44Å; V150-M193 HydrophobicContact CG1-CE 3.71Å; V150-M193 HydrophobicContact CG1-CG 4.27Å; V150-M193 HydrophobicContact CG2-CE 3.84Å; V150-M193 HydrophobicContact CG2-CG 4.42Å; V150-M193 HydrophobicContact CG2-SD 4.32Å; T154-M193 HydrophobicContact CG2-CE 4.02Å; L155-M193 HydrophobicContact CD1-CG 4.31Å; W158-M193 HydrophobicContact CB-CE 4.24Å; W158-M193 HydrophobicContact CD2-SD 4.43Å; W158-M193 HydrophobicContact CG-CE 4.14Å; W158-M193 HydrophobicContact CG-CG 4.5Å; W158-M193 HydrophobicContact CG-SD 4.23Å; I189-M193 HydrophobicContact CG2-CB 4.47Å; I189-M193 HydrophobicContact CG2-SD 4.2Å; I189-M193 WeakPolarHBondContact O-CA 3.27Å; I189-M193 VanDerWaalsContact O-CB 3.26Å; I189-M193 WeakPolarHBondContact O-CB 3.22Å; I189-M193 PolarHBondContact O-N 2.87Å; M193-I195 WeakPolarHBondContact O-CG1 3.3Å; M193-I195 PolarHBondContact O-N 3.44Å; M193-L297 HydrophobicContact SD-CD1 4.14Å
194	S	83.3	Confident	88.5	Confident	107 Å²	107	39.9 Å²	39.9	75%	0.748	21%	0.21	S	C	*	.			trans	55.5	29.9	-179.6	-61.4	0	0	0	0	114.3	R190	R190-S194 WeakPolarHBondContact O-CA 3.43Å; R190-S194 PolarHBondContact O-N 2.86Å
195	I	85	Confident	88.4	Confident	34 Å²	34	39.8 Å²	39.8	17%	0.174	21%	0.209	C	C	.	.	S	Bend	trans	-132.3	143.4	-179.6	-64.1	163.9	0	0	0	109.5	W158 M193 P197 L297	W158-I195 HydrophobicContact CH2-CD1 4.5Å; W158-I195 HydrophobicContact CZ2-CD1 3.45Å; W158-I195 VanDerWaalsContact CZ2-CD1 3.45Å; M193-I195 WeakPolarHBondContact O-CG1 3.3Å; M193-I195 PolarHBondContact O-N 3.44Å; I195-P197 VanDerWaalsContact O-CD 3.23Å; I195-P197 WeakPolarHBondContact O-CD 3.25Å; I195-L297 HydrophobicContact CB-CD1 4.25Å; I195-L297 HydrophobicContact CB-CG 4.45Å; I195-L297 HydrophobicContact CD1-CD1 4.43Å; I195-L297 HydrophobicContact CG2-CB 4.5Å; I195-L297 HydrophobicContact CG2-CD1 4.14Å; I195-L297 HydrophobicContact CG2-CG 3.8Å
196	T	89.3	Confident	87.9	Confident	58 Å²	58	42.6 Å²	42.6	36%	0.356	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	116.6	177.9	-55.1	0	0	0	0	111.1	V296 L297	T196-V296 WeakPolarHBondContact O-CA 3.3Å; T196-L297 PolarHBondContact O-N 2.83Å
197	P	93	Very high	87.2	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	135.3	170.9	32.3	-33.2	0	0	0	110.3	L186 I189 I195 L297 V299	L186-P197 HydrophobicContact CB-CG 4.19Å; L186-P197 HydrophobicContact CD2-CB 3.72Å; L186-P197 HydrophobicContact CD2-CG 3.96Å; L186-P197 WeakPolarHBondContact O-CG 3.43Å; I189-P197 HydrophobicContact CB-CB 4.34Å; I189-P197 HydrophobicContact CB-CG 4.39Å; I189-P197 HydrophobicContact CD1-CB 4.36Å; I189-P197 HydrophobicContact CG2-CB 3.99Å; I189-P197 HydrophobicContact CG2-CG 4.32Å; I195-P197 VanDerWaalsContact O-CD 3.23Å; I195-P197 WeakPolarHBondContact O-CD 3.25Å; P197-L297 CarbonylContact C-O 3.51Å; P197-L297 WeakPolarHBondContact CA-O 3.41Å; P197-V299 HydrophobicContact CB-CG2 3.61Å
198	L	92.4	Very high	86.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	99.2	179.2	-167.9	75.4	0	0	0	109.6	L200 L256 Q259 L260 I287 V296 L297 P298 V299	L198-L200 HydrophobicContact CD2-CD2 4.01Å; L198-L200 HydrophobicContact CG-CD2 4.25Å; L198-L200 PolarHBondContact O-N 3.07Å; L198-L256 HydrophobicContact CD1-CD1 3.45Å; L198-L256 VanDerWaalsContact CD1-CD1 3.45Å; L198-L256 HydrophobicContact CD2-CD1 3.9Å; L198-L256 HydrophobicContact CG-CD1 3.48Å; L198-L256 VanDerWaalsContact CG-CD1 3.48Å; L198-Q259 HydrophobicContact CD1-CB 4.13Å; L198-L260 HydrophobicContact CD2-CD2 3.73Å; L198-L260 HydrophobicContact CD2-CG 4.36Å; L198-I287 HydrophobicContact CD2-CG1 4.09Å; L198-V296 HydrophobicContact CB-CB 4.29Å; L198-V296 HydrophobicContact CD2-CG2 4.43Å; L198-L297 PolarHBondContact N-O 3.16Å; L198-P298 WeakPolarHBondContact O-CA 3.19Å; L198-V299 PolarHBondContact O-N 2.94Å
199	L	92.9	Very high	85.9	Confident	33 Å²	33	54.2 Å²	54.2	17%	0.173	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	114.9	179.5	-175.8	68	0	0	0	110.4	I182 L186 S201 V299 F301	I182-L199 HydrophobicContact CG2-CD1 4.28Å; I182-L199 HydrophobicContact CG2-CD2 4.46Å; L186-L199 HydrophobicContact CD1-CB 4.37Å; L186-L199 HydrophobicContact CD1-CD2 4.29Å; L199-S201 WeakPolarHBondContact CD2-O 3.1Å; L199-S201 WeakPolarHBondContact CG-O 3.3Å; L199-V299 HydrophobicContact CD1-CB 4.44Å; L199-V299 HydrophobicContact CD1-CG1 4.41Å; L199-F301 HydrophobicContact CD1-CD1 4.05Å; L199-F301 HydrophobicContact CD1-CE1 4.23Å
200	L	90.8	Very high	85.5	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.016	32%	0.323	C	S	.	.			trans	-86.4	-17.8	-174.8	-60.8	-171.6	0	0	0	114.3	L198 L217 L256 I287 P298 V299 L300 Y320	L198-L200 HydrophobicContact CD2-CD2 4.01Å; L198-L200 HydrophobicContact CG-CD2 4.25Å; L198-L200 PolarHBondContact O-N 3.07Å; L200-L217 WeakPolarHBondContact O-CB 3.39Å; L200-L217 PolarHBondContact O-N 3.22Å; L200-L217 VanDerWaalsContact O-N 3.15Å; L200-L256 HydrophobicContact CD2-CD1 4.49Å; L200-I287 HydrophobicContact CD2-CD1 3.69Å; L200-I287 HydrophobicContact CD2-CG1 4.39Å; L200-I287 HydrophobicContact CD2-CG2 4.37Å; L200-P298 HydrophobicContact CD1-CB 3.84Å; L200-P298 HydrophobicContact CD2-CB 4.37Å; L200-P298 HydrophobicContact CG-CB 4.13Å; L200-V299 PolarHBondContact N-O 2.8Å; L200-V299 VanDerWaalsContact N-O 3.11Å; L200-L300 HydrophobicContact CD1-CD1 4.27Å; L200-L300 HydrophobicContact CD1-CG 4.45Å; L200-Y320 HydrophobicContact CD1-CD2 3.84Å; L200-Y320 HydrophobicContact CD1-CE2 3.22Å
201	S	90.1	Very high	85.2	Confident	5 Å²	5	53.3 Å²	53.3	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.7	-173.3	-60.7	0	0	0	0	110.5	L199 V215 F301	L199-S201 WeakPolarHBondContact CD2-O 3.1Å; L199-S201 WeakPolarHBondContact CG-O 3.3Å; S201-V215 CarbonylContact C-O 3.59Å; S201-V215 WeakPolarHBondContact CA-O 3.4Å; S201-F301 WeakPolarHBondContact O-CE1 3.43Å
202	Y	88	Confident	85.2	Confident	44 Å²	44	48.7 Å²	48.7	17%	0.173	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129	173.6	175.2	-97.3	0	0	0	110.8	Y214 V215 F252	Y202-Y214 CarbonylContact O-C 3.57Å; Y202-Y214 WeakPolarHBondContact O-CA 3.47Å; Y202-V215 HydrophobicContact CD1-CG2 4.29Å; Y202-V215 PolarHBondContact N-O 3.15Å; Y202-V215 PolarHBondContact O-N 3.1Å; Y202-F252 HydrophobicContact CD2-CD1 4.41Å; Y202-F252 AromaticContact CD2-CD2 3.49Å; Y202-F252 HydrophobicContact CD2-CD2 3.49Å; Y202-F252 VanDerWaalsContact CD2-CD2 3.49Å; Y202-F252 HydrophobicContact CD2-CE1 4.35Å; Y202-F252 AromaticContact CD2-CE2 3.45Å; Y202-F252 HydrophobicContact CD2-CE2 3.45Å; Y202-F252 VanDerWaalsContact CD2-CE2 3.45Å; Y202-F252 HydrophobicContact CD2-CG 4.02Å; Y202-F252 AromaticContact CD2-CZ 3.9Å; Y202-F252 HydrophobicContact CD2-CZ 3.9Å; Y202-F252 AromaticContact CE2-CD2 3.69Å; Y202-F252 HydrophobicContact CE2-CD2 3.69Å; Y202-F252 HydrophobicContact CE2-CE1 4.47Å; Y202-F252 AromaticContact CE2-CE2 3.16Å; Y202-F252 HydrophobicContact CE2-CE2 3.16Å; Y202-F252 AromaticContact CE2-CZ 3.62Å; Y202-F252 HydrophobicContact CE2-CZ 3.62Å; Y202-F252 HydrophobicContact CG-CD2 4.26Å
203	P	88.8	Confident	85.4	Confident	23 Å²	23	45.4 Å²	45.4	15%	0.149	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.2	-177.9	29	-36	0	0	0	112.4	I182 V211 F301	I182-P203 HydrophobicContact CD1-CB 3.99Å; I182-P203 HydrophobicContact CD1-CG 3.86Å; P203-V211 HydrophobicContact CB-CG1 4.04Å; P203-V211 HydrophobicContact CB-CG2 4.28Å; P203-F301 HydrophobicContact CB-CE1 4.37Å; P203-F301 HydrophobicContact CB-CE2 4.05Å; P203-F301 HydrophobicContact CB-CZ 3.72Å; P203-F301 HydrophobicContact CG-CZ 4.47Å
204	L	86.8	Confident	85.7	Confident	18 Å²	18	45.5 Å²	45.5	9%	0.094	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	118.9	169.9	-66.3	174	0	0	0	109.1	V211 C212 G213 V215 A222 L245	L204-V211 CarbonylContact O-C 3.6Å; L204-V211 WeakPolarHBondContact O-CA 3.46Å; L204-C212 PolarHBondContact O-N 2.99Å; L204-C212 PolarHBondContact O-SG 2.63Å; L204-G213 PolarHBondContact N-O 3.49Å; L204-G213 PolarHBondContact O-N 3.31Å; L204-V215 HydrophobicContact CD1-CG2 4.17Å; L204-V215 HydrophobicContact CD2-CG2 3.58Å; L204-V215 HydrophobicContact CG-CG2 3.89Å; L204-A222 HydrophobicContact CD1-CB 4.19Å; L204-L245 HydrophobicContact CD2-CD1 4.13Å; L204-L245 HydrophobicContact CD2-CD2 4.38Å
205	L	85.2	Confident	86	Confident	104 Å²	104	40.4 Å²	40.4	55%	0.545	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	142.4	179.4	-53.3	-179	0	0	0	111.1	N210 V211	L205-N210 CarbonylContact C-O 3.54Å; L205-N210 WeakPolarHBondContact CA-O 3.35Å; L205-V211 HydrophobicContact CD2-CG2 3.8Å
206	D	80.7	Confident	86.2	Confident	62 Å²	62	40 Å²	40	33%	0.332	23%	0.234	S	C	.	.			trans	-80.6	178.5	166.2	69.9	16.6	0	0	0	111.7	G208 G209 N210 C212	D206-G208 PolarHBondContact O-N 3.33Å; D206-G208 VanDerWaalsContact OD1-C 3.31Å; D206-G208 VanDerWaalsContact OD1-CA 3.28Å; D206-G208 WeakPolarHBondContact OD1-CA 3.32Å; D206-G208 PolarHBondContact OD1-N 3.43Å; D206-G209 PolarHBondContact O-N 2.9Å; D206-G209 PolarHBondContact OD1-N 2.98Å; D206-N210 PolarHBondContact N-O 2.84Å; D206-N210 PolarHBondContact OD1-N 2.54Å; D206-N210 PolarHBondContact OD1-ND2 2.71Å; D206-N210 PolarHBondContact OD2-ND2 2.88Å; D206-C212 HydrophobicContact CB-CB 4.16Å
207	E	77.1	Confident	86.1	Confident	213 Å²	213	37.5 Å²	37.5	100%	0.995	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.3	179	-64.3	179	-179.5	0	0	113.1	G209	E207-G209 VanDerWaalsContact C-N 3.35Å
208	G	74.1	Confident	85.7	Confident	62 Å²	62	37.2 Å²	37.2	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	0.6	175.5	0	0	0	0	0	114	D206 N210	D206-G208 PolarHBondContact O-N 3.33Å; D206-G208 VanDerWaalsContact OD1-C 3.31Å; D206-G208 VanDerWaalsContact OD1-CA 3.28Å; D206-G208 WeakPolarHBondContact OD1-CA 3.32Å; D206-G208 PolarHBondContact OD1-N 3.43Å; G208-N210 VanDerWaalsContact C-N 3.32Å
209	G	78.9	Confident	85.2	Confident	47 Å²	47	38.9 Å²	38.9	49%	0.485	23%	0.233	S	C	.	.	S	Bend	trans	79.6	7.8	-176.6	0	0	0	0	0	114.5	D206 E207	D206-G209 PolarHBondContact O-N 2.9Å; D206-G209 PolarHBondContact OD1-N 2.98Å; E207-G209 VanDerWaalsContact C-N 3.35Å
210	N	81	Confident	84.8	Confident	89 Å²	89	39.5 Å²	39.5	48%	0.476	24%	0.236	S	C	.	.			trans	-85.6	147.8	177.3	-49.8	-66.7	0	0	0	110.7	L205 D206 G208 C212	L205-N210 CarbonylContact C-O 3.54Å; L205-N210 WeakPolarHBondContact CA-O 3.35Å; D206-N210 PolarHBondContact N-O 2.84Å; D206-N210 PolarHBondContact OD1-N 2.54Å; D206-N210 PolarHBondContact OD1-ND2 2.71Å; D206-N210 PolarHBondContact OD2-ND2 2.88Å; G208-N210 VanDerWaalsContact C-N 3.32Å; N210-C212 PolarHBondContact O-N 2.87Å
211	V	83.3	Confident	84.5	Confident	22 Å²	22	42 Å²	42	13%	0.133	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115	177.5	-170.5	0	0	0	0	109.9	I175 P203 L204 L205 G213 W225 F301	I175-V211 HydrophobicContact CD1-CB 4.2Å; I175-V211 HydrophobicContact CD1-CG1 4.34Å; I175-V211 HydrophobicContact CD1-CG2 3.61Å; I175-V211 HydrophobicContact CG1-CB 4.38Å; I175-V211 HydrophobicContact CG1-CG2 3.82Å; P203-V211 HydrophobicContact CB-CG1 4.04Å; P203-V211 HydrophobicContact CB-CG2 4.28Å; L204-V211 CarbonylContact O-C 3.6Å; L204-V211 WeakPolarHBondContact O-CA 3.46Å; L205-V211 HydrophobicContact CD2-CG2 3.8Å; V211-G213 VanDerWaalsContact CG1-O 3.28Å; V211-G213 WeakPolarHBondContact CG1-O 3.15Å; V211-W225 HydrophobicContact CB-CZ3 4.34Å; V211-W225 HydrophobicContact CG1-CH2 3.94Å; V211-W225 HydrophobicContact CG1-CZ3 3.73Å; V211-F301 HydrophobicContact CG1-CD2 4.49Å; V211-F301 HydrophobicContact CG1-CE2 3.94Å
212	C	84.3	Confident	84.3	Confident	13 Å²	13	42 Å²	42	9%	0.088	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-4	-179.3	70	0	0	0	0	113.6	L204 D206 N210 W225	L204-C212 PolarHBondContact O-N 2.99Å; L204-C212 PolarHBondContact O-SG 2.63Å; D206-C212 HydrophobicContact CB-CB 4.16Å; N210-C212 PolarHBondContact O-N 2.87Å; C212-W225 VanDerWaalsContact C-CE3 3.4Å; C212-W225 PolarHBondContact O-N 3.24Å
213	G	86.2	Confident	84.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.8	-166.3	-179.9	0	0	0	0	0	111.5	L204 V211 F223	L204-G213 PolarHBondContact N-O 3.49Å; L204-G213 PolarHBondContact O-N 3.31Å; V211-G213 VanDerWaalsContact CG1-O 3.28Å; V211-G213 WeakPolarHBondContact CG1-O 3.15Å; G213-F223 CarbonylContact C-O 3.53Å; G213-F223 WeakPolarHBondContact CA-O 3.49Å
214	Y	89	Confident	83.9	Confident	12 Å²	12	45 Å²	45	5%	0.047	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	159.4	178.3	64.5	-82.8	0	0	0	111	Y202 D216 F223 W225 T312	Y202-Y214 CarbonylContact O-C 3.57Å; Y202-Y214 WeakPolarHBondContact O-CA 3.47Å; Y214-D216 HydrophobicContact CE2-CB 4.48Å; Y214-F223 HydrophobicContact CD1-CB 4.11Å; Y214-F223 HydrophobicContact CD2-CB 4.32Å; Y214-F223 HydrophobicContact CD2-CD2 4.23Å; Y214-F223 HydrophobicContact CE1-CB 3.65Å; Y214-F223 HydrophobicContact CE1-CG 4.37Å; Y214-F223 HydrophobicContact CE2-CB 3.9Å; Y214-F223 AromaticContact CE2-CD2 3.47Å; Y214-F223 HydrophobicContact CE2-CD2 3.47Å; Y214-F223 VanDerWaalsContact CE2-CD2 3.47Å; Y214-F223 HydrophobicContact CE2-CE2 4.29Å; Y214-F223 AromaticContact CE2-CG 3.98Å; Y214-F223 HydrophobicContact CE2-CG 3.98Å; Y214-F223 HydrophobicContact CG-CB 4.41Å; Y214-F223 AromaticContact CZ-CD2 3.7Å; Y214-F223 AromaticContact CZ-CG 3.74Å; Y214-F223 PolarHBondContact N-O 3.04Å; Y214-F223 PolarHBondContact O-N 2.99Å; Y214-W225 AromaticContact CD1-CE2 3.93Å; Y214-W225 AromaticContact CD1-CZ2 3.66Å; Y214-W225 HydrophobicContact CD1-CZ2 3.66Å; Y214-W225 AromaticContact CD1-NE1 3.98Å; Y214-W225 HydrophobicContact CE1-CZ2 4.22Å; Y214-W225 AromaticContact CE1-NE1 3.75Å; Y214-T312 HydrophobicContact CE2-CG2 3.86Å; Y214-T312 PolarHBondContact OH-OG1 3.01Å
215	V	88.9	Confident	83.6	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.6	168.2	-175	0	0	0	0	107.4	S201 Y202 L204 L217 T221 A222 L241 A249	S201-V215 CarbonylContact C-O 3.59Å; S201-V215 WeakPolarHBondContact CA-O 3.4Å; Y202-V215 HydrophobicContact CD1-CG2 4.29Å; Y202-V215 PolarHBondContact N-O 3.15Å; Y202-V215 PolarHBondContact O-N 3.1Å; L204-V215 HydrophobicContact CD1-CG2 4.17Å; L204-V215 HydrophobicContact CD2-CG2 3.58Å; L204-V215 HydrophobicContact CG-CG2 3.89Å; V215-L217 PolarHBondContact O-N 3.03Å; V215-T221 WeakPolarHBondContact CA-O 3.45Å; V215-A222 HydrophobicContact CG2-CB 4.21Å; V215-L241 HydrophobicContact CG1-CD1 4.19Å; V215-L241 HydrophobicContact CG1-CD2 3.96Å; V215-L241 HydrophobicContact CG2-CD2 3.84Å; V215-A249 HydrophobicContact CG1-CB 4.03Å
216	D	88.9	Confident	82.9	Confident	26 Å²	26	42.7 Å²	42.7	14%	0.139	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	112.3	171.1	174.1	8.4	0	0	0	108.4	Y214 T218 G219 M220 T221 F223	Y214-D216 HydrophobicContact CE2-CB 4.48Å; D216-T218 VanDerWaalsContact CG-OG1 3.26Å; D216-T218 PolarHBondContact O-N 3.12Å; D216-T218 WeakPolarHBondContact OD1-CB 3.4Å; D216-T218 PolarHBondContact OD1-N 2.68Å; D216-T218 PolarHBondContact OD1-OG1 2.73Å; D216-T218 PolarHBondContact OD2-OG1 3.32Å; D216-T218 VanDerWaalsContact OD2-OG1 3.12Å; D216-G219 PolarHBondContact OD1-N 2.87Å; D216-G219 PolarHBondContact OD2-N 3.07Å; D216-M220 VanDerWaalsContact O-CA 3.29Å; D216-M220 WeakPolarHBondContact O-CA 3.39Å; D216-M220 PolarHBondContact O-N 3.06Å; D216-T221 PolarHBondContact N-O 3.44Å; D216-T221 PolarHBondContact O-N 3.36Å; D216-F223 HydrophobicContact CB-CD2 4.26Å; D216-F223 HydrophobicContact CB-CE2 3.97Å
217	L	87.2	Confident	82.2	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.6	-178.1	-62.3	176.4	0	0	0	112	L200 V215 F252 R253 L256	L200-L217 WeakPolarHBondContact O-CB 3.39Å; L200-L217 PolarHBondContact O-N 3.22Å; L200-L217 VanDerWaalsContact O-N 3.15Å; V215-L217 PolarHBondContact O-N 3.03Å; L217-F252 HydrophobicContact CD1-CB 4.1Å; L217-F252 HydrophobicContact CD2-CB 3.96Å; L217-R253 PolarHBondContact O-NH1 3.36Å; L217-L256 HydrophobicContact CB-CD2 3.89Å; L217-L256 HydrophobicContact CD1-CD2 4.49Å
218	T	85.2	Confident	81.4	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-40.7	177.8	71.7	0	0	0	0	112	D216 R253 A280 I283 K284 I287	D216-T218 VanDerWaalsContact CG-OG1 3.26Å; D216-T218 PolarHBondContact O-N 3.12Å; D216-T218 WeakPolarHBondContact OD1-CB 3.4Å; D216-T218 PolarHBondContact OD1-N 2.68Å; D216-T218 PolarHBondContact OD1-OG1 2.73Å; D216-T218 PolarHBondContact OD2-OG1 3.32Å; D216-T218 VanDerWaalsContact OD2-OG1 3.12Å; T218-R253 VanDerWaalsContact C-NH1 3.26Å; T218-R253 PolarHBondContact O-NH1 3.17Å; T218-A280 WeakPolarHBondContact O-CA 3.48Å; T218-A280 WeakPolarHBondContact O-CB 3.34Å; T218-I283 HydrophobicContact CG2-CG2 3.94Å; T218-K284 HydrophobicContact CG2-CG 4.38Å; T218-K284 WeakPolarHBondContact OG1-CE 3.47Å; T218-I287 HydrophobicContact CG2-CD1 3.97Å
219	G	82.6	Confident	80.1	Confident	34 Å²	34	43.7 Å²	43.7	35%	0.351	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.4	178.6	0	0	0	0	0	115.2	D216 T221	D216-G219 PolarHBondContact OD1-N 2.87Å; D216-G219 PolarHBondContact OD2-N 3.07Å; G219-T221 PolarHBondContact O-N 3.42Å
220	M	84.5	Confident	78.7	Confident	46 Å²	46	48.3 Å²	48.3	23%	0.227	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	39.6	-169.3	-69.2	-63.7	-71.8	0	0	112.8	D216 L241 A249 E250 R253	D216-M220 VanDerWaalsContact O-CA 3.29Å; D216-M220 WeakPolarHBondContact O-CA 3.39Å; D216-M220 PolarHBondContact O-N 3.06Å; M220-L241 HydrophobicContact CE-CD1 4.17Å; M220-L241 VanDerWaalsContact O-CD1 3.25Å; M220-L241 WeakPolarHBondContact O-CD1 3.11Å; M220-A249 HydrophobicContact CE-CB 3.85Å; M220-A249 HydrophobicContact SD-CB 4.36Å; M220-E250 HydrophobicContact CE-CB 4.44Å; M220-E250 HydrophobicContact CE-CG 3.63Å; M220-R253 HydrophobicContact SD-CB 4.01Å; M220-R253 VanDerWaalsContact SD-CD 3.51Å; M220-R253 HydrophobicContact SD-CG 4.34Å
221	T	84.3	Confident	77.3	Confident	56 Å²	56	46.1 Å²	46.1	34%	0.344	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.2	179.2	46.5	0	0	0	0	110.1	V215 D216 G219 F223	V215-T221 WeakPolarHBondContact CA-O 3.45Å; D216-T221 PolarHBondContact N-O 3.44Å; D216-T221 PolarHBondContact O-N 3.36Å; G219-T221 PolarHBondContact O-N 3.42Å; T221-F223 WeakPolarHBondContact OG1-CE2 3.41Å
222	A	84.9	Confident	75.8	Confident	6 Å²	6	48.1 Å²	48.1	5%	0.05	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	137.8	174.5	0	0	0	0	0	110.1	L204 V215 G238 M239 L241	L204-A222 HydrophobicContact CD1-CB 4.19Å; V215-A222 HydrophobicContact CG2-CB 4.21Å; A222-G238 CarbonylContact O-C 3.57Å; A222-G238 WeakPolarHBondContact O-CA 3.44Å; A222-M239 HydrophobicContact CB-CB 4.25Å; A222-M239 PolarHBondContact N-O 3.15Å; A222-M239 PolarHBondContact O-N 2.91Å; A222-L241 HydrophobicContact CB-CD2 3.77Å; A222-L241 HydrophobicContact CB-CG 4.12Å
223	F	84	Confident	74.4	Confident	37 Å²	37	47.8 Å²	47.8	16%	0.162	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	110.4	-179.3	-74.5	-72.2	0	0	0	108.4	G213 Y214 D216 T221 A236	G213-F223 CarbonylContact C-O 3.53Å; G213-F223 WeakPolarHBondContact CA-O 3.49Å; Y214-F223 HydrophobicContact CD1-CB 4.11Å; Y214-F223 HydrophobicContact CD2-CB 4.32Å; Y214-F223 HydrophobicContact CD2-CD2 4.23Å; Y214-F223 HydrophobicContact CE1-CB 3.65Å; Y214-F223 HydrophobicContact CE1-CG 4.37Å; Y214-F223 HydrophobicContact CE2-CB 3.9Å; Y214-F223 AromaticContact CE2-CD2 3.47Å; Y214-F223 HydrophobicContact CE2-CD2 3.47Å; Y214-F223 VanDerWaalsContact CE2-CD2 3.47Å; Y214-F223 HydrophobicContact CE2-CE2 4.29Å; Y214-F223 AromaticContact CE2-CG 3.98Å; Y214-F223 HydrophobicContact CE2-CG 3.98Å; Y214-F223 HydrophobicContact CG-CB 4.41Å; Y214-F223 AromaticContact CZ-CD2 3.7Å; Y214-F223 AromaticContact CZ-CG 3.74Å; Y214-F223 PolarHBondContact N-O 3.04Å; Y214-F223 PolarHBondContact O-N 2.99Å; D216-F223 HydrophobicContact CB-CD2 4.26Å; D216-F223 HydrophobicContact CB-CE2 3.97Å; T221-F223 WeakPolarHBondContact OG1-CE2 3.41Å; F223-A236 HydrophobicContact CB-CB 3.57Å; F223-A236 HydrophobicContact CD1-CB 3.93Å; F223-A236 HydrophobicContact CG-CB 4.17Å
224	K	84	Confident	73	Confident	92 Å²	92	55.2 Å²	55.2	40%	0.4	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.1	173.4	-168.1	175.8	-178.2	178.4	0	109.7	N226 A236 S237 M239	K224-N226 PolarHBondContact O-N 3.33Å; K224-A236 WeakPolarHBondContact O-CA 3.47Å; K224-A236 WeakPolarHBondContact O-CB 3.46Å; K224-S237 PolarHBondContact O-N 3.43Å; K224-M239 HydrophobicContact CB-SD 3.56Å; K224-M239 VanDerWaalsContact CB-SD 3.56Å; K224-M239 HydrophobicContact CD-SD 4.03Å; K224-M239 HydrophobicContact CG-SD 4.43Å
225	W	81.5	Confident	71.6	Confident	5 Å²	5	59.1 Å²	59.1	2%	0.019	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124.3	173.9	-61.4	-53.2	0	0	0	109	V211 C212 Y214 F301 Q308	V211-W225 HydrophobicContact CB-CZ3 4.34Å; V211-W225 HydrophobicContact CG1-CH2 3.94Å; V211-W225 HydrophobicContact CG1-CZ3 3.73Å; C212-W225 VanDerWaalsContact C-CE3 3.4Å; C212-W225 PolarHBondContact O-N 3.24Å; Y214-W225 AromaticContact CD1-CE2 3.93Å; Y214-W225 AromaticContact CD1-CZ2 3.66Å; Y214-W225 HydrophobicContact CD1-CZ2 3.66Å; Y214-W225 AromaticContact CD1-NE1 3.98Å; Y214-W225 HydrophobicContact CE1-CZ2 4.22Å; Y214-W225 AromaticContact CE1-NE1 3.75Å; W225-F301 HydrophobicContact CH2-CE2 4.35Å; W225-Q308 HydrophobicContact CB-CG 4.46Å; W225-Q308 HydrophobicContact CD2-CB 3.83Å; W225-Q308 HydrophobicContact CD2-CG 3.81Å; W225-Q308 HydrophobicContact CE3-CB 4.02Å; W225-Q308 HydrophobicContact CE3-CG 3.89Å; W225-Q308 HydrophobicContact CG-CB 4.36Å; W225-Q308 HydrophobicContact CG-CG 4.04Å; W225-Q308 HydrophobicContact CH2-CB 4.19Å; W225-Q308 HydrophobicContact CZ2-CB 4Å; W225-Q308 HydrophobicContact CZ3-CB 4.18Å; W225-Q308 HydrophobicContact CZ3-CG 4.43Å
226	N	69.5	Low	70.2	Confident	69 Å²	69	59.5 Å²	59.5	37%	0.369	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126	177	-71	-27.3	0	0	0	108.9	K224 S233 K234 S237	K224-N226 PolarHBondContact O-N 3.33Å; N226-S233 WeakPolarHBondContact O-CA 3.48Å; N226-K234 PolarHBondContact O-N 3.48Å; N226-S237 PolarHBondContact ND2-OG 2.82Å; N226-S237 VanDerWaalsContact ND2-OG 3.09Å
227	Y	66.1	Low	68.8	Low	127 Å²	127	61 Å²	61	50%	0.498	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.8	176.4	-52.9	-77.3	0	0	0	109.9
228	G	60.1	Low	67.9	Low	24 Å²	24	63.6 Å²	63.6	25%	0.247	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-69.8	170.2	161.1	0	0	0	0	0	111.4	D230 G231 E232	G228-D230 PolarHBondContact O-N 3.42Å; G228-G231 PolarHBondContact O-N 2.99Å; G228-E232 PolarHBondContact N-O 2.93Å
229	E	48.5	Very low	67.1	Low	207 Å²	207	68.1 Å²	68.1	97%	0.967	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.3	173.7	-67.4	-179.8	171.6	0	0	111.8	G231	E229-G231 VanDerWaalsContact C-N 3.32Å; E229-G231 PolarHBondContact O-N 3.43Å
230	D	49.6	Very low	66.6	Low	144 Å²	144	73.2 Å²	73.2	77%	0.77	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	5	176.8	-52.6	-44.1	0	0	0	113.8	G228 E232	G228-D230 PolarHBondContact O-N 3.42Å; D230-E232 HydrophobicContact CB-CG 4.47Å; D230-E232 PolarHBondContact O-N 3.02Å
231	G	51.5	Low	65.9	Low	42 Å²	42	72.4 Å²	72.4	43%	0.433	39%	0.394	S	S	.	.	S	Bend	trans	77	-3.7	-174.3	0	0	0	0	0	114.8	G228 E229 S233	G228-G231 PolarHBondContact O-N 2.99Å; E229-G231 VanDerWaalsContact C-N 3.32Å; E229-G231 PolarHBondContact O-N 3.43Å; G231-S233 PolarHBondContact O-N 3.26Å
232	E	51.7	Low	65.5	Low	65 Å²	65	77.7 Å²	77.7	30%	0.304	41%	0.412	S	S	.	.			trans	-68.1	127.6	176.7	-69.4	-170.7	-171.9	0	0	111.9	Y70 M78 G228 D230 K234	Y70-E232 PolarHBondContact OH-OE2 3.33Å; M78-E232 HydrophobicContact SD-CG 4.42Å; M78-E232 VanDerWaalsContact SD-OE1 3.33Å; G228-E232 PolarHBondContact N-O 2.93Å; D230-E232 HydrophobicContact CB-CG 4.47Å; D230-E232 PolarHBondContact O-N 3.02Å; E232-K234 PolarHBondContact O-N 3.17Å
233	S	55	Low	65.1	Low	5 Å²	5	84.8 Å²	84.8	4%	0.035	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	112.4	170.9	140.4	0	0	0	0	110	N226 G231 N307	N226-S233 WeakPolarHBondContact O-CA 3.48Å; G231-S233 PolarHBondContact O-N 3.26Å; S233-N307 WeakPolarHBondContact CB-O 3.49Å; S233-N307 PolarHBondContact OG-O 2.98Å
234	K	56.2	Low	64.8	Low	156 Å²	156	90.1 Å²	90.1	68%	0.678	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	156.7	163.3	-72.4	-178	-179.5	172.3	0	109	N226 E232 A236	N226-K234 PolarHBondContact O-N 3.48Å; E232-K234 PolarHBondContact O-N 3.17Å; K234-A236 PolarHBondContact O-N 3.15Å; K234-A236 VanDerWaalsContact O-N 3.12Å
235	H	59.8	Low	64.7	Low	95 Å²	95	89 Å²	89	44%	0.44	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-40.4	124.2	176.6	-168.7	-58.2	0	0	0	110	S237 H311	H235-S237 PolarHBondContact O-N 3.49Å; H235-H311 AromaticContact CD2-CD2 3.57Å
236	A	59	Low	64.7	Low	8 Å²	8	89.5 Å²	89.5	7%	0.066	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	132.3	-174.2	0	0	0	0	0	109.6	F223 K224 K234	F223-A236 HydrophobicContact CB-CB 3.57Å; F223-A236 HydrophobicContact CD1-CB 3.93Å; F223-A236 HydrophobicContact CG-CB 4.17Å; K224-A236 WeakPolarHBondContact O-CA 3.47Å; K224-A236 WeakPolarHBondContact O-CB 3.46Å; K234-A236 PolarHBondContact O-N 3.15Å; K234-A236 VanDerWaalsContact O-N 3.12Å
237	S	60.3	Low	65.5	Low	59 Å²	59	93.9 Å²	93.9	41%	0.413	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.1	177.7	-63.7	0	0	0	0	108.4	K224 N226 H235 M239	K224-S237 PolarHBondContact O-N 3.43Å; N226-S237 PolarHBondContact ND2-OG 2.82Å; N226-S237 VanDerWaalsContact ND2-OG 3.09Å; H235-S237 PolarHBondContact O-N 3.49Å; S237-M239 PolarHBondContact O-N 2.79Å
238	G	67.6	Low	66.4	Low	57 Å²	57	93.6 Å²	93.6	59%	0.588	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	128.8	174.4	0	0	0	0	0	110.2	A222	A222-G238 CarbonylContact O-C 3.57Å; A222-G238 WeakPolarHBondContact O-CA 3.44Å
239	M	69.4	Low	67.6	Low	96 Å²	96	92.5 Å²	92.5	47%	0.473	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.1	176	-64.9	-177.2	69.8	0	0	109.3	A222 K224 S237 L241	A222-M239 HydrophobicContact CB-CB 4.25Å; A222-M239 PolarHBondContact N-O 3.15Å; A222-M239 PolarHBondContact O-N 2.91Å; K224-M239 HydrophobicContact CB-SD 3.56Å; K224-M239 VanDerWaalsContact CB-SD 3.56Å; K224-M239 HydrophobicContact CD-SD 4.03Å; K224-M239 HydrophobicContact CG-SD 4.43Å; S237-M239 PolarHBondContact O-N 2.79Å; M239-L241 PolarHBondContact O-N 2.91Å
240	V	70.5	Confident	69.5	Low	142 Å²	142	87 Å²	87	86%	0.861	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-69.3	129.9	168.2	-176.9	0	0	0	0	108	K242	V240-K242 PolarHBondContact O-N 3.27Å
241	L	69.7	Low	71.3	Confident	29 Å²	29	83 Å²	83	15%	0.152	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-62.6	126.6	177	-75.3	159.8	0	0	0	110	V215 M220 A222 M239 L245 A246	V215-L241 HydrophobicContact CG1-CD1 4.19Å; V215-L241 HydrophobicContact CG1-CD2 3.96Å; V215-L241 HydrophobicContact CG2-CD2 3.84Å; M220-L241 HydrophobicContact CE-CD1 4.17Å; M220-L241 VanDerWaalsContact O-CD1 3.25Å; M220-L241 WeakPolarHBondContact O-CD1 3.11Å; A222-L241 HydrophobicContact CB-CD2 3.77Å; A222-L241 HydrophobicContact CB-CG 4.12Å; M239-L241 PolarHBondContact O-N 2.91Å; L241-L245 HydrophobicContact CD2-CB 4.23Å; L241-A246 HydrophobicContact CB-CB 3.95Å
242	K	76.2	Confident	73.1	Confident	166 Å²	166	85.1 Å²	85.1	72%	0.722	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-65.3	147.7	167	-66	-176.9	179	-179.3	0	109.2	V240 E244 L245 A246	V240-K242 PolarHBondContact O-N 3.27Å; K242-E244 VanDerWaalsContact C-N 3.25Å; K242-E244 PolarHBondContact O-N 3.25Å; K242-L245 PolarHBondContact O-N 3.22Å; K242-A246 PolarHBondContact O-N 3.04Å
243	E	76.3	Confident	74.9	Confident	156 Å²	156	83.8 Å²	83.8	73%	0.729	42%	0.421	S	S	*	.	H	α-helix	trans	-52.4	-35.6	-172.2	-69.6	-175.5	170.8	0	0	115.1	R247	E243-R247 PolarHBondContact O-N 3.12Å; E243-R247 PolarHBondContact O-NE 3.21Å
244	E	78.4	Confident	76.4	Confident	149 Å²	149	87.1 Å²	87.1	70%	0.696	44%	0.436	S	S	*	.	H	α-helix	trans	-71.4	-40.4	178.1	-66.6	-174.5	163.7	0	0	112.9	K242 K248	K242-E244 VanDerWaalsContact C-N 3.25Å; K242-E244 PolarHBondContact O-N 3.25Å; E244-K248 PolarHBondContact O-N 2.87Å
245	L	81.3	Confident	78	Confident	67 Å²	67	84 Å²	84	35%	0.351	43%	0.427	S	S	.	.	H	α-helix	trans	-73.9	-34.1	176.9	-70.2	173.2	0	0	0	111.2	L204 L241 K242 K248 A249	L204-L245 HydrophobicContact CD2-CD1 4.13Å; L204-L245 HydrophobicContact CD2-CD2 4.38Å; L241-L245 HydrophobicContact CD2-CB 4.23Å; K242-L245 PolarHBondContact O-N 3.22Å; L245-K248 PolarHBondContact O-N 2.85Å; L245-A249 WeakPolarHBondContact O-CB 3.27Å; L245-A249 PolarHBondContact O-N 3.47Å
246	A	81.6	Confident	79.4	Confident	17 Å²	17	79.7 Å²	79.7	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-58.1	-50.9	174.7	0	0	0	0	0	111	L241 K242 K248 A249 E250	L241-A246 HydrophobicContact CB-CB 3.95Å; K242-A246 PolarHBondContact O-N 3.04Å; A246-K248 VanDerWaalsContact C-N 3.32Å; A246-K248 PolarHBondContact O-N 3.06Å; A246-A249 PolarHBondContact O-N 2.81Å; A246-A249 VanDerWaalsContact O-N 3.17Å; A246-E250 WeakPolarHBondContact O-CB 3.49Å; A246-E250 VanDerWaalsContact O-CG 3.3Å; A246-E250 WeakPolarHBondContact O-CG 3.4Å; A246-E250 PolarHBondContact O-N 2.93Å
247	R	86.1	Confident	80.8	Confident	160 Å²	160	80.5 Å²	80.5	60%	0.604	41%	0.41	S	S	*	.	H	α-helix	trans	-59.6	-39.3	178.5	-77.8	-175.2	-83.6	168.4	-8.7	113.3	E243 S251	E243-R247 PolarHBondContact O-N 3.12Å; E243-R247 PolarHBondContact O-NE 3.21Å; R247-S251 PolarHBondContact O-N 3.19Å
248	K	85.5	Confident	82.2	Confident	122 Å²	122	79 Å²	79	53%	0.53	40%	0.404	S	S	.	.	H	α-helix	trans	-66.5	-48.7	174.7	-72.2	-174.3	178.2	-176.5	0	111.1	E244 L245 A246 E250 S251 F252	E244-K248 PolarHBondContact O-N 2.87Å; L245-K248 PolarHBondContact O-N 2.85Å; A246-K248 VanDerWaalsContact C-N 3.32Å; A246-K248 PolarHBondContact O-N 3.06Å; K248-E250 VanDerWaalsContact C-N 3.29Å; K248-E250 PolarHBondContact O-N 3.06Å; K248-S251 WeakPolarHBondContact O-CB 3.41Å; K248-S251 PolarHBondContact O-N 3.05Å; K248-F252 VanDerWaalsContact O-CD2 3.23Å; K248-F252 WeakPolarHBondContact O-CD2 3.25Å; K248-F252 PolarHBondContact O-N 3.18Å
249	A	86.4	Confident	83.2	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-61.9	-36	179.3	0	0	0	0	0	112.6	V215 M220 L245 A246 F252 R253	V215-A249 HydrophobicContact CG1-CB 4.03Å; M220-A249 HydrophobicContact CE-CB 3.85Å; M220-A249 HydrophobicContact SD-CB 4.36Å; L245-A249 WeakPolarHBondContact O-CB 3.27Å; L245-A249 PolarHBondContact O-N 3.47Å; A246-A249 PolarHBondContact O-N 2.81Å; A246-A249 VanDerWaalsContact O-N 3.17Å; A249-F252 PolarHBondContact O-N 2.77Å; A249-R253 WeakPolarHBondContact O-CB 3.37Å; A249-R253 PolarHBondContact O-N 3.14Å
250	E	86.7	Confident	84.2	Confident	92 Å²	92	74.9 Å²	74.9	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-60.7	-44.9	173.8	-76.9	168	-177.3	0	0	111.3	M220 A246 K248 F252 R253 E254	M220-E250 HydrophobicContact CE-CB 4.44Å; M220-E250 HydrophobicContact CE-CG 3.63Å; A246-E250 WeakPolarHBondContact O-CB 3.49Å; A246-E250 VanDerWaalsContact O-CG 3.3Å; A246-E250 WeakPolarHBondContact O-CG 3.4Å; A246-E250 PolarHBondContact O-N 2.93Å; K248-E250 VanDerWaalsContact C-N 3.29Å; K248-E250 PolarHBondContact O-N 3.06Å; E250-F252 PolarHBondContact O-N 3.3Å; E250-R253 PolarHBondContact O-N 3.02Å; E250-E254 WeakPolarHBondContact O-CG 3.38Å; E250-E254 PolarHBondContact O-N 3.09Å
251	S	88.9	Confident	85.1	Confident	61 Å²	61	69.5 Å²	69.5	43%	0.427	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-46.7	175	-170.1	0	0	0	0	112.1	R247 K248 R253 E254 D255	R247-S251 PolarHBondContact O-N 3.19Å; K248-S251 WeakPolarHBondContact O-CB 3.41Å; K248-S251 PolarHBondContact O-N 3.05Å; S251-R253 VanDerWaalsContact C-N 3.31Å; S251-R253 PolarHBondContact O-N 3.35Å; S251-E254 PolarHBondContact O-N 3.29Å; S251-D255 PolarHBondContact O-N 3.4Å
252	F	88.7	Confident	86	Confident	86 Å²	86	76.1 Å²	76.1	38%	0.377	37%	0.369	S	S	.	.	H	α-helix	trans	-66.2	-34	177.2	-77.6	-77	0	0	0	112.6	Y202 L217 K248 A249 E250 D255 L256	Y202-F252 HydrophobicContact CD2-CD1 4.41Å; Y202-F252 AromaticContact CD2-CD2 3.49Å; Y202-F252 HydrophobicContact CD2-CD2 3.49Å; Y202-F252 VanDerWaalsContact CD2-CD2 3.49Å; Y202-F252 HydrophobicContact CD2-CE1 4.35Å; Y202-F252 AromaticContact CD2-CE2 3.45Å; Y202-F252 HydrophobicContact CD2-CE2 3.45Å; Y202-F252 VanDerWaalsContact CD2-CE2 3.45Å; Y202-F252 HydrophobicContact CD2-CG 4.02Å; Y202-F252 AromaticContact CD2-CZ 3.9Å; Y202-F252 HydrophobicContact CD2-CZ 3.9Å; Y202-F252 AromaticContact CE2-CD2 3.69Å; Y202-F252 HydrophobicContact CE2-CD2 3.69Å; Y202-F252 HydrophobicContact CE2-CE1 4.47Å; Y202-F252 AromaticContact CE2-CE2 3.16Å; Y202-F252 HydrophobicContact CE2-CE2 3.16Å; Y202-F252 AromaticContact CE2-CZ 3.62Å; Y202-F252 HydrophobicContact CE2-CZ 3.62Å; Y202-F252 HydrophobicContact CG-CD2 4.26Å; L217-F252 HydrophobicContact CD1-CB 4.1Å; L217-F252 HydrophobicContact CD2-CB 3.96Å; K248-F252 VanDerWaalsContact O-CD2 3.23Å; K248-F252 WeakPolarHBondContact O-CD2 3.25Å; K248-F252 PolarHBondContact O-N 3.18Å; A249-F252 PolarHBondContact O-N 2.77Å; E250-F252 PolarHBondContact O-N 3.3Å; F252-D255 PolarHBondContact O-N 3.39Å; F252-L256 WeakPolarHBondContact O-CB 3.27Å; F252-L256 PolarHBondContact O-N 2.88Å
253	R	88.5	Confident	86.5	Confident	37 Å²	37	71 Å²	71	14%	0.14	35%	0.349	C	S	.	.	H	α-helix	trans	-67.7	-40.9	174.3	178.4	179.6	175	108.6	-5.3	111.4	L217 T218 M220 A249 E250 S251 D255 L256 I257 V278	L217-R253 PolarHBondContact O-NH1 3.36Å; T218-R253 VanDerWaalsContact C-NH1 3.26Å; T218-R253 PolarHBondContact O-NH1 3.17Å; M220-R253 HydrophobicContact SD-CB 4.01Å; M220-R253 VanDerWaalsContact SD-CD 3.51Å; M220-R253 HydrophobicContact SD-CG 4.34Å; A249-R253 WeakPolarHBondContact O-CB 3.37Å; A249-R253 PolarHBondContact O-N 3.14Å; E250-R253 PolarHBondContact O-N 3.02Å; S251-R253 VanDerWaalsContact C-N 3.31Å; S251-R253 PolarHBondContact O-N 3.35Å; R253-D255 VanDerWaalsContact C-N 3.33Å; R253-L256 WeakPolarHBondContact O-CB 3.32Å; R253-L256 PolarHBondContact O-N 2.98Å; R253-I257 HydrophobicContact CG-CD1 3.82Å; R253-I257 HydrophobicContact CG-CG1 4.36Å; R253-I257 WeakPolarHBondContact O-CB 3.39Å; R253-I257 VanDerWaalsContact O-CG1 3.27Å; R253-I257 WeakPolarHBondContact O-CG1 3.47Å; R253-I257 PolarHBondContact O-N 2.91Å; R253-V278 PolarHBondContact NH2-O 2.83Å
254	E	88.2	Confident	87	Confident	74 Å²	74	63.8 Å²	63.8	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-59.4	-45.3	173.9	-75.2	176.6	-151.2	0	0	110.8	V10 E250 S251 L256 I257 G258	V10-E254 HydrophobicContact CG1-CG 4.13Å; V10-E254 WeakPolarHBondContact CG1-OE1 3.35Å; V10-E254 HydrophobicContact CG2-CG 4.48Å; E250-E254 WeakPolarHBondContact O-CG 3.38Å; E250-E254 PolarHBondContact O-N 3.09Å; S251-E254 PolarHBondContact O-N 3.29Å; E254-L256 PolarHBondContact O-N 3.23Å; E254-I257 PolarHBondContact O-N 2.89Å; E254-G258 PolarHBondContact O-N 2.83Å
255	D	89.1	Confident	87.3	Confident	91 Å²	91	64.5 Å²	64.5	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-39.7	176.8	-67.8	-25.7	0	0	0	112.3	S251 F252 R253 G258 Q259	S251-D255 PolarHBondContact O-N 3.4Å; F252-D255 PolarHBondContact O-N 3.39Å; R253-D255 VanDerWaalsContact C-N 3.33Å; D255-G258 PolarHBondContact O-N 3.5Å; D255-Q259 WeakPolarHBondContact O-CG 3.21Å; D255-Q259 PolarHBondContact O-N 3.1Å; D255-Q259 PolarHBondContact O-NE2 2.89Å
256	L	89.6	Confident	87.5	Confident	4 Å²	4	66.8 Å²	66.8	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-48.6	174.9	179.1	74.7	0	0	0	111.1	L198 L200 L217 F252 R253 E254 G258 Q259 L260	L198-L256 HydrophobicContact CD1-CD1 3.45Å; L198-L256 VanDerWaalsContact CD1-CD1 3.45Å; L198-L256 HydrophobicContact CD2-CD1 3.9Å; L198-L256 HydrophobicContact CG-CD1 3.48Å; L198-L256 VanDerWaalsContact CG-CD1 3.48Å; L200-L256 HydrophobicContact CD2-CD1 4.49Å; L217-L256 HydrophobicContact CB-CD2 3.89Å; L217-L256 HydrophobicContact CD1-CD2 4.49Å; F252-L256 WeakPolarHBondContact O-CB 3.27Å; F252-L256 PolarHBondContact O-N 2.88Å; R253-L256 WeakPolarHBondContact O-CB 3.32Å; R253-L256 PolarHBondContact O-N 2.98Å; E254-L256 PolarHBondContact O-N 3.23Å; L256-G258 VanDerWaalsContact C-N 3.32Å; L256-Q259 PolarHBondContact O-N 3.35Å; L256-L260 HydrophobicContact CG-CD1 4.41Å; L256-L260 WeakPolarHBondContact O-CG 3.38Å; L256-L260 PolarHBondContact O-N 2.86Å
257	I	88.8	Confident	87.6	Confident	25 Å²	25	66 Å²	66	13%	0.128	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-39.3	179	-69.2	171.6	0	0	0	110.3	R253 E254 L260 A261 I271 I283	R253-I257 HydrophobicContact CG-CD1 3.82Å; R253-I257 HydrophobicContact CG-CG1 4.36Å; R253-I257 WeakPolarHBondContact O-CB 3.39Å; R253-I257 VanDerWaalsContact O-CG1 3.27Å; R253-I257 WeakPolarHBondContact O-CG1 3.47Å; R253-I257 PolarHBondContact O-N 2.91Å; E254-I257 PolarHBondContact O-N 2.89Å; I257-L260 PolarHBondContact O-N 2.92Å; I257-A261 WeakPolarHBondContact O-CB 3.48Å; I257-A261 PolarHBondContact O-N 2.84Å; I257-I271 HydrophobicContact CG2-CD1 3.38Å; I257-I271 HydrophobicContact CG2-CG1 4.12Å; I257-I283 HydrophobicContact CD1-CD1 4.05Å; I257-I283 HydrophobicContact CG1-CD1 4.17Å
258	G	89.2	Confident	87.6	Confident	28 Å²	28	59.3 Å²	59.3	29%	0.289	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-47.7	174.8	0	0	0	0	0	112.3	E254 D255 L256 L260 A261 E262	E254-G258 PolarHBondContact O-N 2.83Å; D255-G258 PolarHBondContact O-N 3.5Å; L256-G258 VanDerWaalsContact C-N 3.32Å; G258-L260 PolarHBondContact O-N 3.11Å; G258-A261 PolarHBondContact O-N 3.25Å; G258-E262 PolarHBondContact O-N 2.96Å
259	Q	88.9	Confident	87.6	Confident	66 Å²	66	58.4 Å²	58.4	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-39.6	175.7	-73.9	173.1	68.9	0	0	112.7	L198 D255 L256 E262 L263	L198-Q259 HydrophobicContact CD1-CB 4.13Å; D255-Q259 WeakPolarHBondContact O-CG 3.21Å; D255-Q259 PolarHBondContact O-N 3.1Å; D255-Q259 PolarHBondContact O-NE2 2.89Å; L256-Q259 PolarHBondContact O-N 3.35Å; Q259-E262 PolarHBondContact O-N 3.21Å; Q259-L263 WeakPolarHBondContact O-CG 3.4Å
260	L	89.8	Confident	87.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-38.7	176.9	-71.2	175.2	0	0	0	112.2	L198 L256 I257 G258 E262 L263 D264 I267 I283 I287 V290	L198-L260 HydrophobicContact CD2-CD2 3.73Å; L198-L260 HydrophobicContact CD2-CG 4.36Å; L256-L260 HydrophobicContact CG-CD1 4.41Å; L256-L260 WeakPolarHBondContact O-CG 3.38Å; L256-L260 PolarHBondContact O-N 2.86Å; I257-L260 PolarHBondContact O-N 2.92Å; G258-L260 PolarHBondContact O-N 3.11Å; L260-E262 PolarHBondContact O-N 2.86Å; L260-L263 PolarHBondContact O-N 3.07Å; L260-D264 PolarHBondContact O-N 2.74Å; L260-I267 HydrophobicContact CB-CD1 4.24Å; L260-I267 HydrophobicContact CB-CG2 4.24Å; L260-I267 HydrophobicContact CD1-CD1 4.37Å; L260-I283 HydrophobicContact CD1-CG2 3.98Å; L260-I287 HydrophobicContact CD1-CG1 3.94Å; L260-I287 HydrophobicContact CD2-CG1 4.07Å; L260-V290 HydrophobicContact CD2-CG2 3.99Å
261	A	89.5	Confident	87.2	Confident	29 Å²	29	58.8 Å²	58.8	24%	0.24	30%	0.304	C	S	.	.	H	α-helix	trans	-65.2	-26.3	177.8	0	0	0	0	0	113.3	I257 G258 L263 I267 A268 I271	I257-A261 WeakPolarHBondContact O-CB 3.48Å; I257-A261 PolarHBondContact O-N 2.84Å; G258-A261 PolarHBondContact O-N 3.25Å; A261-L263 VanDerWaalsContact C-N 3.27Å; A261-I267 HydrophobicContact CB-CG2 4.32Å; A261-A268 HydrophobicContact CB-CB 4.32Å; A261-A268 WeakPolarHBondContact O-CB 3.43Å; A261-I271 HydrophobicContact CB-CD1 3.73Å
262	E	89	Confident	87	Confident	168 Å²	168	62.2 Å²	62.2	79%	0.785	32%	0.316	S	S	*	.	H	α-helix	trans	-73.3	-20.5	173.6	-70.6	-179.6	177.2	0	0	113	G258 Q259 L260	G258-E262 PolarHBondContact O-N 2.96Å; Q259-E262 PolarHBondContact O-N 3.21Å; L260-E262 PolarHBondContact O-N 2.86Å
263	L	86.9	Confident	86.7	Confident	59 Å²	59	62 Å²	62	31%	0.309	33%	0.326	S	S	.	.	H	α-helix	trans	-110.8	-25.5	-169.6	-62.3	172.2	0	0	0	114.3	Q259 L260 A261 V290 L295 V296	Q259-L263 WeakPolarHBondContact O-CG 3.4Å; L260-L263 PolarHBondContact O-N 3.07Å; A261-L263 VanDerWaalsContact C-N 3.27Å; L263-V290 HydrophobicContact CB-CG1 4.04Å; L263-L295 HydrophobicContact CD2-CB 4.41Å; L263-V296 HydrophobicContact CD1-CG1 3.24Å
264	D	86.1	Confident	85.8	Confident	5 Å²	5	64 Å²	64	3%	0.027	34%	0.339	C	S	.	.			trans	-126.1	114.5	-178.5	-163.3	-8.6	0	0	0	110.7	L260 E266 I267 A268 C286 R289 V290	L260-D264 PolarHBondContact O-N 2.74Å; D264-E266 PolarHBondContact O-N 3.2Å; D264-E266 PolarHBondContact OD1-N 2.75Å; D264-I267 HydrophobicContact CB-CG2 4.1Å; D264-I267 WeakPolarHBondContact O-CG2 3.14Å; D264-I267 PolarHBondContact O-N 2.89Å; D264-A268 PolarHBondContact O-N 3.18Å; D264-C286 PolarHBondContact OD2-SG 2.75Å; D264-C286 VanDerWaalsContact OD2-SG 3.41Å; D264-R289 IonicContact OD1-NH2 3Å; D264-R289 IonicContact OD2-CZ 3.77Å; D264-R289 IonicContact OD2-NE 3.58Å; D264-R289 PolarHBondContact OD2-NE 3.26Å; D264-R289 IonicContact OD2-NH2 3.14Å; D264-R289 PolarHBondContact OD2-NH2 2.81Å; D264-V290 HydrophobicContact CB-CG1 4.07Å
265	E	85.5	Confident	84.8	Confident	164 Å²	164	67.8 Å²	67.8	77%	0.766	36%	0.362	S	S	*	.	H	α-helix	trans	-60.2	-34.9	179.9	-65.6	179.9	173.9	0	0	111.6	I267 A268 D269	E265-I267 PolarHBondContact O-N 2.79Å; E265-A268 PolarHBondContact O-N 3.04Å; E265-D269 WeakPolarHBondContact O-CB 3.2Å; E265-D269 PolarHBondContact O-N 2.7Å
266	E	84.3	Confident	84	Confident	114 Å²	114	68.4 Å²	68.4	53%	0.533	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-42.5	-178.2	-68.3	-177.4	-164.9	0	0	112.3	D264 E270 R289	D264-E266 PolarHBondContact O-N 3.2Å; D264-E266 PolarHBondContact OD1-N 2.75Å; E266-E270 PolarHBondContact O-N 2.93Å; E266-E270 VanDerWaalsContact O-N 3.11Å; E266-R289 IonicContact OE2-CZ 3.02Å; E266-R289 IonicContact OE2-NE 3.93Å; E266-R289 IonicContact OE2-NH1 3.22Å; E266-R289 PolarHBondContact OE2-NH1 2.92Å; E266-R289 IonicContact OE2-NH2 3.64Å; E266-R289 PolarHBondContact OE2-NH2 3.49Å; E266-R289 VanDerWaalsContact OE2-NH2 3.13Å
267	I	85.2	Confident	83.2	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-75.7	-34.2	179.6	-154.1	174.8	0	0	0	110.8	L260 A261 D264 E265 D269 E270 I271 V278 C286	L260-I267 HydrophobicContact CB-CD1 4.24Å; L260-I267 HydrophobicContact CB-CG2 4.24Å; L260-I267 HydrophobicContact CD1-CD1 4.37Å; A261-I267 HydrophobicContact CB-CG2 4.32Å; D264-I267 HydrophobicContact CB-CG2 4.1Å; D264-I267 WeakPolarHBondContact O-CG2 3.14Å; D264-I267 PolarHBondContact O-N 2.89Å; E265-I267 PolarHBondContact O-N 2.79Å; I267-D269 VanDerWaalsContact C-N 3.34Å; I267-E270 PolarHBondContact O-N 2.81Å; I267-I271 HydrophobicContact CG1-CD1 4.19Å; I267-I271 VanDerWaalsContact O-CD1 3.25Å; I267-I271 WeakPolarHBondContact O-CD1 3.35Å; I267-I271 WeakPolarHBondContact O-CG1 3.07Å; I267-I271 PolarHBondContact O-N 3.08Å; I267-V278 HydrophobicContact CD1-CG1 4.27Å; I267-V278 HydrophobicContact CG1-CG1 4.29Å; I267-C286 HydrophobicContact CD1-CB 3.87Å
268	A	85.3	Confident	82.8	Confident	20 Å²	20	71.3 Å²	71.3	17%	0.165	39%	0.389	C	S	.	.	H	α-helix	trans	-60.2	-46	174.7	0	0	0	0	0	111.1	A261 D264 E265 I271 I272	A261-A268 HydrophobicContact CB-CB 4.32Å; A261-A268 WeakPolarHBondContact O-CB 3.43Å; D264-A268 PolarHBondContact O-N 3.18Å; E265-A268 PolarHBondContact O-N 3.04Å; A268-I271 PolarHBondContact O-N 2.86Å; A268-I272 WeakPolarHBondContact O-CD1 3.42Å; A268-I272 VanDerWaalsContact O-CG1 3.22Å; A268-I272 WeakPolarHBondContact O-CG1 3.46Å; A268-I272 PolarHBondContact O-N 2.8Å
269	D	85.4	Confident	82.6	Confident	103 Å²	103	72.8 Å²	72.8	55%	0.551	40%	0.395	S	S	*	.	H	α-helix	trans	-64.2	-41.1	176.6	-76.1	-17.2	0	0	0	111.8	E265 I267 I271 I272 S273	E265-D269 WeakPolarHBondContact O-CB 3.2Å; E265-D269 PolarHBondContact O-N 2.7Å; I267-D269 VanDerWaalsContact C-N 3.34Å; D269-I271 VanDerWaalsContact C-N 3.35Å; D269-I271 PolarHBondContact O-N 3.07Å; D269-I272 PolarHBondContact O-N 3.32Å; D269-S273 VanDerWaalsContact O-CB 3.22Å; D269-S273 WeakPolarHBondContact O-CB 3.1Å; D269-S273 PolarHBondContact O-N 3.47Å; D269-S273 PolarHBondContact O-OG 3.06Å
270	E	83.2	Confident	82.5	Confident	57 Å²	57	71.4 Å²	71.4	27%	0.266	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-41.4	176.7	-169.5	173.2	152.5	0	0	112	E266 I267 S273 N274 T282	E266-E270 PolarHBondContact O-N 2.93Å; E266-E270 VanDerWaalsContact O-N 3.11Å; I267-E270 PolarHBondContact O-N 2.81Å; E270-S273 PolarHBondContact O-OG 3.5Å; E270-N274 WeakPolarHBondContact O-CB 3.33Å; E270-N274 PolarHBondContact O-N 2.72Å; E270-N274 VanDerWaalsContact O-N 3.07Å; E270-N274 PolarHBondContact O-ND2 2.89Å; E270-T282 PolarHBondContact OE1-OG1 3.22Å; E270-T282 WeakPolarHBondContact OE2-CG2 3.41Å
271	I	81.9	Confident	82.4	Confident	43 Å²	43	73.2 Å²	73.2	22%	0.221	41%	0.414	C	S	.	.	H	α-helix	trans	-68.2	-36.7	177.8	-66	158.3	0	0	0	111.7	L6 I257 A261 I267 A268 D269 V278	L6-I271 HydrophobicContact CD2-CG2 4.08Å; I257-I271 HydrophobicContact CG2-CD1 3.38Å; I257-I271 HydrophobicContact CG2-CG1 4.12Å; A261-I271 HydrophobicContact CB-CD1 3.73Å; I267-I271 HydrophobicContact CG1-CD1 4.19Å; I267-I271 VanDerWaalsContact O-CD1 3.25Å; I267-I271 WeakPolarHBondContact O-CD1 3.35Å; I267-I271 WeakPolarHBondContact O-CG1 3.07Å; I267-I271 PolarHBondContact O-N 3.08Å; A268-I271 PolarHBondContact O-N 2.86Å; D269-I271 VanDerWaalsContact C-N 3.35Å; D269-I271 PolarHBondContact O-N 3.07Å; I271-V278 HydrophobicContact CD1-CG2 4.49Å; I271-V278 HydrophobicContact CG1-CG2 3.63Å
272	I	83.7	Confident	82.3	Confident	133 Å²	133	72.9 Å²	72.9	68%	0.682	41%	0.409	S	S	*	.	H	α-helix	trans	-76.9	-37.7	-179.2	-68.2	165.5	0	0	0	111.4	A268 D269	A268-I272 WeakPolarHBondContact O-CD1 3.42Å; A268-I272 VanDerWaalsContact O-CG1 3.22Å; A268-I272 WeakPolarHBondContact O-CG1 3.46Å; A268-I272 PolarHBondContact O-N 2.8Å; D269-I272 PolarHBondContact O-N 3.32Å
273	S	82	Confident	82.3	Confident	83 Å²	83	64.9 Å²	64.9	58%	0.58	37%	0.371	S	S	*	.	H	α-helix	trans	-82.9	-31.3	-173.9	57.8	0	0	0	0	113.5	D269 E270	D269-S273 VanDerWaalsContact O-CB 3.22Å; D269-S273 WeakPolarHBondContact O-CB 3.1Å; D269-S273 PolarHBondContact O-N 3.47Å; D269-S273 PolarHBondContact O-OG 3.06Å; E270-S273 PolarHBondContact O-OG 3.5Å
274	N	70	Confident	82.5	Confident	78 Å²	78	64.8 Å²	64.8	42%	0.417	37%	0.368	S	S	.	.			trans	-112.7	127.9	-174.6	-57.5	-56.6	0	0	0	111.3	E270 V276	E270-N274 WeakPolarHBondContact O-CB 3.33Å; E270-N274 PolarHBondContact O-N 2.72Å; E270-N274 VanDerWaalsContact O-N 3.07Å; E270-N274 PolarHBondContact O-ND2 2.89Å; N274-V276 HydrophobicContact CB-CB 4.38Å; N274-V276 PolarHBondContact O-N 3.08Å; N274-V276 VanDerWaalsContact O-N 3.12Å
275	D	68	Low	82.7	Confident	153 Å²	153	70.3 Å²	70.3	82%	0.818	39%	0.394	S	S	*	.	S	Bend	trans	-75	14.1	165.5	-77.8	-32.4	0	0	0	112.3
276	V	71	Confident	82.9	Confident	104 Å²	104	62.5 Å²	62.5	63%	0.63	36%	0.357	S	S	*	.	S	Bend	trans	-101.5	136.6	-177.7	-176.8	0	0	0	0	109.1	N274 V278	N274-V276 HydrophobicContact CB-CB 4.38Å; N274-V276 PolarHBondContact O-N 3.08Å; N274-V276 VanDerWaalsContact O-N 3.12Å; V276-V278 PolarHBondContact O-N 2.85Å
277	P	73.5	Confident	83.3	Confident	80 Å²	80	57 Å²	57	52%	0.519	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-58.7	130.7	175.2	23.9	-34.2	0	0	0	111	S279	P277-S279 PolarHBondContact O-N 2.82Å
278	V	80.5	Confident	83.6	Confident	11 Å²	11	58.2 Å²	58.2	7%	0.067	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-55.6	130.3	179.6	-173.1	0	0	0	0	110.1	R253 I267 I271 V276 T282 I283	R253-V278 PolarHBondContact NH2-O 2.83Å; I267-V278 HydrophobicContact CD1-CG1 4.27Å; I267-V278 HydrophobicContact CG1-CG1 4.29Å; I271-V278 HydrophobicContact CD1-CG2 4.49Å; I271-V278 HydrophobicContact CG1-CG2 3.63Å; V276-V278 PolarHBondContact O-N 2.85Å; V278-T282 HydrophobicContact CG1-CG2 3.9Å; V278-I283 HydrophobicContact CB-CD1 4.44Å; V278-I283 HydrophobicContact CB-CG1 4.3Å; V278-I283 HydrophobicContact CG1-CD1 4.42Å; V278-I283 HydrophobicContact CG1-CG1 3.77Å
279	S	85.7	Confident	83.8	Confident	59 Å²	59	60 Å²	60	41%	0.413	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-65.8	148.7	-177.7	88.2	0	0	0	0	111.6	P277 G281 T282 I283	P277-S279 PolarHBondContact O-N 2.82Å; S279-G281 PolarHBondContact O-N 2.91Å; S279-G281 PolarHBondContact OG-N 3.34Å; S279-T282 PolarHBondContact O-N 3.12Å; S279-T282 PolarHBondContact OG-N 3.2Å; S279-T282 VanDerWaalsContact OG-N 3.08Å; S279-T282 PolarHBondContact OG-OG1 3.14Å; S279-I283 WeakPolarHBondContact O-CG1 3.45Å; S279-I283 PolarHBondContact O-N 3.43Å; S279-I283 VanDerWaalsContact O-N 3.09Å
280	A	85.8	Confident	84.1	Confident	37 Å²	37	55 Å²	55	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-57.3	-34.2	175.5	0	0	0	0	0	112.4	T218 K284	T218-A280 WeakPolarHBondContact O-CA 3.48Å; T218-A280 WeakPolarHBondContact O-CB 3.34Å; A280-K284 VanDerWaalsContact O-CG 3.31Å; A280-K284 WeakPolarHBondContact O-CG 3.4Å; A280-K284 PolarHBondContact O-N 3.4Å
281	G	87.7	Confident	84.5	Confident	38 Å²	38	52.4 Å²	52.4	39%	0.392	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-45.7	177.4	0	0	0	0	0	112.4	S279 K284 Q285	S279-G281 PolarHBondContact O-N 2.91Å; S279-G281 PolarHBondContact OG-N 3.34Å; G281-K284 PolarHBondContact O-N 3.09Å; G281-Q285 WeakPolarHBondContact O-CG 3.47Å; G281-Q285 PolarHBondContact O-N 3.07Å
282	T	87.6	Confident	84.8	Confident	22 Å²	22	53.8 Å²	53.8	14%	0.135	31%	0.309	C	S	.	.	H	α-helix	trans	-60.1	-46.8	175.6	-48.9	0	0	0	0	110.8	E270 V278 S279 K284 Q285 C286	E270-T282 PolarHBondContact OE1-OG1 3.22Å; E270-T282 WeakPolarHBondContact OE2-CG2 3.41Å; V278-T282 HydrophobicContact CG1-CG2 3.9Å; S279-T282 PolarHBondContact O-N 3.12Å; S279-T282 PolarHBondContact OG-N 3.2Å; S279-T282 VanDerWaalsContact OG-N 3.08Å; S279-T282 PolarHBondContact OG-OG1 3.14Å; T282-K284 VanDerWaalsContact C-N 3.31Å; T282-K284 PolarHBondContact O-N 3.26Å; T282-Q285 PolarHBondContact O-N 3.28Å; T282-C286 WeakPolarHBondContact O-CB 3.28Å; T282-C286 PolarHBondContact O-N 2.85Å
283	I	89.6	Confident	85	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.6	-45.5	178.8	-65.2	171.6	0	0	0	110.4	T218 I257 L260 V278 S279 Q285 C286 I287	T218-I283 HydrophobicContact CG2-CG2 3.94Å; I257-I283 HydrophobicContact CD1-CD1 4.05Å; I257-I283 HydrophobicContact CG1-CD1 4.17Å; L260-I283 HydrophobicContact CD1-CG2 3.98Å; V278-I283 HydrophobicContact CB-CD1 4.44Å; V278-I283 HydrophobicContact CB-CG1 4.3Å; V278-I283 HydrophobicContact CG1-CD1 4.42Å; V278-I283 HydrophobicContact CG1-CG1 3.77Å; S279-I283 WeakPolarHBondContact O-CG1 3.45Å; S279-I283 PolarHBondContact O-N 3.43Å; S279-I283 VanDerWaalsContact O-N 3.09Å; I283-Q285 PolarHBondContact O-N 2.95Å; I283-C286 WeakPolarHBondContact O-CB 3.39Å; I283-C286 PolarHBondContact O-N 3.47Å; I283-I287 HydrophobicContact CG2-CD1 3.78Å; I283-I287 HydrophobicContact CG2-CG1 4.41Å; I283-I287 VanDerWaalsContact O-CG1 3.28Å; I283-I287 WeakPolarHBondContact O-CG1 3.32Å; I283-I287 PolarHBondContact O-N 3.21Å
284	K	90.6	Very high	85.2	Confident	57 Å²	57	53.5 Å²	53.5	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-41.5	178.7	-73.4	178.8	-179.9	-172.5	0	112.7	T218 A280 G281 T282 I287 S288 Y320	T218-K284 HydrophobicContact CG2-CG 4.38Å; T218-K284 WeakPolarHBondContact OG1-CE 3.47Å; A280-K284 VanDerWaalsContact O-CG 3.31Å; A280-K284 WeakPolarHBondContact O-CG 3.4Å; A280-K284 PolarHBondContact O-N 3.4Å; G281-K284 PolarHBondContact O-N 3.09Å; T282-K284 VanDerWaalsContact C-N 3.31Å; T282-K284 PolarHBondContact O-N 3.26Å; K284-I287 PolarHBondContact O-N 3.41Å; K284-S288 PolarHBondContact O-N 3.29Å; K284-Y320 HydrophobicContact CB-CE1 4.2Å; K284-Y320 HydrophobicContact CG-CE1 4.21Å
285	Q	89	Confident	86	Confident	120 Å²	120	53.4 Å²	53.4	56%	0.561	29%	0.289	S	S	*	.	H	α-helix	trans	-64.9	-42.3	175.9	-72.2	174.4	-3.4	0	0	111.8	G281 T282 I283 S288 R289	G281-Q285 WeakPolarHBondContact O-CG 3.47Å; G281-Q285 PolarHBondContact O-N 3.07Å; T282-Q285 PolarHBondContact O-N 3.28Å; I283-Q285 PolarHBondContact O-N 2.95Å; Q285-S288 WeakPolarHBondContact O-CB 3.47Å; Q285-S288 PolarHBondContact O-N 2.8Å; Q285-R289 WeakPolarHBondContact O-CG 3.25Å; Q285-R289 PolarHBondContact O-N 2.97Å
286	C	91.5	Very high	87.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.7	-50.3	174.4	-178.2	0	0	0	0	111.1	D264 I267 T282 I283 S288 R289 V290	D264-C286 PolarHBondContact OD2-SG 2.75Å; D264-C286 VanDerWaalsContact OD2-SG 3.41Å; I267-C286 HydrophobicContact CD1-CB 3.87Å; T282-C286 WeakPolarHBondContact O-CB 3.28Å; T282-C286 PolarHBondContact O-N 2.85Å; I283-C286 WeakPolarHBondContact O-CB 3.39Å; I283-C286 PolarHBondContact O-N 3.47Å; C286-S288 VanDerWaalsContact C-N 3.29Å; C286-S288 PolarHBondContact O-N 3.35Å; C286-R289 PolarHBondContact O-N 3.23Å; C286-R289 VanDerWaalsContact O-N 3.13Å; C286-V290 WeakPolarHBondContact O-CG2 3.16Å; C286-V290 PolarHBondContact O-N 3.13Å
287	I	92.4	Very high	88.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.6	-45.7	177.3	-66.3	161.6	0	0	0	110.4	L198 L200 T218 L260 I283 K284 R289 V290 T291 P298 Y320	L198-I287 HydrophobicContact CD2-CG1 4.09Å; L200-I287 HydrophobicContact CD2-CD1 3.69Å; L200-I287 HydrophobicContact CD2-CG1 4.39Å; L200-I287 HydrophobicContact CD2-CG2 4.37Å; T218-I287 HydrophobicContact CG2-CD1 3.97Å; L260-I287 HydrophobicContact CD1-CG1 3.94Å; L260-I287 HydrophobicContact CD2-CG1 4.07Å; I283-I287 HydrophobicContact CG2-CD1 3.78Å; I283-I287 HydrophobicContact CG2-CG1 4.41Å; I283-I287 VanDerWaalsContact O-CG1 3.28Å; I283-I287 WeakPolarHBondContact O-CG1 3.32Å; I283-I287 PolarHBondContact O-N 3.21Å; K284-I287 PolarHBondContact O-N 3.41Å; I287-R289 PolarHBondContact O-N 2.88Å; I287-V290 VanDerWaalsContact O-CG2 3.25Å; I287-V290 WeakPolarHBondContact O-CG2 3.24Å; I287-V290 PolarHBondContact O-N 3.47Å; I287-T291 VanDerWaalsContact O-CB 3.26Å; I287-T291 WeakPolarHBondContact O-CB 3.18Å; I287-T291 PolarHBondContact O-N 3.07Å; I287-T291 PolarHBondContact O-OG1 3.45Å; I287-P298 HydrophobicContact CG2-CB 4.32Å; I287-P298 HydrophobicContact CG2-CG 3.9Å; I287-Y320 HydrophobicContact CB-CD1 3.83Å; I287-Y320 HydrophobicContact CB-CE1 3.72Å; I287-Y320 HydrophobicContact CD1-CE1 4.05Å; I287-Y320 HydrophobicContact CG2-CD1 3.39Å; I287-Y320 HydrophobicContact CG2-CD2 4.47Å; I287-Y320 HydrophobicContact CG2-CE1 3.58Å; I287-Y320 HydrophobicContact CG2-CG 3.88Å
288	S	91	Very high	89.2	Confident	24 Å²	24	37.7 Å²	37.7	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-49.4	176.7	179.1	0	0	0	0	111.7	K284 Q285 C286 V290 T291 E292	K284-S288 PolarHBondContact O-N 3.29Å; Q285-S288 WeakPolarHBondContact O-CB 3.47Å; Q285-S288 PolarHBondContact O-N 2.8Å; C286-S288 VanDerWaalsContact C-N 3.29Å; C286-S288 PolarHBondContact O-N 3.35Å; S288-V290 PolarHBondContact O-N 2.88Å; S288-T291 PolarHBondContact O-N 2.94Å; S288-E292 WeakPolarHBondContact O-CG 3.44Å; S288-E292 PolarHBondContact O-N 3.34Å
289	R	89.7	Confident	89.9	Confident	57 Å²	57	37.2 Å²	37.2	22%	0.215	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-44.7	178.9	-70.2	-173	-59.9	-120.1	6.3	113.4	D264 E266 Q285 C286 I287 T291 E292 K293	D264-R289 IonicContact OD1-NH2 3Å; D264-R289 IonicContact OD2-CZ 3.77Å; D264-R289 IonicContact OD2-NE 3.58Å; D264-R289 PolarHBondContact OD2-NE 3.26Å; D264-R289 IonicContact OD2-NH2 3.14Å; D264-R289 PolarHBondContact OD2-NH2 2.81Å; E266-R289 IonicContact OE2-CZ 3.02Å; E266-R289 IonicContact OE2-NE 3.93Å; E266-R289 IonicContact OE2-NH1 3.22Å; E266-R289 PolarHBondContact OE2-NH1 2.92Å; E266-R289 IonicContact OE2-NH2 3.64Å; E266-R289 PolarHBondContact OE2-NH2 3.49Å; E266-R289 VanDerWaalsContact OE2-NH2 3.13Å; Q285-R289 WeakPolarHBondContact O-CG 3.25Å; Q285-R289 PolarHBondContact O-N 2.97Å; C286-R289 PolarHBondContact O-N 3.23Å; C286-R289 VanDerWaalsContact O-N 3.13Å; I287-R289 PolarHBondContact O-N 2.88Å; R289-T291 VanDerWaalsContact C-N 3.3Å; R289-T291 PolarHBondContact O-N 3.47Å; R289-E292 PolarHBondContact O-N 2.87Å; R289-K293 WeakPolarHBondContact O-CG 3.33Å; R289-K293 PolarHBondContact O-N 2.91Å
290	V	91.2	Very high	90.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-70	-30.2	179.6	-61.9	0	0	0	0	111.9	L260 L263 D264 C286 I287 S288 R294 L295 V296	L260-V290 HydrophobicContact CD2-CG2 3.99Å; L263-V290 HydrophobicContact CB-CG1 4.04Å; D264-V290 HydrophobicContact CB-CG1 4.07Å; C286-V290 WeakPolarHBondContact O-CG2 3.16Å; C286-V290 PolarHBondContact O-N 3.13Å; I287-V290 VanDerWaalsContact O-CG2 3.25Å; I287-V290 WeakPolarHBondContact O-CG2 3.24Å; I287-V290 PolarHBondContact O-N 3.47Å; S288-V290 PolarHBondContact O-N 2.88Å; V290-R294 PolarHBondContact O-N 3.2Å; V290-L295 PolarHBondContact O-N 3.45Å; V290-L295 VanDerWaalsContact O-N 3.08Å; V290-V296 HydrophobicContact CB-CG2 3.94Å; V290-V296 HydrophobicContact CG2-CG2 3.34Å
291	T	91.7	Very high	90.7	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-69.1	-45.6	173.9	-55	0	0	0	0	110.8	P167 I287 S288 R289 K293 R294 P298	P167-T291 HydrophobicContact CB-CG2 4.24Å; P167-T291 WeakPolarHBondContact CB-O 3.36Å; I287-T291 VanDerWaalsContact O-CB 3.26Å; I287-T291 WeakPolarHBondContact O-CB 3.18Å; I287-T291 PolarHBondContact O-N 3.07Å; I287-T291 PolarHBondContact O-OG1 3.45Å; S288-T291 PolarHBondContact O-N 2.94Å; R289-T291 VanDerWaalsContact C-N 3.3Å; R289-T291 PolarHBondContact O-N 3.47Å; T291-K293 VanDerWaalsContact C-N 3.28Å; T291-K293 PolarHBondContact O-N 3.34Å; T291-R294 WeakPolarHBondContact O-CA 3.1Å; T291-R294 PolarHBondContact O-N 3.47Å; T291-P298 HydrophobicContact CG2-CG 4.01Å; T291-P298 WeakPolarHBondContact OG1-CG 3.2Å
292	E	88.5	Confident	90.9	Very high	72 Å²	72	31.5 Å²	31.5	34%	0.336	15%	0.145	S	C	.	.	H	α-helix	trans	-60	-37.3	175.1	-73.7	-175.2	170.6	0	0	112.5	S288 R289 R294 P322	S288-E292 WeakPolarHBondContact O-CG 3.44Å; S288-E292 PolarHBondContact O-N 3.34Å; R289-E292 PolarHBondContact O-N 2.87Å; E292-R294 PolarHBondContact O-N 3.23Å; E292-P322 HydrophobicContact CG-CB 4.23Å
293	K	87.2	Confident	91	Very high	115 Å²	115	30.5 Å²	30.5	50%	0.5	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-11	173.3	-69	174.9	-176.6	175.4	0	113.5	R289 T291 L295	R289-K293 WeakPolarHBondContact O-CG 3.33Å; R289-K293 PolarHBondContact O-N 2.91Å; T291-K293 VanDerWaalsContact C-N 3.28Å; T291-K293 PolarHBondContact O-N 3.34Å; K293-L295 VanDerWaalsContact C-N 3.32Å; K293-L295 HydrophobicContact CB-CD1 4.14Å; K293-L295 HydrophobicContact CB-CG 3.95Å; K293-L295 HydrophobicContact CD-CD1 4.27Å
294	R	87.5	Confident	91	Very high	95 Å²	95	30.5 Å²	30.5	36%	0.358	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	34.9	-176.3	-58.5	175.4	-62.1	-64.2	-24.3	113.7	K165 L166 V290 T291 E292	K165-R294 WeakPolarHBondContact O-CD 3.4Å; K165-R294 PolarHBondContact O-NH1 3.06Å; L166-R294 WeakPolarHBondContact O-CD 3.24Å; V290-R294 PolarHBondContact O-N 3.2Å; T291-R294 WeakPolarHBondContact O-CA 3.1Å; T291-R294 PolarHBondContact O-N 3.47Å; E292-R294 PolarHBondContact O-N 3.23Å
295	L	86.8	Confident	90.8	Very high	77 Å²	77	33.7 Å²	33.7	40%	0.403	15%	0.154	S	C	.	.	S	Bend	trans	-84.9	-28.1	177.3	-63	176.7	0	0	0	112.3	L263 V290 K293	L263-L295 HydrophobicContact CD2-CB 4.41Å; V290-L295 PolarHBondContact O-N 3.45Å; V290-L295 VanDerWaalsContact O-N 3.08Å; K293-L295 VanDerWaalsContact C-N 3.32Å; K293-L295 HydrophobicContact CB-CD1 4.14Å; K293-L295 HydrophobicContact CB-CG 3.95Å; K293-L295 HydrophobicContact CD-CD1 4.27Å
296	V	91.4	Very high	90.6	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	160.2	179.5	-67	0	0	0	0	110.6	T196 L198 L263 V290	T196-V296 WeakPolarHBondContact O-CA 3.3Å; L198-V296 HydrophobicContact CB-CB 4.29Å; L198-V296 HydrophobicContact CD2-CG2 4.43Å; L263-V296 HydrophobicContact CD1-CG1 3.24Å; V290-V296 HydrophobicContact CB-CG2 3.94Å; V290-V296 HydrophobicContact CG2-CG2 3.34Å
297	L	92.6	Very high	90.2	Very high	5 Å²	5	34 Å²	34	3%	0.026	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.2	168.8	-70.3	174.6	0	0	0	109.4	W158 A168 V170 I189 M193 I195 T196 P197 L198 V299	W158-L297 HydrophobicContact CH2-CD2 3.92Å; W158-L297 HydrophobicContact CZ2-CD1 4.38Å; W158-L297 HydrophobicContact CZ2-CD2 4.35Å; A168-L297 HydrophobicContact CB-CD2 3.84Å; A168-L297 WeakPolarHBondContact O-CD2 3.42Å; V170-L297 HydrophobicContact CG2-CB 4.07Å; V170-L297 HydrophobicContact CG2-CD1 4.22Å; I189-L297 HydrophobicContact CG2-CD1 4.08Å; M193-L297 HydrophobicContact SD-CD1 4.14Å; I195-L297 HydrophobicContact CB-CD1 4.25Å; I195-L297 HydrophobicContact CB-CG 4.45Å; I195-L297 HydrophobicContact CD1-CD1 4.43Å; I195-L297 HydrophobicContact CG2-CB 4.5Å; I195-L297 HydrophobicContact CG2-CD1 4.14Å; I195-L297 HydrophobicContact CG2-CG 3.8Å; T196-L297 PolarHBondContact O-N 2.83Å; P197-L297 CarbonylContact C-O 3.51Å; P197-L297 WeakPolarHBondContact CA-O 3.41Å; L198-L297 PolarHBondContact N-O 3.16Å; L297-V299 WeakPolarHBondContact O-CG2 3.49Å; L297-V299 PolarHBondContact O-N 2.96Å
298	P	95	Very high	90	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	129	172.4	-17.4	29.7	0	0	0	110.6	A168 L169 V170 L198 L200 I287 T291	A168-P298 WeakPolarHBondContact O-CD 3.22Å; L169-P298 HydrophobicContact CD1-CB 4.18Å; V170-P298 PolarHBondContact N-O 2.88Å; L198-P298 WeakPolarHBondContact O-CA 3.19Å; L200-P298 HydrophobicContact CD1-CB 3.84Å; L200-P298 HydrophobicContact CD2-CB 4.37Å; L200-P298 HydrophobicContact CG-CB 4.13Å; I287-P298 HydrophobicContact CG2-CB 4.32Å; I287-P298 HydrophobicContact CG2-CG 3.9Å; T291-P298 HydrophobicContact CG2-CG 4.01Å; T291-P298 WeakPolarHBondContact OG1-CG 3.2Å
299	V	95.2	Very high	89.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	127.1	-176.9	-172	0	0	0	0	110.3	V170 L172 L186 I189 P197 L198 L199 L200 L297	V170-V299 HydrophobicContact CB-CB 4.5Å; V170-V299 HydrophobicContact CB-CG1 4.36Å; V170-V299 HydrophobicContact CB-CG2 4.12Å; V170-V299 HydrophobicContact CG1-CG1 4.25Å; V170-V299 WeakPolarHBondContact O-CA 3.37Å; L172-V299 HydrophobicContact CD1-CG1 3.85Å; L172-V299 HydrophobicContact CD2-CG1 4.29Å; L172-V299 HydrophobicContact CG-CG1 3.75Å; L186-V299 HydrophobicContact CD2-CB 4.18Å; L186-V299 HydrophobicContact CD2-CG1 4.07Å; L186-V299 HydrophobicContact CD2-CG2 3.94Å; I189-V299 HydrophobicContact CD1-CG2 4.31Å; P197-V299 HydrophobicContact CB-CG2 3.61Å; L198-V299 PolarHBondContact O-N 2.94Å; L199-V299 HydrophobicContact CD1-CB 4.44Å; L199-V299 HydrophobicContact CD1-CG1 4.41Å; L200-V299 PolarHBondContact N-O 2.8Å; L200-V299 VanDerWaalsContact N-O 3.11Å; L297-V299 WeakPolarHBondContact O-CG2 3.49Å; L297-V299 PolarHBondContact O-N 2.96Å
300	L	94.3	Very high	89.7	Confident	7 Å²	7	30.5 Å²	30.5	4%	0.037	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	165.8	166.4	-62.6	108.8	0	0	0	109.8	L169 V170 F171 L172 L200 T312 A316	L169-L300 HydrophobicContact CD1-CD1 3.82Å; L169-L300 HydrophobicContact CD2-CD1 3.68Å; L169-L300 HydrophobicContact CG-CD1 3.97Å; V170-L300 PolarHBondContact O-N 3.1Å; F171-L300 WeakPolarHBondContact CA-O 3.2Å; F171-L300 HydrophobicContact CD2-CB 4.32Å; L172-L300 PolarHBondContact N-O 2.93Å; L200-L300 HydrophobicContact CD1-CD1 4.27Å; L200-L300 HydrophobicContact CD1-CG 4.45Å; L300-T312 HydrophobicContact CD2-CG2 3.66Å; L300-A316 HydrophobicContact CD1-CB 3.5Å; L300-A316 HydrophobicContact CD2-CB 3.99Å; L300-A316 HydrophobicContact CG-CB 4.42Å
301	F	93.9	Very high	89.6	Confident	8 Å²	8	32 Å²	32	4%	0.035	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.3	177.2	58.8	-97.9	0	0	0	111.6	L172 I175 I182 L199 S201 P203 V211 W225	L172-F301 HydrophobicContact CB-CB 3.92Å; L172-F301 CarbonylContact O-C 3.58Å; L172-F301 VanDerWaalsContact O-CA 3.29Å; L172-F301 WeakPolarHBondContact O-CA 3.46Å; I175-F301 HydrophobicContact CD1-CB 4Å; I175-F301 HydrophobicContact CD1-CD2 3.57Å; I175-F301 HydrophobicContact CD1-CE2 4.36Å; I175-F301 HydrophobicContact CD1-CG 3.95Å; I182-F301 HydrophobicContact CD1-CB 4.48Å; I182-F301 HydrophobicContact CD1-CD1 3.78Å; I182-F301 HydrophobicContact CD1-CD2 4.32Å; I182-F301 HydrophobicContact CD1-CE1 4.06Å; I182-F301 HydrophobicContact CD1-CG 3.93Å; I182-F301 HydrophobicContact CD1-CZ 4.47Å; L199-F301 HydrophobicContact CD1-CD1 4.05Å; L199-F301 HydrophobicContact CD1-CE1 4.23Å; S201-F301 WeakPolarHBondContact O-CE1 3.43Å; P203-F301 HydrophobicContact CB-CE1 4.37Å; P203-F301 HydrophobicContact CB-CE2 4.05Å; P203-F301 HydrophobicContact CB-CZ 3.72Å; P203-F301 HydrophobicContact CG-CZ 4.47Å; V211-F301 HydrophobicContact CG1-CD2 4.49Å; V211-F301 HydrophobicContact CG1-CE2 3.94Å; W225-F301 HydrophobicContact CH2-CE2 4.35Å
302	G	91.4	Very high	89.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.149	C	C	.	.			trans	176.5	-166.1	176.8	0	0	0	0	0	112.6	L172 N173 K174 I175 Q308	L172-G302 PolarHBondContact O-N 3.25Å; N173-G302 CarbonylContact C-O 3.48Å; N173-G302 WeakPolarHBondContact CA-O 3.33Å; K174-G302 PolarHBondContact N-O 3Å; I175-G302 WeakPolarHBondContact CG2-O 3.43Å; I175-G302 PolarHBondContact N-O 3.48Å; G302-Q308 WeakPolarHBondContact CA-O 3.26Å
303	S	91	Very high	89.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-133.8	106.8	172.7	174.6	0	0	0	0	108.4	D176 Q305 R306 N307 Q308	D176-S303 VanDerWaalsContact CG-OG 3.24Å; D176-S303 WeakPolarHBondContact OD1-CB 3.36Å; D176-S303 PolarHBondContact OD1-OG 2.92Å; S303-Q305 PolarHBondContact O-N 3.14Å; S303-R306 CarbonylContact O-C 3.52Å; S303-R306 PolarHBondContact O-N 3.13Å; S303-R306 PolarHBondContact OG-N 3.02Å; S303-N307 PolarHBondContact O-N 3.45Å; S303-Q308 PolarHBondContact N-O 3.29Å; S303-Q308 PolarHBondContact O-N 2.97Å
304	A	89.7	Confident	89.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-37.5	174.1	0	0	0	0	0	110.8	T63 T64 R67 N173 R306 N307	T63-A304 HydrophobicContact CG2-CB 4.2Å; T64-A304 WeakPolarHBondContact OG1-CB 3.44Å; R67-A304 WeakPolarHBondContact CD-O 3.46Å; R67-A304 HydrophobicContact CG-CB 4.24Å; R67-A304 WeakPolarHBondContact CG-O 3.39Å; R67-A304 PolarHBondContact NE-O 3.36Å; N173-A304 WeakPolarHBondContact OD1-CB 3.44Å; N173-A304 PolarHBondContact OD1-N 3.43Å; A304-R306 VanDerWaalsContact C-N 3.29Å; A304-R306 PolarHBondContact O-N 3.11Å; A304-N307 PolarHBondContact O-N 3.48Å; A304-N307 VanDerWaalsContact O-N 3.14Å
305	Q	86.3	Confident	90.1	Very high	124 Å²	124	21.6 Å²	21.6	58%	0.579	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-42.5	178.6	-169.7	170.5	7.5	0	0	111.7	R67 S303	R67-Q305 PolarHBondContact NH2-O 3.24Å; S303-Q305 PolarHBondContact O-N 3.14Å
306	R	84.3	Confident	90.4	Very high	121 Å²	121	18.1 Å²	18.1	46%	0.457	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	7.6	178.8	-57.4	-170.5	-173.5	-168.3	0.5	114.9	D176 S303 A304 Q308	D176-R306 IonicContact OD2-CZ 3.46Å; D176-R306 IonicContact OD2-NE 2.84Å; D176-R306 PolarHBondContact OD2-NE 2.96Å; D176-R306 IonicContact OD2-NH2 3.42Å; D176-R306 PolarHBondContact OD2-NH2 2.92Å; S303-R306 CarbonylContact O-C 3.52Å; S303-R306 PolarHBondContact O-N 3.13Å; S303-R306 PolarHBondContact OG-N 3.02Å; A304-R306 VanDerWaalsContact C-N 3.29Å; A304-R306 PolarHBondContact O-N 3.11Å; R306-Q308 VanDerWaalsContact C-N 3.26Å; R306-Q308 HydrophobicContact CB-CG 3.94Å; R306-Q308 PolarHBondContact O-N 3.44Å
307	N	84.3	Confident	90.5	Very high	5 Å²	5	18 Å²	18	3%	0.027	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	37.7	-175.8	-161.3	28.6	0	0	0	113.9	M78 S233 S303 A304	M78-N307 HydrophobicContact CE-CB 3.78Å; S233-N307 WeakPolarHBondContact CB-O 3.49Å; S233-N307 PolarHBondContact OG-O 2.98Å; S303-N307 PolarHBondContact O-N 3.45Å; A304-N307 PolarHBondContact O-N 3.48Å; A304-N307 VanDerWaalsContact O-N 3.14Å
308	Q	86.6	Confident	90.5	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.019	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-103.5	130.8	-179.2	-67.5	174.3	-6.9	0	0	110.2	W225 G302 S303 R306 V310	W225-Q308 HydrophobicContact CB-CG 4.46Å; W225-Q308 HydrophobicContact CD2-CB 3.83Å; W225-Q308 HydrophobicContact CD2-CG 3.81Å; W225-Q308 HydrophobicContact CE3-CB 4.02Å; W225-Q308 HydrophobicContact CE3-CG 3.89Å; W225-Q308 HydrophobicContact CG-CB 4.36Å; W225-Q308 HydrophobicContact CG-CG 4.04Å; W225-Q308 HydrophobicContact CH2-CB 4.19Å; W225-Q308 HydrophobicContact CZ2-CB 4Å; W225-Q308 HydrophobicContact CZ3-CB 4.18Å; W225-Q308 HydrophobicContact CZ3-CG 4.43Å; G302-Q308 WeakPolarHBondContact CA-O 3.26Å; S303-Q308 PolarHBondContact N-O 3.29Å; S303-Q308 PolarHBondContact O-N 2.97Å; R306-Q308 VanDerWaalsContact C-N 3.26Å; R306-Q308 HydrophobicContact CB-CG 3.94Å; R306-Q308 PolarHBondContact O-N 3.44Å; Q308-V310 PolarHBondContact O-N 2.87Å
309	G	85.9	Confident	90.3	Very high	5 Å²	5	22.2 Å²	22.2	5%	0.052	11%	0.105	C	C	.	.	S	Bend	trans	78.2	-9.9	178.2	0	0	0	0	0	115.6	H311 T312 L313	G309-H311 PolarHBondContact O-N 2.8Å; G309-T312 WeakPolarHBondContact O-CB 3.29Å; G309-T312 PolarHBondContact O-N 2.96Å; G309-L313 WeakPolarHBondContact O-CB 3.35Å; G309-L313 PolarHBondContact O-N 2.78Å
310	V	89.4	Confident	90.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.2	-37.2	-177	-178.3	0	0	0	0	112.9	R67 M68 A71 Q308 L313 L314	R67-V310 HydrophobicContact CB-CB 4.42Å; R67-V310 HydrophobicContact CB-CG1 3.91Å; R67-V310 HydrophobicContact CB-CG2 3.85Å; R67-V310 HydrophobicContact CG-CG2 4.37Å; M68-V310 HydrophobicContact CG-CG1 3.98Å; A71-V310 HydrophobicContact CB-CG1 4.29Å; Q308-V310 PolarHBondContact O-N 2.87Å; V310-L313 WeakPolarHBondContact O-CB 3.21Å; V310-L313 PolarHBondContact O-N 2.92Å; V310-L314 WeakPolarHBondContact O-CG 3.42Å; V310-L314 PolarHBondContact O-N 2.75Å
311	H	88.5	Confident	90	Very high	31 Å²	31	22.5 Å²	22.5	14%	0.144	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-44.7	176.4	-68.5	72.1	0	0	0	111.3	W110 H235 G309 L313 L314 D315	W110-H311 AromaticContact CH2-CD2 3.73Å; H235-H311 AromaticContact CD2-CD2 3.57Å; G309-H311 PolarHBondContact O-N 2.8Å; H311-L313 VanDerWaalsContact C-N 3.26Å; H311-L313 PolarHBondContact O-N 2.78Å; H311-L314 PolarHBondContact O-N 3.06Å; H311-D315 PolarHBondContact O-N 2.81Å
312	T	90	Very high	89.9	Confident	24 Å²	24	22.2 Å²	22.2	15%	0.147	10%	0.104	C	C	.	.	H	α-helix	trans	-62.4	-37.5	176	-37.8	0	0	0	0	111.3	Y214 L300 G309 D315 A316	Y214-T312 HydrophobicContact CE2-CG2 3.86Å; Y214-T312 PolarHBondContact OH-OG1 3.01Å; L300-T312 HydrophobicContact CD2-CG2 3.66Å; G309-T312 WeakPolarHBondContact O-CB 3.29Å; G309-T312 PolarHBondContact O-N 2.96Å; T312-D315 PolarHBondContact O-N 2.84Å; T312-A316 VanDerWaalsContact O-CB 3.24Å; T312-A316 WeakPolarHBondContact O-CB 3.41Å; T312-A316 PolarHBondContact O-N 2.67Å
313	L	92.9	Very high	89.7	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.3	-45	174.8	176.2	60.8	0	0	0	111.7	T64 M68 L141 L169 F171 G309 V310 H311 D315 A316 I317	T64-L313 HydrophobicContact CG2-CD2 3.97Å; M68-L313 HydrophobicContact CE-CD2 3.24Å; M68-L313 HydrophobicContact CE-CG 3.69Å; L141-L313 HydrophobicContact CD1-CD1 3.78Å; L141-L313 HydrophobicContact CD2-CD1 4.1Å; L141-L313 HydrophobicContact CD2-CD2 4.09Å; L141-L313 HydrophobicContact CD2-CG 4.36Å; L169-L313 HydrophobicContact CD2-CD1 3.45Å; L169-L313 VanDerWaalsContact CD2-CD1 3.45Å; F171-L313 HydrophobicContact CB-CD1 4.02Å; F171-L313 HydrophobicContact CB-CD2 4.14Å; F171-L313 HydrophobicContact CD1-CD2 3.86Å; F171-L313 HydrophobicContact CD2-CB 4.42Å; F171-L313 HydrophobicContact CD2-CD1 4.18Å; F171-L313 HydrophobicContact CD2-CD2 3.83Å; F171-L313 HydrophobicContact CD2-CG 4.38Å; F171-L313 HydrophobicContact CE1-CD2 4.17Å; F171-L313 HydrophobicContact CE2-CD2 4.14Å; F171-L313 HydrophobicContact CG-CD1 4.24Å; F171-L313 HydrophobicContact CG-CD2 3.68Å; F171-L313 HydrophobicContact CZ-CD2 4.3Å; G309-L313 WeakPolarHBondContact O-CB 3.35Å; G309-L313 PolarHBondContact O-N 2.78Å; V310-L313 WeakPolarHBondContact O-CB 3.21Å; V310-L313 PolarHBondContact O-N 2.92Å; H311-L313 VanDerWaalsContact C-N 3.26Å; H311-L313 PolarHBondContact O-N 2.78Å; L313-D315 VanDerWaalsContact C-N 3.35Å; L313-D315 PolarHBondContact O-N 2.69Å; L313-A316 WeakPolarHBondContact O-CB 3.49Å; L313-A316 PolarHBondContact O-N 3.29Å; L313-I317 HydrophobicContact CG-CD1 4.38Å; L313-I317 WeakPolarHBondContact O-CG1 3.29Å; L313-I317 PolarHBondContact O-N 3.4Å
314	L	92.3	Very high	89.4	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.2	-42.7	174.8	-74.7	175.6	0	0	0	112	M68 A71 F108 W110 I115 V310 H311 I317 C318	M68-L314 HydrophobicContact CB-CD2 3.96Å; M68-L314 HydrophobicContact CG-CD2 3.74Å; M68-L314 HydrophobicContact CG-CG 4.15Å; M68-L314 HydrophobicContact SD-CD2 4.11Å; A71-L314 HydrophobicContact CB-CD1 3.91Å; F108-L314 HydrophobicContact CE2-CD2 3.7Å; F108-L314 HydrophobicContact CZ-CD2 4.04Å; W110-L314 HydrophobicContact CD2-CB 3.92Å; W110-L314 HydrophobicContact CD2-CD1 3.83Å; W110-L314 HydrophobicContact CD2-CG 4.45Å; W110-L314 HydrophobicContact CE3-CD1 3.86Å; W110-L314 HydrophobicContact CG-CB 3.94Å; W110-L314 HydrophobicContact CG-CD1 4.33Å; W110-L314 HydrophobicContact CH2-CD1 4.41Å; W110-L314 HydrophobicContact CZ2-CB 4.24Å; W110-L314 HydrophobicContact CZ2-CD1 4.39Å; W110-L314 HydrophobicContact CZ3-CD1 4.16Å; I115-L314 HydrophobicContact CD1-CD2 4Å; V310-L314 WeakPolarHBondContact O-CG 3.42Å; V310-L314 PolarHBondContact O-N 2.75Å; H311-L314 PolarHBondContact O-N 3.06Å; L314-I317 HydrophobicContact CD2-CD1 4.5Å; L314-I317 PolarHBondContact O-N 3.06Å; L314-C318 PolarHBondContact O-N 2.77Å; L314-C318 PolarHBondContact O-SG 3.05Å
315	D	91.7	Very high	88.9	Confident	41 Å²	41	26.3 Å²	26.3	22%	0.219	13%	0.13	C	C	.	.	H	α-helix	trans	-61.3	-45.5	173.2	-72.8	-25.8	0	0	0	111.3	W110 N111 H311 T312 L313 I317 C318 H319	W110-D315 PolarHBondContact NE1-OD1 3.21Å; N111-D315 PolarHBondContact ND2-OD1 2.99Å; H311-D315 PolarHBondContact O-N 2.81Å; T312-D315 PolarHBondContact O-N 2.84Å; L313-D315 VanDerWaalsContact C-N 3.35Å; L313-D315 PolarHBondContact O-N 2.69Å; D315-I317 VanDerWaalsContact C-N 3.33Å; D315-I317 PolarHBondContact O-N 2.85Å; D315-C318 PolarHBondContact O-N 2.81Å; D315-C318 VanDerWaalsContact O-N 3.13Å; D315-H319 PolarHBondContact O-N 3.14Å; D315-H319 PolarHBondContact O-ND1 3.37Å
316	A	93	Very high	88.1	Confident	4 Å²	4	22.2 Å²	22.2	3%	0.033	12%	0.117	C	C	.	.	H	α-helix	trans	-61.7	-38.6	179.3	0	0	0	0	0	112.6	L169 L300 T312 L313 C318 H319 Y320	L169-A316 HydrophobicContact CD1-CB 3.86Å; L300-A316 HydrophobicContact CD1-CB 3.5Å; L300-A316 HydrophobicContact CD2-CB 3.99Å; L300-A316 HydrophobicContact CG-CB 4.42Å; T312-A316 VanDerWaalsContact O-CB 3.24Å; T312-A316 WeakPolarHBondContact O-CB 3.41Å; T312-A316 PolarHBondContact O-N 2.67Å; L313-A316 WeakPolarHBondContact O-CB 3.49Å; L313-A316 PolarHBondContact O-N 3.29Å; A316-C318 VanDerWaalsContact C-N 3.33Å; A316-C318 PolarHBondContact O-N 3.18Å; A316-H319 PolarHBondContact O-N 3.23Å; A316-Y320 HydrophobicContact CB-CD2 3.75Å; A316-Y320 HydrophobicContact CB-CE2 3.86Å; A316-Y320 WeakPolarHBondContact O-CB 3.26Å; A316-Y320 WeakPolarHBondContact O-CD2 3.36Å; A316-Y320 PolarHBondContact O-N 3.04Å
317	I	93.3	Very high	87.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-57.9	-46.6	172.8	-72.5	165.3	0	0	0	110.6	R49 V51 M68 I115 L141 L313 L314 D315 L321	R49-I317 HydrophobicContact CB-CG2 4.31Å; R49-I317 HydrophobicContact CG-CG2 4.4Å; V51-I317 HydrophobicContact CG2-CG2 3.93Å; M68-I317 HydrophobicContact CE-CD1 3.87Å; M68-I317 HydrophobicContact SD-CD1 4.38Å; I115-I317 HydrophobicContact CD1-CG2 4.02Å; I115-I317 HydrophobicContact CG1-CG2 4.39Å; L141-I317 HydrophobicContact CD2-CD1 4.17Å; L313-I317 HydrophobicContact CG-CD1 4.38Å; L313-I317 WeakPolarHBondContact O-CG1 3.29Å; L313-I317 PolarHBondContact O-N 3.4Å; L314-I317 HydrophobicContact CD2-CD1 4.5Å; L314-I317 PolarHBondContact O-N 3.06Å; D315-I317 VanDerWaalsContact C-N 3.33Å; D315-I317 PolarHBondContact O-N 2.85Å; I317-L321 HydrophobicContact CB-CD1 4.42Å; I317-L321 HydrophobicContact CG1-CD1 4.16Å; I317-L321 HydrophobicContact CG2-CD1 4.19Å; I317-L321 WeakPolarHBondContact O-CB 3.48Å; I317-L321 PolarHBondContact O-N 3Å
318	C	91.7	Very high	86.3	Confident	8 Å²	8	18.9 Å²	18.9	5%	0.054	11%	0.108	C	C	.	.	H	α-helix	trans	-67.3	-37	179.7	-65.1	0	0	0	0	112.9	R49 N113 L314 D315 A316	R49-C318 PolarHBondContact NE-O 3.35Å; R49-C318 PolarHBondContact NH2-O 3.41Å; N113-C318 HydrophobicContact CB-CB 4.49Å; L314-C318 PolarHBondContact O-N 2.77Å; L314-C318 PolarHBondContact O-SG 3.05Å; D315-C318 PolarHBondContact O-N 2.81Å; D315-C318 VanDerWaalsContact O-N 3.13Å; A316-C318 VanDerWaalsContact C-N 3.33Å; A316-C318 PolarHBondContact O-N 3.18Å
319	H	90.5	Very high	84.9	Confident	85 Å²	85	22 Å²	22	39%	0.394	13%	0.13	S	C	.	.	H	α-helix	trans	-83.8	-38.2	-175.3	-69.3	89.9	0	0	0	113.9	D315 A316	D315-H319 PolarHBondContact O-N 3.14Å; D315-H319 PolarHBondContact O-ND1 3.37Å; A316-H319 PolarHBondContact O-N 3.23Å
320	Y	92.2	Very high	83.8	Confident	11 Å²	11	28.6 Å²	28.6	4%	0.043	15%	0.154	C	C	.	.	H	α-helix	trans	-110.5	-25.1	-167	-51.2	-50.3	0	0	0	114.7	L169 L200 K284 I287 A316	L169-Y320 HydrophobicContact CD1-CD2 3.9Å; L200-Y320 HydrophobicContact CD1-CD2 3.84Å; L200-Y320 HydrophobicContact CD1-CE2 3.22Å; K284-Y320 HydrophobicContact CB-CE1 4.2Å; K284-Y320 HydrophobicContact CG-CE1 4.21Å; I287-Y320 HydrophobicContact CB-CD1 3.83Å; I287-Y320 HydrophobicContact CB-CE1 3.72Å; I287-Y320 HydrophobicContact CD1-CE1 4.05Å; I287-Y320 HydrophobicContact CG2-CD1 3.39Å; I287-Y320 HydrophobicContact CG2-CD2 4.47Å; I287-Y320 HydrophobicContact CG2-CE1 3.58Å; I287-Y320 HydrophobicContact CG2-CG 3.88Å; A316-Y320 HydrophobicContact CB-CD2 3.75Å; A316-Y320 HydrophobicContact CB-CE2 3.86Å; A316-Y320 WeakPolarHBondContact O-CB 3.26Å; A316-Y320 WeakPolarHBondContact O-CD2 3.36Å; A316-Y320 PolarHBondContact O-N 3.04Å
321	L	92.3	Very high	82.5	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	16%	0.16	C	C	.	.	S	Bend	trans	-83.1	147.3	174.6	-66.3	-178.7	0	0	0	111.1	R49 V51 L169 I317	R49-L321 VanDerWaalsContact CD-O 3.32Å; R49-L321 WeakPolarHBondContact CD-O 3.1Å; R49-L321 PolarHBondContact NE-O 3.33Å; V51-L321 HydrophobicContact CB-CD1 4.38Å; V51-L321 HydrophobicContact CG1-CD1 3.78Å; V51-L321 HydrophobicContact CG2-CD1 3.63Å; L169-L321 HydrophobicContact CB-CD2 4.02Å; L169-L321 HydrophobicContact CB-CG 4.34Å; I317-L321 HydrophobicContact CB-CD1 4.42Å; I317-L321 HydrophobicContact CG1-CD1 4.16Å; I317-L321 HydrophobicContact CG2-CD1 4.19Å; I317-L321 WeakPolarHBondContact O-CB 3.48Å; I317-L321 PolarHBondContact O-N 3Å
322	P	90.1	Very high	81	Confident	2 Å²	2	30 Å²	30	1%	0.013	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-70.6	154	-173.7	29.6	-38.1	0	0	0	112.5	R49 D138 P167 E292 A326	R49-P322 VanDerWaalsContact CD-O 3.29Å; R49-P322 WeakPolarHBondContact CD-O 3.44Å; D138-P322 HydrophobicContact CB-CG 4.15Å; D138-P322 WeakPolarHBondContact O-CG 3.44Å; P167-P322 HydrophobicContact CB-CG 4.26Å; P167-P322 HydrophobicContact CG-CG 3.93Å; E292-P322 HydrophobicContact CG-CB 4.23Å; P322-A326 HydrophobicContact CB-CB 4.2Å
323	S	88.5	Confident	79.4	Confident	15 Å²	15	31.9 Å²	31.9	11%	0.105	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-83.5	160	163.7	75	0	0	0	0	111	L45 L48 V325 A326	L45-S323 WeakPolarHBondContact O-CB 3.3Å; L48-S323 WeakPolarHBondContact O-CA 3.45Å; S323-V325 PolarHBondContact O-N 3.18Å; S323-V325 PolarHBondContact OG-N 3.01Å; S323-A326 PolarHBondContact O-N 3.43Å; S323-A326 VanDerWaalsContact O-N 3.11Å
324	P	84.7	Confident	77.8	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-51.6	-25.2	172.9	-22.7	24.3	0	0	0	114.3	L45 L48 D138 A326 N327 N328	L45-P324 HydrophobicContact CD2-CB 4.24Å; L45-P324 HydrophobicContact CD2-CG 4.45Å; L48-P324 HydrophobicContact CB-CG 4.2Å; L48-P324 HydrophobicContact CD2-CG 3.5Å; L48-P324 HydrophobicContact CG-CG 4.44Å; L48-P324 WeakPolarHBondContact O-CD 3.42Å; D138-P324 WeakPolarHBondContact OD2-CA 3.5Å; D138-P324 WeakPolarHBondContact OD2-CG 3.35Å; P324-A326 VanDerWaalsContact C-N 3.27Å; P324-A326 PolarHBondContact O-N 2.66Å; P324-N327 PolarHBondContact O-N 2.96Å; P324-N328 WeakPolarHBondContact CB-ND2 3.42Å; P324-N328 WeakPolarHBondContact O-CB 3.48Å; P324-N328 PolarHBondContact O-N 3.32Å; P324-N328 PolarHBondContact O-ND2 3.37Å; P324-N328 PolarHBondContact O-OD1 2.96Å
325	V	78.8	Confident	76.2	Confident	71 Å²	71	35.3 Å²	35.3	43%	0.43	21%	0.205	S	C	.	.	H	α-helix	trans	-60.1	-39.2	-179.2	-177	0	0	0	0	111.4	L45 N46 S323	L45-V325 HydrophobicContact CB-CG2 3.57Å; L45-V325 HydrophobicContact CD1-CG2 4.46Å; N46-V325 WeakPolarHBondContact OD1-CG2 3.44Å; S323-V325 PolarHBondContact O-N 3.18Å; S323-V325 PolarHBondContact OG-N 3.01Å
326	A	68.8	Low	74.6	Confident	38 Å²	38	36.8 Å²	36.8	31%	0.314	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-47.2	-178.5	0	0	0	0	0	111.9	P322 S323 P324 S329	P322-A326 HydrophobicContact CB-CB 4.2Å; S323-A326 PolarHBondContact O-N 3.43Å; S323-A326 VanDerWaalsContact O-N 3.11Å; P324-A326 VanDerWaalsContact C-N 3.27Å; P324-A326 PolarHBondContact O-N 2.66Å; A326-S329 PolarHBondContact O-OG 2.98Å
327	N	66	Low	73.2	Confident	43 Å²	43	47.5 Å²	47.5	23%	0.23	26%	0.258	C	S	.	.	H	α-helix	trans	-88.4	-28	-173.2	-78.1	-20.3	0	0	0	114.7	D138 P324 S329	D138-N327 WeakPolarHBondContact CA-ND2 3.47Å; D138-N327 PolarHBondContact O-ND2 3.39Å; D138-N327 WeakPolarHBondContact OD1-CB 3.4Å; P324-N327 PolarHBondContact O-N 2.96Å; N327-S329 PolarHBondContact O-N 3.42Å
328	N	65.8	Low	72.4	Confident	13 Å²	13	49 Å²	49	7%	0.07	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.2	179.8	-73.7	-12.8	0	0	0	112.9	P324 R330 V331 S332 Y361	P324-N328 WeakPolarHBondContact CB-ND2 3.42Å; P324-N328 WeakPolarHBondContact O-CB 3.48Å; P324-N328 PolarHBondContact O-N 3.32Å; P324-N328 PolarHBondContact O-ND2 3.37Å; P324-N328 PolarHBondContact O-OD1 2.96Å; N328-R330 PolarHBondContact O-N 2.88Å; N328-V331 PolarHBondContact O-N 2.83Å; N328-V331 VanDerWaalsContact O-N 3.11Å; N328-S332 WeakPolarHBondContact O-CB 3.27Å; N328-S332 PolarHBondContact O-N 2.94Å; N328-S332 PolarHBondContact O-OG 2.96Å; N328-Y361 WeakPolarHBondContact OD1-CD1 3.49Å
329	S	57.7	Low	72.1	Confident	68 Å²	68	48.6 Å²	48.6	48%	0.476	27%	0.266	S	S	.	.	H	α-helix	trans	-49.7	-41.9	178.5	57.4	0	0	0	0	112.7	A326 N327 V331 S332	A326-S329 PolarHBondContact O-OG 2.98Å; N327-S329 PolarHBondContact O-N 3.42Å; S329-V331 PolarHBondContact O-N 2.84Å; S329-S332 VanDerWaalsContact CA-OG 3.27Å; S329-S332 WeakPolarHBondContact CA-OG 3.4Å; S329-S332 PolarHBondContact O-N 2.78Å; S329-S332 PolarHBondContact O-OG 3.21Å
330	R	60.9	Low	71.9	Confident	145 Å²	145	44.5 Å²	44.5	55%	0.547	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-39.6	-179.8	-65.1	-174.5	-177.2	157.7	11	113.6	K165 N328	K165-R330 VanDerWaalsContact CD-NH2 3.31Å; N328-R330 PolarHBondContact O-N 2.88Å
331	V	62.5	Low	71.7	Confident	22 Å²	22	44 Å²	44	13%	0.133	25%	0.246	C	C	.	.	H	α-helix	trans	-86.6	-32.1	-179.6	-179	0	0	0	0	111	N328 S329 G333 F334 Y335 Y361 L447	N328-V331 PolarHBondContact O-N 2.83Å; N328-V331 VanDerWaalsContact O-N 3.11Å; S329-V331 PolarHBondContact O-N 2.84Å; V331-G333 PolarHBondContact O-N 3.37Å; V331-F334 PolarHBondContact O-N 3.4Å; V331-F334 VanDerWaalsContact O-N 3.16Å; V331-Y335 HydrophobicContact CG1-CD2 4.04Å; V331-Y335 PolarHBondContact O-N 3.46Å; V331-Y361 HydrophobicContact CB-CD1 4.43Å; V331-Y361 HydrophobicContact CG1-CG 4.29Å; V331-Y361 HydrophobicContact CG2-CD1 4.11Å; V331-Y361 HydrophobicContact CG2-CE1 4.38Å; V331-Y361 HydrophobicContact CG2-CG 4.47Å; V331-L447 HydrophobicContact CB-CD2 4.29Å; V331-L447 HydrophobicContact CG1-CD2 3.7Å; V331-L447 HydrophobicContact CG2-CD2 3.57Å
332	S	57.4	Low	71.5	Confident	37 Å²	37	44 Å²	44	26%	0.259	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-25.8	-174.8	74.2	0	0	0	0	114.3	N328 S329 F334	N328-S332 WeakPolarHBondContact O-CB 3.27Å; N328-S332 PolarHBondContact O-N 2.94Å; N328-S332 PolarHBondContact O-OG 2.96Å; S329-S332 VanDerWaalsContact CA-OG 3.27Å; S329-S332 WeakPolarHBondContact CA-OG 3.4Å; S329-S332 PolarHBondContact O-N 2.78Å; S329-S332 PolarHBondContact O-OG 3.21Å; S332-F334 VanDerWaalsContact C-N 3.27Å; S332-F334 PolarHBondContact O-N 3.49Å
333	G	56.9	Low	71.5	Confident	65 Å²	65	44 Å²	44	67%	0.67	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-28.1	177.8	0	0	0	0	0	113.5	V331	V331-G333 PolarHBondContact O-N 3.37Å
334	F	57.9	Low	71.5	Confident	66 Å²	66	43.6 Å²	43.6	29%	0.289	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-38.8	-176.4	-63	-79.4	0	0	0	112.4	V331 S332 S429 L445	V331-F334 PolarHBondContact O-N 3.4Å; V331-F334 VanDerWaalsContact O-N 3.16Å; S332-F334 VanDerWaalsContact C-N 3.27Å; S332-F334 PolarHBondContact O-N 3.49Å; F334-S429 VanDerWaalsContact O-CB 3.26Å; F334-S429 WeakPolarHBondContact O-CB 3.2Å; F334-L445 HydrophobicContact CB-CD2 4.18Å; F334-L445 HydrophobicContact CD1-CD2 3.94Å; F334-L445 HydrophobicContact CG-CD2 4.37Å
335	Y	60.3	Low	71.5	Confident	6 Å²	6	44.3 Å²	44.3	2%	0.024	25%	0.245	C	C	.	.			trans	-108.5	84.7	-175.4	-62	-81.4	0	0	0	110.2	V331 R337 C340 T420 L445	V331-Y335 HydrophobicContact CG1-CD2 4.04Å; V331-Y335 PolarHBondContact O-N 3.46Å; Y335-R337 PolarHBondContact O-N 3.12Å; Y335-C340 HydrophobicContact CD1-CB 4.18Å; Y335-C340 HydrophobicContact CD2-CB 4.01Å; Y335-C340 VanDerWaalsContact CD2-SG 3.58Å; Y335-C340 HydrophobicContact CG-CB 3.82Å; Y335-T420 HydrophobicContact CE1-CG2 4.03Å; Y335-L445 PolarHBondContact OH-O 3.38Å
336	S	57.6	Low	72	Confident	72 Å²	72	41.1 Å²	41.1	50%	0.503	23%	0.225	S	C	.	.	S	Bend	trans	-61.7	-39.2	-170.1	57.3	0	0	0	0	113.9
337	R	63.8	Low	72.8	Confident	228 Å²	228	40.6 Å²	40.6	86%	0.86	22%	0.217	S	C	*	.	S	Bend	trans	-149	-10.2	-178.5	-71.4	-170.4	178.9	164.9	-0.8	115.2	Y335	Y335-R337 PolarHBondContact O-N 3.12Å
338	S	76.4	Confident	73.7	Confident	31 Å²	31	40.3 Å²	40.3	22%	0.217	21%	0.214	C	C	.	.	S	Bend	trans	-76.3	152.7	179.4	-55.1	0	0	0	0	111.2	C340 S425	S338-C340 PolarHBondContact O-N 2.89Å; S338-S425 WeakPolarHBondContact OG-CB 3.47Å; S338-S425 PolarHBondContact OG-OG 2.87Å
339	L	84.5	Confident	74.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.			trans	-53	133.7	166.4	-175.6	74.1	0	0	0	110.4	C341 I360 K362 L365 V371 T420 D421	L339-C341 VanDerWaalsContact CD1-SG 3.52Å; L339-I360 HydrophobicContact CD1-CG2 4.22Å; L339-K362 WeakPolarHBondContact CA-O 3.42Å; L339-L365 HydrophobicContact CD1-CB 4.31Å; L339-L365 HydrophobicContact CD1-CD1 4.34Å; L339-L365 HydrophobicContact CD2-CD1 3.65Å; L339-V371 HydrophobicContact CD2-CG1 3.81Å; L339-T420 VanDerWaalsContact O-CA 3.3Å; L339-T420 WeakPolarHBondContact O-CA 3.33Å; L339-D421 HydrophobicContact CB-CB 4.25Å; L339-D421 WeakPolarHBondContact CB-OD1 3.24Å; L339-D421 VanDerWaalsContact CB-OD2 3.3Å; L339-D421 WeakPolarHBondContact CB-OD2 3.49Å; L339-D421 PolarHBondContact N-OD2 3.44Å
340	C	86.5	Confident	75.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	113.8	171.3	-177.2	0	0	0	0	108.1	Y335 S338 Y361 K362 L419	Y335-C340 HydrophobicContact CD1-CB 4.18Å; Y335-C340 HydrophobicContact CD2-CB 4.01Å; Y335-C340 VanDerWaalsContact CD2-SG 3.58Å; Y335-C340 HydrophobicContact CG-CB 3.82Å; S338-C340 PolarHBondContact O-N 2.89Å; C340-Y361 PolarHBondContact O-N 3.29Å; C340-K362 HydrophobicContact CB-CB 4.28Å; C340-K362 PolarHBondContact N-O 3.38Å; C340-K362 PolarHBondContact O-N 3.45Å; C340-L419 WeakPolarHBondContact CA-O 3.35Å
341	C	88.3	Confident	76.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.007	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	149.1	178.9	-50.6	0	0	0	0	110.7	L339 V358 R359 T418 L419	L339-C341 VanDerWaalsContact CD1-SG 3.52Å; C341-V358 HydrophobicContact CB-CB 4.24Å; C341-V358 HydrophobicContact CB-CG2 4.49Å; C341-R359 CarbonylContact C-O 3.37Å; C341-R359 WeakPolarHBondContact CA-O 3.49Å; C341-T418 WeakPolarHBondContact O-CA 3.45Å; C341-L419 HydrophobicContact CB-CB 4.24Å; C341-L419 PolarHBondContact N-O 2.88Å; C341-L419 PolarHBondContact O-N 2.83Å
342	L	88.9	Confident	77.5	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.1	169.6	-179.8	66	0	0	0	109.2	R135 V136 V358 R359 Y361 L447	R135-L342 HydrophobicContact CG-CD2 4.19Å; V136-L342 HydrophobicContact CG2-CD2 4.09Å; L342-V358 CarbonylContact O-C 3.49Å; L342-V358 WeakPolarHBondContact O-CA 3.37Å; L342-R359 PolarHBondContact N-O 3.34Å; L342-R359 PolarHBondContact O-N 3.04Å; L342-Y361 HydrophobicContact CB-CE2 3.73Å; L342-L447 HydrophobicContact CB-CD1 3.79Å; L342-L447 HydrophobicContact CD1-CB 4.07Å; L342-L447 HydrophobicContact CD1-CD1 4.42Å
343	A	89.6	Confident	78.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	124.6	165.1	0	0	0	0	0	108.9	T356 F357 V358 T413 G416 D417	A343-T356 HydrophobicContact CB-CG2 3.68Å; A343-F357 WeakPolarHBondContact CA-O 3.44Å; A343-V358 HydrophobicContact CB-CG1 4.24Å; A343-T413 HydrophobicContact CB-CG2 3.53Å; A343-G416 WeakPolarHBondContact O-CA 3.29Å; A343-G416 PolarHBondContact O-N 3.31Å; A343-D417 PolarHBondContact N-O 2.84Å
344	F	87.3	Confident	80.3	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.035	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	-16.7	-174	71.6	-88.1	0	0	0	114.2	I118 V136 F357 I404 T415	I118-F344 HydrophobicContact CD1-CE2 4.2Å; I118-F344 HydrophobicContact CD1-CZ 4.44Å; V136-F344 HydrophobicContact CB-CD1 4.37Å; V136-F344 HydrophobicContact CB-CG 4.29Å; V136-F344 HydrophobicContact CG1-CD1 4.08Å; V136-F344 HydrophobicContact CG1-CE1 3.95Å; V136-F344 HydrophobicContact CG1-CG 4.42Å; V136-F344 HydrophobicContact CG1-CZ 4.2Å; V136-F344 HydrophobicContact CG2-CB 3.5Å; V136-F344 HydrophobicContact CG2-CD1 3.66Å; V136-F344 HydrophobicContact CG2-CD2 4.16Å; V136-F344 HydrophobicContact CG2-CE1 4.38Å; V136-F344 HydrophobicContact CG2-CG 3.52Å; F344-F357 HydrophobicContact CD1-CB 4.19Å; F344-F357 VanDerWaalsContact CD1-O 3.27Å; F344-F357 WeakPolarHBondContact CD1-O 3.23Å; F344-F357 HydrophobicContact CE1-CB 3.61Å; F344-F357 HydrophobicContact CE2-CB 4.19Å; F344-F357 HydrophobicContact CZ-CB 3.61Å; F344-F357 HydrophobicContact CZ-CD1 4.41Å; F344-F357 HydrophobicContact CZ-CG 4.41Å; F344-F357 PolarHBondContact N-O 3.15Å; F344-I404 HydrophobicContact CE1-CG2 3.85Å; F344-I404 HydrophobicContact CZ-CG2 3.7Å; F344-T415 WeakPolarHBondContact O-CG2 3.17Å
345	K	86.2	Confident	81.9	Confident	15 Å²	15	48 Å²	48	7%	0.065	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	139.8	175	-178.1	179.9	-169.9	-173.1	0	109.4	A103 F357	A103-K345 PolarHBondContact O-NZ 3.2Å; K345-F357 HydrophobicContact CB-CB 3.96Å; K345-F357 HydrophobicContact CB-CD2 4.13Å; K345-F357 HydrophobicContact CB-CG 4.22Å; K345-F357 HydrophobicContact CD-CD2 4.27Å; K345-F357 HydrophobicContact CD-CE2 4.42Å; K345-F357 HydrophobicContact CG-CD2 4.13Å; K345-F357 PolarHBondContact O-N 3.3Å
346	I	88	Confident	83.4	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.8	171.1	-65	173.9	0	0	0	107.3	L355 T356 T413 C414 R481 E482	I346-L355 WeakPolarHBondContact CA-O 3.47Å; I346-T356 HydrophobicContact CG1-CG2 4.22Å; I346-T413 WeakPolarHBondContact CD1-O 3.21Å; I346-C414 VanDerWaalsContact CD1-CA 3.4Å; I346-R481 HydrophobicContact CD1-CG 4.07Å; I346-R481 HydrophobicContact CG2-CG 4.49Å; I346-E482 HydrophobicContact CB-CG 4.49Å; I346-E482 HydrophobicContact CG2-CG 4.18Å; I346-E482 WeakPolarHBondContact O-CG 3.34Å
347	M	85.5	Confident	85	Confident	27 Å²	27	44.7 Å²	44.7	13%	0.133	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	131.1	179.1	-174.4	178.2	76.2	0	0	108.5	F90 L355 F357 M393	F90-M347 HydrophobicContact CE2-SD 4.43Å; F90-M347 HydrophobicContact CZ-SD 4.1Å; M347-L355 HydrophobicContact CE-CD1 3.59Å; M347-L355 PolarHBondContact N-O 2.96Å; M347-L355 WeakPolarHBondContact O-CA 3.41Å; M347-L355 WeakPolarHBondContact O-CB 3.12Å; M347-L355 PolarHBondContact O-N 3.24Å; M347-F357 HydrophobicContact CB-CE2 4.08Å; M347-F357 HydrophobicContact CE-CE2 4.21Å; M347-F357 HydrophobicContact CE-CZ 4.27Å; M347-M393 HydrophobicContact CE-CE 3.93Å
348	H	85.4	Confident	86.3	Confident	37 Å²	37	33.8 Å²	33.8	17%	0.171	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.8	173.5	-63.3	81.2	0	0	0	109.2	E478 E482	H348-E478 PolarHBondContact CE1-O 3.23Å; H348-E482 IonicContact CE1-OE1 2.88Å; H348-E482 IonicContact CG-OE1 2.76Å; H348-E482 PolarHBondContact N-OE1 3Å; H348-E482 WeakPolarHBondContact ND1-CG 3.41Å; H348-E482 IonicContact ND1-OE1 3.27Å; H348-E482 PolarHBondContact ND1-OE1 3.26Å
349	D	82.5	Confident	87	Confident	31 Å²	31	32.3 Å²	32.3	17%	0.166	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.1	172.6	179.4	-90.9	0	0	0	110.1	Y351 L352 G353 L355	D349-Y351 PolarHBondContact O-N 3.18Å; D349-Y351 WeakPolarHBondContact OD1-CA 3.28Å; D349-Y351 WeakPolarHBondContact OD1-CB 3.47Å; D349-Y351 PolarHBondContact OD1-N 3.08Å; D349-L352 HydrophobicContact CB-CB 4.13Å; D349-L352 PolarHBondContact OD1-N 2.87Å; D349-G353 PolarHBondContact N-O 3.11Å; D349-G353 VanDerWaalsContact O-CA 3.23Å; D349-G353 WeakPolarHBondContact O-CA 3.44Å; D349-G353 PolarHBondContact O-N 2.99Å; D349-L355 HydrophobicContact CB-CD1 3.75Å; D349-L355 HydrophobicContact CB-CG 4.49Å
350	R	79.2	Confident	87.2	Confident	224 Å²	224	32.3 Å²	32.3	85%	0.845	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.3	-177	-173.4	176.1	-179.7	177.1	2.4	113.6
351	Y	82.1	Confident	87.2	Confident	202 Å²	202	33.4 Å²	33.4	79%	0.792	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-38.1	-174.9	-60.1	-77.8	0	0	0	112.8	D349	D349-Y351 PolarHBondContact O-N 3.18Å; D349-Y351 WeakPolarHBondContact OD1-CA 3.28Å; D349-Y351 WeakPolarHBondContact OD1-CB 3.47Å; D349-Y351 PolarHBondContact OD1-N 3.08Å
352	L	83.3	Confident	86.9	Confident	66 Å²	66	36.5 Å²	36.5	35%	0.346	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-13.3	-177.7	-61.3	176.3	0	0	0	113.1	D349 L355 F386 M393 T408	D349-L352 HydrophobicContact CB-CB 4.13Å; D349-L352 PolarHBondContact OD1-N 2.87Å; L352-L355 HydrophobicContact CB-CD1 4.39Å; L352-L355 HydrophobicContact CB-CD2 4.27Å; L352-L355 HydrophobicContact CB-CG 4.39Å; L352-L355 HydrophobicContact CD1-CD1 4.26Å; L352-L355 HydrophobicContact CD1-CD2 4.37Å; L352-F386 HydrophobicContact CD1-CZ 4.46Å; L352-F386 HydrophobicContact CD2-CZ 4.08Å; L352-M393 HydrophobicContact CD1-CB 4.01Å; L352-M393 HydrophobicContact CD1-CG 3.93Å; L352-T408 HydrophobicContact CB-CG2 4.49Å
353	G	85.4	Confident	86.6	Confident	35 Å²	35	37.4 Å²	37.4	36%	0.361	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	76.2	-151.3	-175.2	0	0	0	0	0	112.2	D349 L355	D349-G353 PolarHBondContact N-O 3.11Å; D349-G353 VanDerWaalsContact O-CA 3.23Å; D349-G353 WeakPolarHBondContact O-CA 3.44Å; D349-G353 PolarHBondContact O-N 2.99Å; G353-L355 PolarHBondContact O-N 3Å
354	C	88.3	Confident	86.5	Confident	19 Å²	19	40.8 Å²	40.8	13%	0.128	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	115.1	178.3	178.4	0	0	0	0	111.4	R481	C354-R481 PolarHBondContact SG-NH1 3.07Å
355	L	90.8	Very high	86.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.9	172.7	-68.8	166	0	0	0	109.4	I346 M347 D349 L352 G353 F357 F386 M393 A406 I407 T408	I346-L355 WeakPolarHBondContact CA-O 3.47Å; M347-L355 HydrophobicContact CE-CD1 3.59Å; M347-L355 PolarHBondContact N-O 2.96Å; M347-L355 WeakPolarHBondContact O-CA 3.41Å; M347-L355 WeakPolarHBondContact O-CB 3.12Å; M347-L355 PolarHBondContact O-N 3.24Å; D349-L355 HydrophobicContact CB-CD1 3.75Å; D349-L355 HydrophobicContact CB-CG 4.49Å; L352-L355 HydrophobicContact CB-CD1 4.39Å; L352-L355 HydrophobicContact CB-CD2 4.27Å; L352-L355 HydrophobicContact CB-CG 4.39Å; L352-L355 HydrophobicContact CD1-CD1 4.26Å; L352-L355 HydrophobicContact CD1-CD2 4.37Å; G353-L355 PolarHBondContact O-N 3Å; L355-F357 HydrophobicContact CB-CE2 4.44Å; L355-F386 HydrophobicContact CD2-CD2 4.17Å; L355-F386 HydrophobicContact CD2-CE2 4.41Å; L355-M393 HydrophobicContact CD1-CE 4.12Å; L355-A406 HydrophobicContact CD2-CB 4.33Å; L355-I407 WeakPolarHBondContact CA-O 3.33Å; L355-T408 HydrophobicContact CD2-CG2 3.37Å; L355-T408 HydrophobicContact CG-CG2 4.32Å
356	T	91.4	Very high	86.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	113.7	173.6	-52.1	0	0	0	0	109.4	A343 I346 V358 A406 I407 L410 T413	A343-T356 HydrophobicContact CB-CG2 3.68Å; I346-T356 HydrophobicContact CG1-CG2 4.22Å; T356-V358 HydrophobicContact CG2-CG1 4.04Å; T356-A406 CarbonylContact O-C 3.39Å; T356-A406 WeakPolarHBondContact O-CA 3.43Å; T356-I407 PolarHBondContact N-O 2.82Å; T356-I407 PolarHBondContact O-N 2.71Å; T356-L410 HydrophobicContact CG2-CD1 4.03Å; T356-T413 HydrophobicContact CG2-CG2 3.83Å
357	F	91.6	Very high	86.9	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.035	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	127.4	173.4	-67.6	-108.1	0	0	0	109.5	A105 A343 F344 K345 M347 L355 P388 M393 V405 A406	A105-F357 HydrophobicContact CB-CE1 4.31Å; A343-F357 WeakPolarHBondContact CA-O 3.44Å; F344-F357 HydrophobicContact CD1-CB 4.19Å; F344-F357 VanDerWaalsContact CD1-O 3.27Å; F344-F357 WeakPolarHBondContact CD1-O 3.23Å; F344-F357 HydrophobicContact CE1-CB 3.61Å; F344-F357 HydrophobicContact CE2-CB 4.19Å; F344-F357 HydrophobicContact CZ-CB 3.61Å; F344-F357 HydrophobicContact CZ-CD1 4.41Å; F344-F357 HydrophobicContact CZ-CG 4.41Å; F344-F357 PolarHBondContact N-O 3.15Å; K345-F357 HydrophobicContact CB-CB 3.96Å; K345-F357 HydrophobicContact CB-CD2 4.13Å; K345-F357 HydrophobicContact CB-CG 4.22Å; K345-F357 HydrophobicContact CD-CD2 4.27Å; K345-F357 HydrophobicContact CD-CE2 4.42Å; K345-F357 HydrophobicContact CG-CD2 4.13Å; K345-F357 PolarHBondContact O-N 3.3Å; M347-F357 HydrophobicContact CB-CE2 4.08Å; M347-F357 HydrophobicContact CE-CE2 4.21Å; M347-F357 HydrophobicContact CE-CZ 4.27Å; L355-F357 HydrophobicContact CB-CE2 4.44Å; F357-P388 HydrophobicContact CD1-CG 4.4Å; F357-P388 HydrophobicContact CE1-CB 3.78Å; F357-P388 HydrophobicContact CE1-CG 4.05Å; F357-M393 HydrophobicContact CZ-CE 3.9Å; F357-V405 CarbonylContact C-O 3.53Å; F357-V405 WeakPolarHBondContact CA-O 3.45Å; F357-A406 HydrophobicContact CD1-CB 4.18Å; F357-A406 HydrophobicContact CD2-CB 4.47Å; F357-A406 HydrophobicContact CE1-CB 4.17Å; F357-A406 HydrophobicContact CE2-CB 4.44Å; F357-A406 HydrophobicContact CG-CB 4.34Å; F357-A406 HydrophobicContact CZ-CB 4.3Å
358	V	91.3	Very high	87.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146.9	-179.5	-54.9	0	0	0	0	112	C341 L342 A343 T356 I360 I404 V405 I407 L419	C341-V358 HydrophobicContact CB-CB 4.24Å; C341-V358 HydrophobicContact CB-CG2 4.49Å; L342-V358 CarbonylContact O-C 3.49Å; L342-V358 WeakPolarHBondContact O-CA 3.37Å; A343-V358 HydrophobicContact CB-CG1 4.24Å; T356-V358 HydrophobicContact CG2-CG1 4.04Å; V358-I360 HydrophobicContact CG2-CG1 4.45Å; V358-I404 WeakPolarHBondContact O-CA 3.49Å; V358-V405 HydrophobicContact CG2-CG2 3.64Å; V358-V405 PolarHBondContact N-O 2.97Å; V358-V405 PolarHBondContact O-N 2.91Å; V358-I407 HydrophobicContact CB-CD1 4.27Å; V358-I407 HydrophobicContact CG1-CD1 3.75Å; V358-I407 HydrophobicContact CG2-CD1 3.46Å; V358-I407 VanDerWaalsContact CG2-CD1 3.46Å; V358-I407 HydrophobicContact CG2-CG1 4.09Å; V358-L419 HydrophobicContact CG1-CD1 4.02Å
359	R	90.4	Very high	87.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.9	166.6	174	53.2	176.8	-159.6	-5.2	109.5	N50 V136 D138 C341 L342 Y361 G402	N50-R359 VanDerWaalsContact ND2-CZ 3.29Å; N50-R359 PolarHBondContact ND2-NH1 3.14Å; N50-R359 PolarHBondContact ND2-NH2 3.28Å; N50-R359 PolarHBondContact OD1-NH1 2.95Å; V136-R359 HydrophobicContact CB-CB 4.33Å; V136-R359 HydrophobicContact CG1-CB 3.65Å; V136-R359 HydrophobicContact CG1-CG 3.96Å; V136-R359 HydrophobicContact CG2-CB 3.96Å; D138-R359 IonicContact OD1-NH2 3.71Å; D138-R359 IonicContact OD2-CZ 3.16Å; D138-R359 IonicContact OD2-NH2 2.79Å; D138-R359 PolarHBondContact OD2-NH2 3.2Å; C341-R359 CarbonylContact C-O 3.37Å; C341-R359 WeakPolarHBondContact CA-O 3.49Å; L342-R359 PolarHBondContact N-O 3.34Å; L342-R359 PolarHBondContact O-N 3.04Å; R359-Y361 HydrophobicContact CB-CE2 4.02Å; R359-Y361 HydrophobicContact CG-CD2 4Å; R359-Y361 HydrophobicContact CG-CE1 4.07Å; R359-Y361 HydrophobicContact CG-CE2 3.49Å; R359-Y361 VanDerWaalsContact CG-CE2 3.49Å; R359-Y361 HydrophobicContact CG-CG 4.48Å; R359-G402 VanDerWaalsContact NH1-C 3.26Å; R359-G402 PolarHBondContact NH1-O 3.13Å
360	I	89.4	Confident	87.7	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115	175.6	-50.9	178.4	0	0	0	108.6	L339 V358 L365 A399 G400 G402 Q403 V405	L339-I360 HydrophobicContact CD1-CG2 4.22Å; V358-I360 HydrophobicContact CG2-CG1 4.45Å; I360-L365 HydrophobicContact CD1-CB 3.8Å; I360-A399 HydrophobicContact CD1-CB 3.5Å; I360-G400 WeakPolarHBondContact CB-O 3.4Å; I360-G400 WeakPolarHBondContact CD1-O 3.46Å; I360-G402 PolarHBondContact O-N 3.13Å; I360-Q403 PolarHBondContact N-O 3.07Å; I360-V405 HydrophobicContact CD1-CG2 4.1Å; I360-V405 HydrophobicContact CG1-CG2 4.45Å
361	Y	85.4	Confident	88.2	Confident	23 Å²	23	44.5 Å²	44.5	9%	0.09	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-40.8	176.2	-71.1	-84.8	0	0	0	111.7	R135 N328 V331 C340 L342 R359 L447	R135-Y361 PolarHBondContact O-OH 3.28Å; N328-Y361 WeakPolarHBondContact OD1-CD1 3.49Å; V331-Y361 HydrophobicContact CB-CD1 4.43Å; V331-Y361 HydrophobicContact CG1-CG 4.29Å; V331-Y361 HydrophobicContact CG2-CD1 4.11Å; V331-Y361 HydrophobicContact CG2-CE1 4.38Å; V331-Y361 HydrophobicContact CG2-CG 4.47Å; C340-Y361 PolarHBondContact O-N 3.29Å; L342-Y361 HydrophobicContact CB-CE2 3.73Å; R359-Y361 HydrophobicContact CB-CE2 4.02Å; R359-Y361 HydrophobicContact CG-CD2 4Å; R359-Y361 HydrophobicContact CG-CE1 4.07Å; R359-Y361 HydrophobicContact CG-CE2 3.49Å; R359-Y361 VanDerWaalsContact CG-CE2 3.49Å; R359-Y361 HydrophobicContact CG-CG 4.48Å; Y361-L447 HydrophobicContact CD2-CD1 3.82Å; Y361-L447 HydrophobicContact CE2-CD1 3.82Å
362	K	83.3	Confident	88.6	Confident	65 Å²	65	36.1 Å²	36.1	28%	0.283	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156	-177.6	-79.9	-78.5	-176.4	170.2	0	110	L339 C340	L339-K362 WeakPolarHBondContact CA-O 3.42Å; C340-K362 HydrophobicContact CB-CB 4.28Å; C340-K362 PolarHBondContact N-O 3.38Å; C340-K362 PolarHBondContact O-N 3.45Å
363	G	82.5	Confident	88.8	Confident	22 Å²	22	33 Å²	33	23%	0.227	18%	0.179	C	C	.	.	S	Bend	trans	76.7	-172.1	179.3	0	0	0	0	0	113.2	P401	G363-P401 WeakPolarHBondContact O-CD 3.42Å
364	K	86.4	Confident	88.8	Confident	70 Å²	70	32.8 Å²	32.8	30%	0.304	17%	0.17	S	C	.	.			trans	-129.1	126	-177.6	-176.4	173.9	-176.1	163.2	0	108.9	I36 V366 C398 A399	I36-K364 PolarHBondContact O-NZ 3.14Å; I36-K364 VanDerWaalsContact O-NZ 3.14Å; K364-V366 HydrophobicContact CD-CG2 4.49Å; K364-V366 HydrophobicContact CG-CG2 4.19Å; K364-C398 VanDerWaalsContact CE-CB 3.41Å; K364-C398 WeakPolarHBondContact CE-SG 3.43Å; K364-C398 HydrophobicContact CG-CB 4.48Å; K364-A399 WeakPolarHBondContact CA-O 3.31Å; K364-A399 WeakPolarHBondContact CG-O 3.4Å
365	L	88.8	Confident	88.4	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.9	174.4	-165.3	76.9	0	0	0	109	L339 I360 V371 V382 I385 C398 A399 V405 I407	L339-L365 HydrophobicContact CD1-CB 4.31Å; L339-L365 HydrophobicContact CD1-CD1 4.34Å; L339-L365 HydrophobicContact CD2-CD1 3.65Å; I360-L365 HydrophobicContact CD1-CB 3.8Å; L365-V371 HydrophobicContact CD1-CG1 3.91Å; L365-V382 HydrophobicContact CD1-CG2 3.99Å; L365-V382 HydrophobicContact CD2-CG1 4.29Å; L365-V382 HydrophobicContact CG-CG1 4.36Å; L365-I385 HydrophobicContact CB-CD1 4.17Å; L365-I385 HydrophobicContact CD2-CD1 3.71Å; L365-I385 HydrophobicContact CD2-CG1 3.91Å; L365-I385 HydrophobicContact CG-CD1 3.76Å; L365-I385 HydrophobicContact CG-CG1 4.44Å; L365-C398 CarbonylContact O-C 3.52Å; L365-C398 WeakPolarHBondContact O-CA 3.43Å; L365-C398 WeakPolarHBondContact O-CB 3.25Å; L365-A399 PolarHBondContact N-O 3.03Å; L365-A399 PolarHBondContact O-N 3.39Å; L365-V405 HydrophobicContact CD2-CG2 4.35Å; L365-I407 HydrophobicContact CD2-CD1 3.34Å; L365-I407 HydrophobicContact CD2-CG1 3.71Å
366	V	90.9	Very high	88	Confident	55 Å²	55	39.4 Å²	39.4	33%	0.333	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.3	179.4	-177.6	0	0	0	0	108.9	K364 T369 C398	K364-V366 HydrophobicContact CD-CG2 4.49Å; K364-V366 HydrophobicContact CG-CG2 4.19Å; V366-T369 HydrophobicContact CB-CG2 3.77Å; V366-T369 HydrophobicContact CG1-CG2 4.28Å; V366-T369 WeakPolarHBondContact O-CB 3.41Å; V366-T369 WeakPolarHBondContact O-CG2 3.39Å; V366-T369 PolarHBondContact O-N 2.8Å; V366-T369 PolarHBondContact O-OG1 3.29Å; V366-C398 HydrophobicContact CG2-CB 4.07Å
367	T	90.9	Very high	87.6	Confident	35 Å²	35	45 Å²	45	22%	0.215	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	149.9	176.3	53.9	0	0	0	0	111.6	T369 I385 V396 S397	T367-T369 PolarHBondContact O-N 2.93Å; T367-I385 HydrophobicContact CG2-CB 4.17Å; T367-I385 HydrophobicContact CG2-CD1 3.92Å; T367-I385 HydrophobicContact CG2-CG1 3.84Å; T367-V396 WeakPolarHBondContact CG2-O 3.47Å; T367-S397 PolarHBondContact N-O 3.18Å; T367-S397 VanDerWaalsContact N-O 3.07Å; T367-S397 PolarHBondContact OG1-O 3.03Å
368	N	89.3	Confident	87.4	Confident	129 Å²	129	46 Å²	46	69%	0.69	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	29.2	-176.5	-56.5	-50.4	0	0	0	114.7	V382	N368-V382 WeakPolarHBondContact CA-O 3.47Å; N368-V382 PolarHBondContact N-O 2.84Å
369	T	89.7	Confident	87.3	Confident	46 Å²	46	49.7 Å²	49.7	28%	0.282	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	151.5	173.6	60.5	0	0	0	0	111.9	V366 T367 V382	V366-T369 HydrophobicContact CB-CG2 3.77Å; V366-T369 HydrophobicContact CG1-CG2 4.28Å; V366-T369 WeakPolarHBondContact O-CB 3.41Å; V366-T369 WeakPolarHBondContact O-CG2 3.39Å; V366-T369 PolarHBondContact O-N 2.8Å; V366-T369 PolarHBondContact O-OG1 3.29Å; T367-T369 PolarHBondContact O-N 2.93Å; T369-V382 PolarHBondContact O-N 2.89Å
370	K	90.7	Very high	87.3	Confident	155 Å²	155	50.3 Å²	50.3	67%	0.674	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.3	172.6	-71.1	-175.8	177.9	-172.5	0	109.1	E380 I381	K370-E380 WeakPolarHBondContact CA-O 3.36Å; K370-I381 HydrophobicContact CG-CG1 4.1Å
371	V	90.9	Very high	87.4	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	158.2	169.7	-63.8	0	0	0	0	108.7	L339 L365 A379 E380 V382 L410 T420	L339-V371 HydrophobicContact CD2-CG1 3.81Å; L365-V371 HydrophobicContact CD1-CG1 3.91Å; V371-A379 CarbonylContact O-C 3.47Å; V371-A379 WeakPolarHBondContact O-CA 3.42Å; V371-E380 HydrophobicContact CG2-CB 4.32Å; V371-E380 PolarHBondContact N-O 3.42Å; V371-E380 PolarHBondContact O-N 2.91Å; V371-E380 VanDerWaalsContact O-O 3.09Å; V371-V382 HydrophobicContact CB-CG2 4.4Å; V371-V382 HydrophobicContact CG1-CG2 3.63Å; V371-V382 HydrophobicContact CG2-CG2 3.87Å; V371-L410 HydrophobicContact CG2-CD2 3.96Å; V371-T420 CarbonylContact C-O 3.59Å; V371-T420 WeakPolarHBondContact CA-O 3.48Å
372	Y	89.3	Confident	87.7	Confident	27 Å²	27	53.3 Å²	53.3	11%	0.106	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.1	-178.9	178.2	-97.1	0	0	0	109.3	V374 D377 A379 L419 T420 L423	Y372-V374 HydrophobicContact CD1-CG2 4.22Å; Y372-V374 HydrophobicContact CE1-CG2 4.35Å; Y372-D377 WeakPolarHBondContact OH-CA 3.23Å; Y372-D377 VanDerWaalsContact OH-CG 3.3Å; Y372-D377 PolarHBondContact OH-OD1 3.29Å; Y372-A379 HydrophobicContact CD2-CB 4.43Å; Y372-L419 WeakPolarHBondContact O-CA 3.38Å; Y372-T420 PolarHBondContact N-O 3.18Å; Y372-T420 PolarHBondContact O-N 3.33Å; Y372-T420 PolarHBondContact O-OG1 3.06Å; Y372-L423 HydrophobicContact CE1-CB 4.33Å; Y372-L423 HydrophobicContact CE1-CD1 3.74Å; Y372-L423 WeakPolarHBondContact OH-CD1 3.3Å
373	N	88.5	Confident	88.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	112.7	175.3	-177	-16.1	0	0	0	108.9	N375 R376 D377 C378 D417 L419	N373-N375 VanDerWaalsContact C-N 3.32Å; N373-N375 WeakPolarHBondContact OD1-CB 3.23Å; N373-N375 PolarHBondContact OD1-N 2.84Å; N373-R376 PolarHBondContact OD1-N 3.18Å; N373-D377 PolarHBondContact O-N 3.43Å; N373-D377 VanDerWaalsContact O-N 3.12Å; N373-C378 PolarHBondContact N-O 3.39Å; N373-C378 PolarHBondContact O-N 3.41Å; N373-D417 PolarHBondContact ND2-OD2 2.92Å; N373-L419 HydrophobicContact CB-CD2 3.82Å
374	V	84.2	Confident	88.6	Confident	30 Å²	30	57.1 Å²	57.1	18%	0.182	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-31.3	-176.3	-175	0	0	0	0	111.4	Y372 T418 T420 V426 L446	Y372-V374 HydrophobicContact CD1-CG2 4.22Å; Y372-V374 HydrophobicContact CE1-CG2 4.35Å; V374-T418 PolarHBondContact N-O 2.74Å; V374-T420 HydrophobicContact CG2-CG2 3.67Å; V374-V426 HydrophobicContact CG1-CG1 4.42Å; V374-V426 HydrophobicContact CG1-CG2 4.12Å; V374-V426 HydrophobicContact CG2-CG2 3.86Å; V374-L446 HydrophobicContact CB-CD2 4.2Å; V374-L446 HydrophobicContact CG1-CD2 3.76Å
375	N	81.5	Confident	88.8	Confident	57 Å²	57	53.8 Å²	53.8	31%	0.305	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-34.3	-177	-66.8	59.8	0	0	0	112.1	N373 D417 T418 L446	N373-N375 VanDerWaalsContact C-N 3.32Å; N373-N375 WeakPolarHBondContact OD1-CB 3.23Å; N373-N375 PolarHBondContact OD1-N 2.84Å; N375-D417 HydrophobicContact CB-CB 4.24Å; N375-D417 VanDerWaalsContact CB-OD1 3.22Å; N375-D417 WeakPolarHBondContact CB-OD1 3.45Å; N375-D417 PolarHBondContact ND2-OD1 3.06Å; N375-T418 PolarHBondContact OD1-N 3.35Å; N375-L446 WeakPolarHBondContact OD1-CD2 3.49Å
376	R	81.4	Confident	88.9	Confident	101 Å²	101	54.2 Å²	54.2	38%	0.381	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-0.2	-174.4	-65.6	-166.8	174.5	-147.5	-1.7	114.9	N373 C378 E412 C414 D417	N373-R376 PolarHBondContact OD1-N 3.18Å; R376-C378 PolarHBondContact O-N 3.44Å; R376-E412 VanDerWaalsContact CD-O 3.25Å; R376-E412 WeakPolarHBondContact CD-O 3.42Å; R376-E412 PolarHBondContact NE-O 3.46Å; R376-E412 PolarHBondContact NH1-O 3.46Å; R376-E412 IonicContact NH1-OE2 2.86Å; R376-E412 PolarHBondContact NH1-OE2 2.79Å; R376-E412 PolarHBondContact NH2-O 2.97Å; R376-C414 PolarHBondContact NH2-SG 3.49Å; R376-D417 IonicContact NE-OD2 3.59Å
377	D	83	Confident	88.8	Confident	119 Å²	119	52.5 Å²	52.5	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	44.3	-175.6	-167.3	8.9	0	0	0	112.7	Y372 N373	Y372-D377 WeakPolarHBondContact OH-CA 3.23Å; Y372-D377 VanDerWaalsContact OH-CG 3.3Å; Y372-D377 PolarHBondContact OH-OD1 3.29Å; N373-D377 PolarHBondContact O-N 3.43Å; N373-D377 VanDerWaalsContact O-N 3.12Å
378	C	86.7	Confident	88.5	Confident	28 Å²	28	51 Å²	51	19%	0.189	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.3	-176.9	70.1	0	0	0	0	112.4	N373 R376	N373-C378 PolarHBondContact N-O 3.39Å; N373-C378 PolarHBondContact O-N 3.41Å; R376-C378 PolarHBondContact O-N 3.44Å
379	A	89.5	Confident	88.2	Confident	77 Å²	77	46.3 Å²	46.3	64%	0.636	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.4	172.7	0	0	0	0	0	110.2	V371 Y372	V371-A379 CarbonylContact O-C 3.47Å; V371-A379 WeakPolarHBondContact O-CA 3.42Å; Y372-A379 HydrophobicContact CD2-CB 4.43Å
380	E	91.1	Very high	87.3	Confident	14 Å²	14	44.5 Å²	44.5	7%	0.065	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	161.8	-177.5	-60.3	-168.9	80.6	0	0	110.8	K370 V371 L410 Q411 E412 T413	K370-E380 WeakPolarHBondContact CA-O 3.36Å; V371-E380 HydrophobicContact CG2-CB 4.32Å; V371-E380 PolarHBondContact N-O 3.42Å; V371-E380 PolarHBondContact O-N 2.91Å; V371-E380 VanDerWaalsContact O-O 3.09Å; E380-L410 HydrophobicContact CB-CD2 3.56Å; E380-L410 VanDerWaalsContact OE1-C 3.24Å; E380-L410 WeakPolarHBondContact OE1-CA 3.36Å; E380-Q411 PolarHBondContact OE1-N 2.9Å; E380-E412 PolarHBondContact OE1-N 2.81Å; E380-T413 PolarHBondContact OE1-N 3.07Å; E380-T413 PolarHBondContact OE2-N 3.38Å; E380-T413 PolarHBondContact OE2-OG1 2.76Å
381	I	91.6	Very high	86.3	Confident	86 Å²	86	42.9 Å²	42.9	44%	0.441	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.1	-176.8	-61.3	173.8	0	0	0	109.8	K370 S383 G409	K370-I381 HydrophobicContact CG-CG1 4.1Å; I381-S383 PolarHBondContact O-N 3.14Å; I381-G409 CarbonylContact O-C 3.55Å
382	V	91.7	Very high	85.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	103.5	173.8	176.7	0	0	0	0	108.1	L365 N368 T369 V371 I385 I407	L365-V382 HydrophobicContact CD1-CG2 3.99Å; L365-V382 HydrophobicContact CD2-CG1 4.29Å; L365-V382 HydrophobicContact CG-CG1 4.36Å; N368-V382 WeakPolarHBondContact CA-O 3.47Å; N368-V382 PolarHBondContact N-O 2.84Å; T369-V382 PolarHBondContact O-N 2.89Å; V371-V382 HydrophobicContact CB-CG2 4.4Å; V371-V382 HydrophobicContact CG1-CG2 3.63Å; V371-V382 HydrophobicContact CG2-CG2 3.87Å; V382-I385 HydrophobicContact CG1-CD1 4.13Å; V382-I385 HydrophobicContact CG1-CG1 3.71Å; V382-I407 HydrophobicContact CB-CG2 4.23Å; V382-I407 HydrophobicContact CG1-CG2 3.74Å; V382-I407 HydrophobicContact CG2-CG2 4.21Å
383	S	91.6	Very high	85.4	Confident	49 Å²	49	46.5 Å²	46.5	34%	0.343	25%	0.25	S	C	.	.			trans	-75.1	-56.9	-178.9	-63.8	0	0	0	0	111.7	I381 T408	I381-S383 PolarHBondContact O-N 3.14Å; S383-T408 WeakPolarHBondContact CB-O 3.45Å; S383-T408 PolarHBondContact N-O 3.3Å
384	K	92.2	Very high	85.3	Confident	117 Å²	117	50 Å²	50	51%	0.509	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	153.9	178.4	-65.5	-176.4	179.9	177.4	0	110.2	F386 I407 T408	K384-F386 HydrophobicContact CB-CD2 4.42Å; K384-F386 HydrophobicContact CB-CE2 3.59Å; K384-F386 HydrophobicContact CB-CZ 3.78Å; K384-F386 HydrophobicContact CD-CE2 4.46Å; K384-F386 HydrophobicContact CD-CZ 3.87Å; K384-F386 HydrophobicContact CG-CZ 4.49Å; K384-I407 WeakPolarHBondContact O-CA 3.47Å; K384-T408 PolarHBondContact N-OG1 2.86Å; K384-T408 PolarHBondContact O-N 2.83Å
385	I	92.1	Very high	85.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.7	176.4	-56.3	166.6	0	0	0	107.4	L365 T367 V382 S395 V396 A399 V405 A406	L365-I385 HydrophobicContact CB-CD1 4.17Å; L365-I385 HydrophobicContact CD2-CD1 3.71Å; L365-I385 HydrophobicContact CD2-CG1 3.91Å; L365-I385 HydrophobicContact CG-CD1 3.76Å; L365-I385 HydrophobicContact CG-CG1 4.44Å; T367-I385 HydrophobicContact CG2-CB 4.17Å; T367-I385 HydrophobicContact CG2-CD1 3.92Å; T367-I385 HydrophobicContact CG2-CG1 3.84Å; V382-I385 HydrophobicContact CG1-CD1 4.13Å; V382-I385 HydrophobicContact CG1-CG1 3.71Å; I385-S395 WeakPolarHBondContact O-CA 3.38Å; I385-V396 HydrophobicContact CB-CG2 3.99Å; I385-V396 HydrophobicContact CG2-CG2 3.62Å; I385-V396 PolarHBondContact O-N 2.95Å; I385-A399 HydrophobicContact CG2-CB 4.17Å; I385-V405 HydrophobicContact CG2-CB 3.81Å; I385-V405 HydrophobicContact CG2-CG1 4.12Å; I385-V405 HydrophobicContact CG2-CG2 3.91Å; I385-A406 CarbonylContact C-O 3.56Å; I385-A406 WeakPolarHBondContact CA-O 3.03Å
386	F	90.8	Very high	85.9	Confident	12 Å²	12	50.5 Å²	50.5	5%	0.053	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.5	-179.6	-59.1	-85.7	0	0	0	110.5	L352 L355 K384 M393 N394 V405 A406 T408	L352-F386 HydrophobicContact CD1-CZ 4.46Å; L352-F386 HydrophobicContact CD2-CZ 4.08Å; L355-F386 HydrophobicContact CD2-CD2 4.17Å; L355-F386 HydrophobicContact CD2-CE2 4.41Å; K384-F386 HydrophobicContact CB-CD2 4.42Å; K384-F386 HydrophobicContact CB-CE2 3.59Å; K384-F386 HydrophobicContact CB-CZ 3.78Å; K384-F386 HydrophobicContact CD-CE2 4.46Å; K384-F386 HydrophobicContact CD-CZ 3.87Å; K384-F386 HydrophobicContact CG-CZ 4.49Å; F386-M393 HydrophobicContact CB-CB 3.99Å; F386-M393 HydrophobicContact CB-SD 4.16Å; F386-M393 HydrophobicContact CD1-CB 3.7Å; F386-M393 HydrophobicContact CE1-CB 4.4Å; F386-M393 HydrophobicContact CG-CB 3.96Å; F386-N394 CarbonylContact C-O 3.47Å; F386-N394 VanDerWaalsContact CA-O 3.3Å; F386-N394 WeakPolarHBondContact CA-O 3.41Å; F386-V405 CarbonylContact O-C 3.58Å; F386-V405 WeakPolarHBondContact O-CA 3.38Å; F386-V405 WeakPolarHBondContact O-CB 3.48Å; F386-A406 HydrophobicContact CB-CB 4.34Å; F386-A406 PolarHBondContact N-O 3.09Å; F386-A406 PolarHBondContact O-N 2.65Å; F386-T408 HydrophobicContact CD2-CG2 4.35Å; F386-T408 HydrophobicContact CE2-CG2 3.71Å
387	I	87.9	Confident	86.2	Confident	19 Å²	19	48.5 Å²	48.5	10%	0.097	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.9	164.3	-63.2	178.5	0	0	0	107.1	V33 C107 N394 V396 V405	V33-I387 HydrophobicContact CG1-CD1 4.07Å; C107-I387 HydrophobicContact CB-CG2 3.66Å; I387-N394 PolarHBondContact N-O 2.97Å; I387-N394 PolarHBondContact O-N 3.07Å; I387-V396 HydrophobicContact CD1-CG1 3.67Å; I387-V396 HydrophobicContact CG1-CG1 3.88Å; I387-V396 HydrophobicContact CG1-CG2 4.12Å; I387-V405 HydrophobicContact CG1-CG1 4.42Å
388	P	85	Confident	86.4	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.019	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	138	-178.5	30.6	-34.7	0	0	0	111.6	A105 C107 F357 M393	A105-P388 HydrophobicContact CB-CB 4.22Å; A105-P388 HydrophobicContact CB-CG 3.84Å; C107-P388 PolarHBondContact N-O 3.39Å; F357-P388 HydrophobicContact CD1-CG 4.4Å; F357-P388 HydrophobicContact CE1-CB 3.78Å; F357-P388 HydrophobicContact CE1-CG 4.05Å; P388-M393 HydrophobicContact CB-CE 4.38Å; P388-M393 HydrophobicContact CB-SD 4.15Å
389	F	82.2	Confident	86.5	Confident	31 Å²	31	42.5 Å²	42.5	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	78.4	170.4	-172.5	-99.6	0	0	0	108.4	L69 T74 T75 V87 C107 H391 T392	L69-F389 HydrophobicContact CD1-CZ 4.43Å; L69-F389 HydrophobicContact CD2-CE2 3.73Å; L69-F389 HydrophobicContact CD2-CZ 4.08Å; T74-F389 HydrophobicContact CG2-CD2 4.2Å; T74-F389 HydrophobicContact CG2-CE1 4.36Å; T74-F389 HydrophobicContact CG2-CE2 3.28Å; T74-F389 HydrophobicContact CG2-CZ 3.39Å; T75-F389 HydrophobicContact CG2-CE1 4.21Å; T75-F389 HydrophobicContact CG2-CZ 3.92Å; V87-F389 HydrophobicContact CG1-CE1 4.34Å; C107-F389 WeakPolarHBondContact O-CD2 3.47Å; F389-H391 PolarHBondContact O-N 3.36Å; F389-T392 WeakPolarHBondContact CB-OG1 3.44Å; F389-T392 WeakPolarHBondContact CD1-OG1 3.42Å; F389-T392 PolarHBondContact N-O 2.77Å; F389-T392 PolarHBondContact O-N 3.49Å; F389-T392 PolarHBondContact O-OG1 3.41Å
390	G	72.7	Confident	86.3	Confident	8 Å²	8	39.6 Å²	39.6	8%	0.082	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	-121.3	-171.7	0	0	0	0	0	110.1	A105	A105-G390 PolarHBondContact O-N 2.92Å
391	H	69.4	Low	86.1	Confident	120 Å²	120	40.1 Å²	40.1	56%	0.556	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-20.8	174.2	-170.3	-64.1	0	0	0	113.4	F90 F389	F90-H391 HydrophobicContact CB-CB 4.34Å; F389-H391 PolarHBondContact O-N 3.36Å
392	T	77.9	Confident	85.7	Confident	73 Å²	73	36 Å²	36	45%	0.448	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.3	-177.2	62.3	0	0	0	0	111.9	F389	F389-T392 WeakPolarHBondContact CB-OG1 3.44Å; F389-T392 WeakPolarHBondContact CD1-OG1 3.42Å; F389-T392 PolarHBondContact N-O 2.77Å; F389-T392 PolarHBondContact O-N 3.49Å; F389-T392 PolarHBondContact O-OG1 3.41Å
393	M	82.9	Confident	85.6	Confident	33 Å²	33	37.3 Å²	37.3	16%	0.163	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	108.6	-175.6	-66.6	-65.3	170.4	0	0	110.1	M347 L352 L355 F357 F386 P388 A406	M347-M393 HydrophobicContact CE-CE 3.93Å; L352-M393 HydrophobicContact CD1-CB 4.01Å; L352-M393 HydrophobicContact CD1-CG 3.93Å; L355-M393 HydrophobicContact CD1-CE 4.12Å; F357-M393 HydrophobicContact CZ-CE 3.9Å; F386-M393 HydrophobicContact CB-CB 3.99Å; F386-M393 HydrophobicContact CB-SD 4.16Å; F386-M393 HydrophobicContact CD1-CB 3.7Å; F386-M393 HydrophobicContact CE1-CB 4.4Å; F386-M393 HydrophobicContact CG-CB 3.96Å; P388-M393 HydrophobicContact CB-CE 4.38Å; P388-M393 HydrophobicContact CB-SD 4.15Å; M393-A406 HydrophobicContact SD-CB 4.3Å
394	N	86.3	Confident	85.5	Confident	74 Å²	74	35.2 Å²	35.2	40%	0.396	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	110.4	-179.2	-69.5	-40.7	0	0	0	110.3	F386 I387 V396	F386-N394 CarbonylContact C-O 3.47Å; F386-N394 VanDerWaalsContact CA-O 3.3Å; F386-N394 WeakPolarHBondContact CA-O 3.41Å; I387-N394 PolarHBondContact N-O 2.97Å; I387-N394 PolarHBondContact O-N 3.07Å; N394-V396 PolarHBondContact O-N 3.46Å
395	S	88.9	Confident	85.4	Confident	80 Å²	80	29.7 Å²	29.7	56%	0.559	17%	0.174	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	132.7	-178.1	-170.5	0	0	0	0	111.8	I385	I385-S395 WeakPolarHBondContact O-CA 3.38Å
396	V	89.5	Confident	85.4	Confident	17 Å²	17	29.7 Å²	29.7	10%	0.103	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.1	174.7	-65.7	0	0	0	0	111.1	V33 T367 I385 I387 N394	V33-V396 HydrophobicContact CG1-CG1 3.75Å; T367-V396 WeakPolarHBondContact CG2-O 3.47Å; I385-V396 HydrophobicContact CB-CG2 3.99Å; I385-V396 HydrophobicContact CG2-CG2 3.62Å; I385-V396 PolarHBondContact O-N 2.95Å; I387-V396 HydrophobicContact CD1-CG1 3.67Å; I387-V396 HydrophobicContact CG1-CG1 3.88Å; I387-V396 HydrophobicContact CG1-CG2 4.12Å; N394-V396 PolarHBondContact O-N 3.46Å
397	S	87.4	Confident	85.5	Confident	58 Å²	58	29.1 Å²	29.1	41%	0.406	17%	0.171	S	C	.	.	S	Bend	trans	-82.6	-25.5	179.5	57.2	0	0	0	0	113.5	P35 T367	P35-S397 VanDerWaalsContact CB-OG 3.31Å; P35-S397 WeakPolarHBondContact CB-OG 3.37Å; T367-S397 PolarHBondContact N-O 3.18Å; T367-S397 VanDerWaalsContact N-O 3.07Å; T367-S397 PolarHBondContact OG1-O 3.03Å
398	C	88.2	Confident	85.8	Confident	20 Å²	20	28.9 Å²	28.9	14%	0.135	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	158.8	178.3	64.5	0	0	0	0	111.7	K364 L365 V366	K364-C398 VanDerWaalsContact CE-CB 3.41Å; K364-C398 WeakPolarHBondContact CE-SG 3.43Å; K364-C398 HydrophobicContact CG-CB 4.48Å; L365-C398 CarbonylContact O-C 3.52Å; L365-C398 WeakPolarHBondContact O-CA 3.43Å; L365-C398 WeakPolarHBondContact O-CB 3.25Å; V366-C398 HydrophobicContact CG2-CB 4.07Å
399	A	87.9	Confident	85.9	Confident	2 Å²	2	29.9 Å²	29.9	2%	0.017	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.8	176.4	0	0	0	0	0	110.6	I360 K364 L365 I385 Q403 V405	I360-A399 HydrophobicContact CD1-CB 3.5Å; K364-A399 WeakPolarHBondContact CA-O 3.31Å; K364-A399 WeakPolarHBondContact CG-O 3.4Å; L365-A399 PolarHBondContact N-O 3.03Å; L365-A399 PolarHBondContact O-N 3.39Å; I385-A399 HydrophobicContact CG2-CB 4.17Å; A399-Q403 VanDerWaalsContact CA-OE1 3.31Å; A399-V405 HydrophobicContact CB-CB 4.47Å; A399-V405 HydrophobicContact CB-CG1 3.63Å; A399-V405 HydrophobicContact CB-CG2 4.17Å
400	G	85.8	Confident	86.3	Confident	16 Å²	16	28.4 Å²	28.4	17%	0.165	18%	0.176	C	C	.	.			trans	-102.5	-179.9	-174.3	0	0	0	0	0	114	I360 Q403	I360-G400 WeakPolarHBondContact CB-O 3.4Å; I360-G400 WeakPolarHBondContact CD1-O 3.46Å; G400-Q403 WeakPolarHBondContact O-CB 3.46Å; G400-Q403 PolarHBondContact O-N 2.7Å
401	P	86.2	Confident	86.9	Confident	25 Å²	25	34.4 Å²	34.4	16%	0.162	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	149.3	177.2	28.1	-34.2	0	0	0	111.4	L45 G363 Q403	L45-P401 HydrophobicContact CD1-CG 4.09Å; L45-P401 HydrophobicContact CD2-CB 4.11Å; L45-P401 HydrophobicContact CD2-CG 4.07Å; L45-P401 WeakPolarHBondContact CD2-O 3.34Å; L45-P401 HydrophobicContact CG-CG 4.34Å; G363-P401 WeakPolarHBondContact O-CD 3.42Å; P401-Q403 PolarHBondContact O-N 3.04Å
402	G	84.3	Confident	87.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	-1.6	-177.4	0	0	0	0	0	114.7	L48 N50 R359 I360	L48-G402 WeakPolarHBondContact CD1-O 3.41Å; L48-G402 WeakPolarHBondContact CD2-O 3.19Å; N50-G402 PolarHBondContact ND2-O 3.06Å; N50-G402 PolarHBondContact OD1-O 3.44Å; R359-G402 VanDerWaalsContact NH1-C 3.26Å; R359-G402 PolarHBondContact NH1-O 3.13Å; I360-G402 PolarHBondContact O-N 3.13Å
403	Q	87.8	Confident	88.1	Confident	26 Å²	26	29.8 Å²	29.8	12%	0.121	18%	0.175	C	C	.	.			trans	-90.4	150.6	177.3	-65.1	-177.6	-27.6	0	0	111.6	L48 I360 A399 G400 P401 V405	L48-Q403 HydrophobicContact CD1-CG 3.88Å; I360-Q403 PolarHBondContact N-O 3.07Å; A399-Q403 VanDerWaalsContact CA-OE1 3.31Å; G400-Q403 WeakPolarHBondContact O-CB 3.46Å; G400-Q403 PolarHBondContact O-N 2.7Å; P401-Q403 PolarHBondContact O-N 3.04Å; Q403-V405 HydrophobicContact CB-CG1 4.43Å
404	I	89.8	Confident	88.1	Confident	6 Å²	6	29.2 Å²	29.2	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.9	170.6	-63	175.6	0	0	0	107	N50 N116 I118 V136 F344 V358	N50-I404 HydrophobicContact CB-CD1 4.42Å; N116-I404 HydrophobicContact CB-CD1 4.15Å; I118-I404 HydrophobicContact CD1-CD1 4.06Å; I118-I404 HydrophobicContact CG1-CD1 4.43Å; V136-I404 HydrophobicContact CG1-CD1 3.65Å; V136-I404 HydrophobicContact CG1-CG1 4.02Å; F344-I404 HydrophobicContact CE1-CG2 3.85Å; F344-I404 HydrophobicContact CZ-CG2 3.7Å; V358-I404 WeakPolarHBondContact O-CA 3.49Å
405	V	91.5	Very high	88	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.5	-176.1	-63.7	0	0	0	0	111.1	F357 V358 I360 L365 I385 F386 I387 A399 Q403	F357-V405 CarbonylContact C-O 3.53Å; F357-V405 WeakPolarHBondContact CA-O 3.45Å; V358-V405 HydrophobicContact CG2-CG2 3.64Å; V358-V405 PolarHBondContact N-O 2.97Å; V358-V405 PolarHBondContact O-N 2.91Å; I360-V405 HydrophobicContact CD1-CG2 4.1Å; I360-V405 HydrophobicContact CG1-CG2 4.45Å; L365-V405 HydrophobicContact CD2-CG2 4.35Å; I385-V405 HydrophobicContact CG2-CB 3.81Å; I385-V405 HydrophobicContact CG2-CG1 4.12Å; I385-V405 HydrophobicContact CG2-CG2 3.91Å; F386-V405 CarbonylContact O-C 3.58Å; F386-V405 WeakPolarHBondContact O-CA 3.38Å; F386-V405 WeakPolarHBondContact O-CB 3.48Å; I387-V405 HydrophobicContact CG1-CG1 4.42Å; A399-V405 HydrophobicContact CB-CB 4.47Å; A399-V405 HydrophobicContact CB-CG1 3.63Å; A399-V405 HydrophobicContact CB-CG2 4.17Å; Q403-V405 HydrophobicContact CB-CG1 4.43Å
406	A	91.9	Very high	87.7	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136.3	170	0	0	0	0	0	110.2	L355 T356 F357 I385 F386 M393	L355-A406 HydrophobicContact CD2-CB 4.33Å; T356-A406 CarbonylContact O-C 3.39Å; T356-A406 WeakPolarHBondContact O-CA 3.43Å; F357-A406 HydrophobicContact CD1-CB 4.18Å; F357-A406 HydrophobicContact CD2-CB 4.47Å; F357-A406 HydrophobicContact CE1-CB 4.17Å; F357-A406 HydrophobicContact CE2-CB 4.44Å; F357-A406 HydrophobicContact CG-CB 4.34Å; F357-A406 HydrophobicContact CZ-CB 4.3Å; I385-A406 CarbonylContact C-O 3.56Å; I385-A406 WeakPolarHBondContact CA-O 3.03Å; F386-A406 HydrophobicContact CB-CB 4.34Å; F386-A406 PolarHBondContact N-O 3.09Å; F386-A406 PolarHBondContact O-N 2.65Å; M393-A406 HydrophobicContact SD-CB 4.3Å
407	I	93.1	Very high	87.5	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.9	-179	-60.5	167.4	0	0	0	109.3	L355 T356 V358 L365 V382 K384 L410	L355-I407 WeakPolarHBondContact CA-O 3.33Å; T356-I407 PolarHBondContact N-O 2.82Å; T356-I407 PolarHBondContact O-N 2.71Å; V358-I407 HydrophobicContact CB-CD1 4.27Å; V358-I407 HydrophobicContact CG1-CD1 3.75Å; V358-I407 HydrophobicContact CG2-CD1 3.46Å; V358-I407 VanDerWaalsContact CG2-CD1 3.46Å; V358-I407 HydrophobicContact CG2-CG1 4.09Å; L365-I407 HydrophobicContact CD2-CD1 3.34Å; L365-I407 HydrophobicContact CD2-CG1 3.71Å; V382-I407 HydrophobicContact CB-CG2 4.23Å; V382-I407 HydrophobicContact CG1-CG2 3.74Å; V382-I407 HydrophobicContact CG2-CG2 4.21Å; K384-I407 WeakPolarHBondContact O-CA 3.47Å; I407-L410 HydrophobicContact CB-CD1 4.49Å; I407-L410 HydrophobicContact CG2-CD1 4.22Å; I407-L410 HydrophobicContact CG2-CG 4.1Å
408	T	92.5	Very high	87.5	Confident	14 Å²	14	19.7 Å²	19.7	9%	0.086	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	155.7	165	60.1	0	0	0	0	111.9	L352 L355 S383 K384 F386	L352-T408 HydrophobicContact CB-CG2 4.49Å; L355-T408 HydrophobicContact CD2-CG2 3.37Å; L355-T408 HydrophobicContact CG-CG2 4.32Å; S383-T408 WeakPolarHBondContact CB-O 3.45Å; S383-T408 PolarHBondContact N-O 3.3Å; K384-T408 PolarHBondContact N-OG1 2.86Å; K384-T408 PolarHBondContact O-N 2.83Å; F386-T408 HydrophobicContact CD2-CG2 4.35Å; F386-T408 HydrophobicContact CE2-CG2 3.71Å
409	G	87.8	Confident	87.5	Confident	25 Å²	25	18.8 Å²	18.8	26%	0.258	11%	0.107	S	C	.	.			trans	104.8	-6	174.9	0	0	0	0	0	115.1	I381	I381-G409 CarbonylContact O-C 3.55Å
410	L	90.1	Very high	87.4	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.106	C	C	.	.			trans	-83.1	116.7	174.5	-51.4	-177.4	0	0	0	109.2	T356 V371 E380 I407 T413 L419 R481	T356-L410 HydrophobicContact CG2-CD1 4.03Å; V371-L410 HydrophobicContact CG2-CD2 3.96Å; E380-L410 HydrophobicContact CB-CD2 3.56Å; E380-L410 VanDerWaalsContact OE1-C 3.24Å; E380-L410 WeakPolarHBondContact OE1-CA 3.36Å; I407-L410 HydrophobicContact CB-CD1 4.49Å; I407-L410 HydrophobicContact CG2-CD1 4.22Å; I407-L410 HydrophobicContact CG2-CG 4.1Å; L410-T413 HydrophobicContact CD1-CG2 4.27Å; L410-L419 HydrophobicContact CD1-CD1 3.75Å; L410-R481 PolarHBondContact O-NH2 2.92Å
411	Q	85	Confident	87.3	Confident	133 Å²	133	21 Å²	21	62%	0.621	11%	0.114	S	C	*	.	S	Bend	trans	-96.3	-30.6	-177.3	-61.6	-60.2	-22.8	0	0	112.5	E380 R481	E380-Q411 PolarHBondContact OE1-N 2.9Å; Q411-R481 PolarHBondContact O-NH1 2.68Å; Q411-R481 PolarHBondContact O-NH2 3.45Å; Q411-R481 VanDerWaalsContact O-NH2 3.1Å
412	E	85.7	Confident	86.7	Confident	97 Å²	97	26.4 Å²	26.4	45%	0.453	14%	0.136	S	C	.	.	S	Bend	trans	-106.8	-30.6	-175.3	-67	-59.8	149.3	0	0	112.1	R376 E380 C414	R376-E412 VanDerWaalsContact CD-O 3.25Å; R376-E412 WeakPolarHBondContact CD-O 3.42Å; R376-E412 PolarHBondContact NE-O 3.46Å; R376-E412 PolarHBondContact NH1-O 3.46Å; R376-E412 IonicContact NH1-OE2 2.86Å; R376-E412 PolarHBondContact NH1-OE2 2.79Å; R376-E412 PolarHBondContact NH2-O 2.97Å; E380-E412 PolarHBondContact OE1-N 2.81Å; E412-C414 PolarHBondContact O-N 2.79Å
413	T	87.4	Confident	85.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.			trans	-50.4	130.2	-178.5	-63.5	0	0	0	0	112.5	A343 I346 T356 E380 L410 D417 L419 R481	A343-T413 HydrophobicContact CB-CG2 3.53Å; I346-T413 WeakPolarHBondContact CD1-O 3.21Å; T356-T413 HydrophobicContact CG2-CG2 3.83Å; E380-T413 PolarHBondContact OE1-N 3.07Å; E380-T413 PolarHBondContact OE2-N 3.38Å; E380-T413 PolarHBondContact OE2-OG1 2.76Å; L410-T413 HydrophobicContact CD1-CG2 4.27Å; T413-D417 HydrophobicContact CG2-CB 4.08Å; T413-L419 HydrophobicContact CG2-CD2 4.21Å; T413-R481 PolarHBondContact O-NE 3.4Å; T413-R481 VanDerWaalsContact O-NE 3.11Å; T413-R481 PolarHBondContact O-NH2 3.45Å
414	C	83.9	Confident	84.4	Confident	20 Å²	20	31.8 Å²	31.8	14%	0.135	17%	0.169	C	C	.	.			trans	-110.7	165.7	173	-103.5	0	0	0	0	112.2	I346 R376 E412 G416 D417	I346-C414 VanDerWaalsContact CD1-CA 3.4Å; R376-C414 PolarHBondContact NH2-SG 3.49Å; E412-C414 PolarHBondContact O-N 2.79Å; C414-G416 PolarHBondContact O-N 3.29Å; C414-D417 PolarHBondContact N-OD2 2.79Å; C414-D417 WeakPolarHBondContact O-CB 3.4Å; C414-D417 PolarHBondContact O-N 3.34Å
415	T	83.9	Confident	82.8	Confident	11 Å²	11	32 Å²	32	7%	0.067	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	124.3	172.7	-61.1	0	0	0	0	110.8	K132 F344 E482	K132-T415 HydrophobicContact CD-CG2 3.56Å; K132-T415 HydrophobicContact CG-CG2 3.81Å; F344-T415 WeakPolarHBondContact O-CG2 3.17Å; T415-E482 PolarHBondContact OG1-O 3.34Å
416	G	81.1	Confident	81.1	Confident	4 Å²	4	32.7 Å²	32.7	4%	0.041	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.8	-7.3	-176.3	0	0	0	0	0	114.8	A343 C414	A343-G416 WeakPolarHBondContact O-CA 3.29Å; A343-G416 PolarHBondContact O-N 3.31Å; C414-G416 PolarHBondContact O-N 3.29Å
417	D	86	Confident	79.2	Confident	14 Å²	14	38.1 Å²	38.1	8%	0.075	20%	0.201	C	C	.	.			trans	-76.1	146	-178.2	-73.7	-9.6	0	0	0	112.8	A343 N373 N375 R376 T413 C414	A343-D417 PolarHBondContact N-O 2.84Å; N373-D417 PolarHBondContact ND2-OD2 2.92Å; N375-D417 HydrophobicContact CB-CB 4.24Å; N375-D417 VanDerWaalsContact CB-OD1 3.22Å; N375-D417 WeakPolarHBondContact CB-OD1 3.45Å; N375-D417 PolarHBondContact ND2-OD1 3.06Å; R376-D417 IonicContact NE-OD2 3.59Å; T413-D417 HydrophobicContact CG2-CB 4.08Å; C414-D417 PolarHBondContact N-OD2 2.79Å; C414-D417 WeakPolarHBondContact O-CB 3.4Å; C414-D417 PolarHBondContact O-N 3.34Å
418	T	87	Confident	77.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124	176.4	-55.5	0	0	0	0	110.7	C341 V374 N375 T420 L447	C341-T418 WeakPolarHBondContact O-CA 3.45Å; V374-T418 PolarHBondContact N-O 2.74Å; N375-T418 PolarHBondContact OD1-N 3.35Å; T418-T420 HydrophobicContact CG2-CG2 4.34Å; T418-L447 HydrophobicContact CG2-CD1 4.05Å; T418-L447 HydrophobicContact CG2-CG 4.1Å; T418-L447 PolarHBondContact OG1-N 3Å
419	L	88.6	Confident	75.3	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.9	177.3	-53.6	177.9	0	0	0	111.1	C340 C341 V358 Y372 N373 L410 T413	C340-L419 WeakPolarHBondContact CA-O 3.35Å; C341-L419 HydrophobicContact CB-CB 4.24Å; C341-L419 PolarHBondContact N-O 2.88Å; C341-L419 PolarHBondContact O-N 2.83Å; V358-L419 HydrophobicContact CG1-CD1 4.02Å; Y372-L419 WeakPolarHBondContact O-CA 3.38Å; N373-L419 HydrophobicContact CB-CD2 3.82Å; L410-L419 HydrophobicContact CD1-CD1 3.75Å; T413-L419 HydrophobicContact CG2-CD2 4.21Å
420	T	86.8	Confident	73.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	166.8	-179.8	64.4	0	0	0	0	112.3	Y335 L339 V371 Y372 V374 T418	Y335-T420 HydrophobicContact CE1-CG2 4.03Å; L339-T420 VanDerWaalsContact O-CA 3.3Å; L339-T420 WeakPolarHBondContact O-CA 3.33Å; V371-T420 CarbonylContact C-O 3.59Å; V371-T420 WeakPolarHBondContact CA-O 3.48Å; Y372-T420 PolarHBondContact N-O 3.18Å; Y372-T420 PolarHBondContact O-N 3.33Å; Y372-T420 PolarHBondContact O-OG1 3.06Å; V374-T420 HydrophobicContact CG2-CG2 3.67Å; T418-T420 HydrophobicContact CG2-CG2 4.34Å
421	D	83	Confident	71.4	Confident	64 Å²	64	47 Å²	47	34%	0.342	25%	0.248	S	C	.	.	S	Bend	trans	-69.3	-42	179.6	-77.3	-35.5	0	0	0	113.6	L339	L339-D421 HydrophobicContact CB-CB 4.25Å; L339-D421 WeakPolarHBondContact CB-OD1 3.24Å; L339-D421 VanDerWaalsContact CB-OD2 3.3Å; L339-D421 WeakPolarHBondContact CB-OD2 3.49Å; L339-D421 PolarHBondContact N-OD2 3.44Å
422	K	74.1	Confident	69.6	Low	139 Å²	139	48.1 Å²	48.1	60%	0.604	25%	0.251	S	S	*	.			trans	-151.1	145	-170.5	-64.3	-177.6	-176.9	177.3	0	110.4	S424 S425	K422-S424 PolarHBondContact O-N 3.47Å; K422-S425 WeakPolarHBondContact O-CB 3.38Å; K422-S425 PolarHBondContact O-N 2.85Å; K422-S425 PolarHBondContact O-OG 3.36Å
423	L	66.4	Low	67.7	Low	84 Å²	84	45.1 Å²	45.1	44%	0.44	25%	0.246	S	C	.	.	H	α-helix	trans	-49.3	-41.6	170.2	178.5	62.3	0	0	0	112.6	Y372 S425 V426 E427	Y372-L423 HydrophobicContact CE1-CB 4.33Å; Y372-L423 HydrophobicContact CE1-CD1 3.74Å; Y372-L423 WeakPolarHBondContact OH-CD1 3.3Å; L423-S425 PolarHBondContact O-N 3.48Å; L423-S425 VanDerWaalsContact O-N 3.09Å; L423-V426 VanDerWaalsContact O-CB 3.27Å; L423-V426 WeakPolarHBondContact O-CB 3.09Å; L423-V426 PolarHBondContact O-N 3.35Å; L423-E427 PolarHBondContact O-N 3.07Å
424	S	56.1	Low	65.6	Low	55 Å²	55	53 Å²	53	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-18.9	179.1	59.9	0	0	0	0	114	K422 V426 E427 T428	K422-S424 PolarHBondContact O-N 3.47Å; S424-V426 PolarHBondContact O-N 2.96Å; S424-E427 PolarHBondContact O-N 3.37Å; S424-T428 WeakPolarHBondContact O-CB 3.32Å; S424-T428 PolarHBondContact O-N 3.17Å; S424-T428 PolarHBondContact O-OG1 3.02Å
425	S	56.8	Low	63.5	Low	10 Å²	10	57.3 Å²	57.3	7%	0.07	31%	0.311	C	S	.	.	H	α-helix	trans	-64.1	-34.6	172.8	-44.1	0	0	0	0	111.1	S338 K422 L423 S429	S338-S425 WeakPolarHBondContact OG-CB 3.47Å; S338-S425 PolarHBondContact OG-OG 2.87Å; K422-S425 WeakPolarHBondContact O-CB 3.38Å; K422-S425 PolarHBondContact O-N 2.85Å; K422-S425 PolarHBondContact O-OG 3.36Å; L423-S425 PolarHBondContact O-N 3.48Å; L423-S425 VanDerWaalsContact O-N 3.09Å; S425-S429 WeakPolarHBondContact O-CB 3.35Å; S425-S429 PolarHBondContact O-N 2.86Å; S425-S429 VanDerWaalsContact O-N 3.16Å; S425-S429 PolarHBondContact O-OG 3.26Å
426	V	55.8	Low	61.5	Low	14 Å²	14	61 Å²	61	9%	0.085	34%	0.337	C	S	.	.	H	α-helix	trans	-71.3	-43.5	175.6	-170	0	0	0	0	109.6	V374 L423 S424 T428 S429 H430	V374-V426 HydrophobicContact CG1-CG1 4.42Å; V374-V426 HydrophobicContact CG1-CG2 4.12Å; V374-V426 HydrophobicContact CG2-CG2 3.86Å; L423-V426 VanDerWaalsContact O-CB 3.27Å; L423-V426 WeakPolarHBondContact O-CB 3.09Å; L423-V426 PolarHBondContact O-N 3.35Å; S424-V426 PolarHBondContact O-N 2.96Å; V426-T428 PolarHBondContact O-N 2.91Å; V426-S429 WeakPolarHBondContact CA-OG 3.46Å; V426-S429 PolarHBondContact O-N 2.76Å; V426-S429 PolarHBondContact O-OG 2.82Å; V426-H430 PolarHBondContact O-CD2 3.24Å; V426-H430 VanDerWaalsContact O-CG 3.28Å; V426-H430 PolarHBondContact O-N 3.37Å
427	E	52.3	Low	59.5	Low	115 Å²	115	67.6 Å²	67.6	54%	0.537	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-35.4	176.6	-61.1	-179.6	151.3	0	0	114	L423 S424 H430 S431	L423-E427 PolarHBondContact O-N 3.07Å; S424-E427 PolarHBondContact O-N 3.37Å; E427-H430 WeakPolarHBondContact O-CB 3.46Å; E427-H430 PolarHBondContact O-N 3.45Å; E427-S431 PolarHBondContact O-N 2.82Å; E427-S431 VanDerWaalsContact O-N 3.11Å; E427-S431 PolarHBondContact O-OG 3.3Å
428	T	51.3	Low	57.2	Low	69 Å²	69	69.9 Å²	69.9	42%	0.423	38%	0.379	S	S	.	.	H	α-helix	trans	-72.2	-36.1	178.3	-46.4	0	0	0	0	110.7	S424 V426 S431 K432	S424-T428 WeakPolarHBondContact O-CB 3.32Å; S424-T428 PolarHBondContact O-N 3.17Å; S424-T428 PolarHBondContact O-OG1 3.02Å; V426-T428 PolarHBondContact O-N 2.91Å; T428-S431 PolarHBondContact O-N 2.85Å; T428-S431 VanDerWaalsContact O-N 3.15Å; T428-K432 PolarHBondContact O-N 3.38Å; T428-K432 VanDerWaalsContact O-N 3.17Å
429	S	51.5	Low	55	Low	11 Å²	11	74.8 Å²	74.8	8%	0.077	41%	0.41	C	S	.	.	H	α-helix	trans	-71.5	-33.8	173.5	48.2	0	0	0	0	111.5	F334 S425 V426 S431 L445	F334-S429 VanDerWaalsContact O-CB 3.26Å; F334-S429 WeakPolarHBondContact O-CB 3.2Å; S425-S429 WeakPolarHBondContact O-CB 3.35Å; S425-S429 PolarHBondContact O-N 2.86Å; S425-S429 VanDerWaalsContact O-N 3.16Å; S425-S429 PolarHBondContact O-OG 3.26Å; V426-S429 WeakPolarHBondContact CA-OG 3.46Å; V426-S429 PolarHBondContact O-N 2.76Å; V426-S429 PolarHBondContact O-OG 2.82Å; S429-S431 PolarHBondContact O-N 3.25Å; S429-L445 WeakPolarHBondContact OG-CD2 3.15Å
430	H	48.7	Very low	52.9	Low	74 Å²	74	78.1 Å²	78.1	34%	0.343	44%	0.438	S	S	.	.	H	α-helix	trans	-59.6	-27.4	165.8	-74.1	-57.6	0	0	0	113.8	V426 E427 K434 L445	V426-H430 PolarHBondContact O-CD2 3.24Å; V426-H430 VanDerWaalsContact O-CG 3.28Å; V426-H430 PolarHBondContact O-N 3.37Å; E427-H430 WeakPolarHBondContact O-CB 3.46Å; E427-H430 PolarHBondContact O-N 3.45Å; H430-K434 VanDerWaalsContact O-CE 3.26Å; H430-K434 WeakPolarHBondContact O-CE 3.48Å; H430-K434 WeakPolarHBondContact O-CG 3.29Å; H430-L445 WeakPolarHBondContact CE1-CD1 3.38Å; H430-L445 WeakPolarHBondContact ND1-CD1 3.46Å
431	S	47.4	Very low	50.8	Low	70 Å²	70	79.9 Å²	79.9	49%	0.49	45%	0.448	S	S	.	.	H	α-helix	trans	-91.2	-31.7	-173.3	-59.4	0	0	0	0	113.6	E427 T428 S429	E427-S431 PolarHBondContact O-N 2.82Å; E427-S431 VanDerWaalsContact O-N 3.11Å; E427-S431 PolarHBondContact O-OG 3.3Å; T428-S431 PolarHBondContact O-N 2.85Å; T428-S431 VanDerWaalsContact O-N 3.15Å; S429-S431 PolarHBondContact O-N 3.25Å
432	K	48	Very low	48.6	Very low	158 Å²	158	85.3 Å²	85.3	69%	0.687	46%	0.463	S	S	*	.	H	α-helix	trans	-85.8	-17.1	-179.4	-72.5	-176.1	177.7	179.2	0	114.5	T428	T428-K432 PolarHBondContact O-N 3.38Å; T428-K432 VanDerWaalsContact O-N 3.17Å
433	G	44.7	Very low	47.1	Very low	34 Å²	34	86.1 Å²	86.1	35%	0.351	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	5.4	178.1	0	0	0	0	0	116	S435	G433-S435 VanDerWaalsContact C-N 3.26Å; G433-S435 PolarHBondContact O-N 3.12Å; G433-S435 VanDerWaalsContact O-N 3.12Å
434	K	43.6	Very low	46.2	Very low	164 Å²	164	87.1 Å²	87.1	71%	0.713	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-7.4	-167.6	-74	-174.9	174.1	172	0	116.6	H430	H430-K434 VanDerWaalsContact O-CE 3.26Å; H430-K434 WeakPolarHBondContact O-CE 3.48Å; H430-K434 WeakPolarHBondContact O-CG 3.29Å
435	S	41.5	Very low	45.9	Very low	112 Å²	112	85.3 Å²	85.3	78%	0.783	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-1	-172.9	67.1	0	0	0	0	116.5	G433	G433-S435 VanDerWaalsContact C-N 3.26Å; G433-S435 PolarHBondContact O-N 3.12Å; G433-S435 VanDerWaalsContact O-N 3.12Å
436	S	41	Very low	45.9	Very low	88 Å²	88	87.7 Å²	87.7	62%	0.615	47%	0.468	S	S	*	.	S	Bend	trans	-141	5.4	-172.7	-55.3	0	0	0	0	116.6
437	Y	39.1	Very low	46.1	Very low	142 Å²	142	87.9 Å²	87.9	56%	0.557	47%	0.468	S	S	*	.			trans	-141.6	142.2	-172.2	-69.2	-68.3	0	0	0	113.1	D441	Y437-D441 WeakPolarHBondContact CA-OD2 3.39Å; Y437-D441 WeakPolarHBondContact CB-OD2 2.99Å; Y437-D441 HydrophobicContact CD1-CB 4.41Å; Y437-D441 HydrophobicContact CG-CB 4.31Å
438	S	38	Very low	46.1	Very low	63 Å²	63	85.6 Å²	85.6	44%	0.441	47%	0.469	S	S	.	.			trans	-73.7	165.6	-176.3	77	0	0	0	0	112.4	A440 D441	S438-A440 PolarHBondContact O-N 2.92Å; S438-A440 VanDerWaalsContact O-N 3.14Å; S438-D441 PolarHBondContact N-OD2 2.94Å; S438-D441 WeakPolarHBondContact O-CA 3.33Å; S438-D441 WeakPolarHBondContact O-CB 2.95Å; S438-D441 PolarHBondContact O-N 3.32Å; S438-D441 PolarHBondContact OG-OD2 3.1Å; S438-D441 VanDerWaalsContact OG-OD2 3.11Å
439	P	40.5	Very low	46.3	Very low	102 Å²	102	84.6 Å²	84.6	66%	0.662	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-56.7	-28.6	177.2	-23.4	33.6	0	0	0	114.4	D441 R442	P439-D441 PolarHBondContact O-N 3.16Å; P439-R442 WeakPolarHBondContact O-CB 3.39Å; P439-R442 PolarHBondContact O-N 3.24Å
440	A	43.8	Very low	46.6	Very low	73 Å²	73	85.5 Å²	85.5	60%	0.603	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-64.7	-25.6	174	0	0	0	0	0	112.4	S438 R442 Q443	S438-A440 PolarHBondContact O-N 2.92Å; S438-A440 VanDerWaalsContact O-N 3.14Å; A440-R442 PolarHBondContact O-N 3.42Å; A440-Q443 PolarHBondContact O-N 3.2Å
441	D	42.5	Very low	47.2	Very low	36 Å²	36	86.3 Å²	86.3	19%	0.193	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-77.1	-4.7	178.2	-62.8	-52.3	0	0	0	113.4	Y437 S438 P439 Q443 K444	Y437-D441 WeakPolarHBondContact CA-OD2 3.39Å; Y437-D441 WeakPolarHBondContact CB-OD2 2.99Å; Y437-D441 HydrophobicContact CD1-CB 4.41Å; Y437-D441 HydrophobicContact CG-CB 4.31Å; S438-D441 PolarHBondContact N-OD2 2.94Å; S438-D441 WeakPolarHBondContact O-CA 3.33Å; S438-D441 WeakPolarHBondContact O-CB 2.95Å; S438-D441 PolarHBondContact O-N 3.32Å; S438-D441 PolarHBondContact OG-OD2 3.1Å; S438-D441 VanDerWaalsContact OG-OD2 3.11Å; P439-D441 PolarHBondContact O-N 3.16Å; D441-Q443 PolarHBondContact O-N 3.49Å; D441-K444 HydrophobicContact CB-CD 3.93Å; D441-K444 HydrophobicContact CB-CG 4.33Å; D441-K444 WeakPolarHBondContact O-CB 3.36Å; D441-K444 PolarHBondContact O-N 3.11Å; D441-K444 WeakPolarHBondContact OD1-CD 3.42Å; D441-K444 WeakPolarHBondContact OD1-CE 3.5Å; D441-K444 IonicContact OD1-NZ 3.65Å; D441-K444 PolarHBondContact OD1-NZ 3.2Å
442	R	38.3	Very low	48	Very low	179 Å²	179	86 Å²	86	68%	0.675	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-63.6	-24	171.1	-69.1	-176.5	-172.5	173.7	4.7	112.2	P439 A440 K444	P439-R442 WeakPolarHBondContact O-CB 3.39Å; P439-R442 PolarHBondContact O-N 3.24Å; A440-R442 PolarHBondContact O-N 3.42Å; R442-K444 PolarHBondContact O-N 2.84Å
443	Q	42.7	Very low	48.8	Very low	155 Å²	155	80.6 Å²	80.6	72%	0.724	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18.3	168	-86.2	176.1	-21.2	0	0	113.3	A440 D441 L445 L446	A440-Q443 PolarHBondContact O-N 3.2Å; D441-Q443 PolarHBondContact O-N 3.49Å; Q443-L445 PolarHBondContact O-N 3.26Å; Q443-L446 PolarHBondContact O-N 3Å
444	K	46.6	Very low	49.8	Very low	106 Å²	106	80.9 Å²	80.9	46%	0.461	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-72.4	-7.6	179.4	-67.3	-179.1	170.6	160.1	0	114.5	D441 R442	D441-K444 HydrophobicContact CB-CD 3.93Å; D441-K444 HydrophobicContact CB-CG 4.33Å; D441-K444 WeakPolarHBondContact O-CB 3.36Å; D441-K444 PolarHBondContact O-N 3.11Å; D441-K444 WeakPolarHBondContact OD1-CD 3.42Å; D441-K444 WeakPolarHBondContact OD1-CE 3.5Å; D441-K444 IonicContact OD1-NZ 3.65Å; D441-K444 PolarHBondContact OD1-NZ 3.2Å; R442-K444 PolarHBondContact O-N 2.84Å
445	L	49	Very low	51.2	Low	16 Å²	16	73.1 Å²	73.1	8%	0.084	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-80.2	-31.2	176.4	-78.3	160.9	0	0	0	112.7	F334 Y335 S429 H430 Q443 L447	F334-L445 HydrophobicContact CB-CD2 4.18Å; F334-L445 HydrophobicContact CD1-CD2 3.94Å; F334-L445 HydrophobicContact CG-CD2 4.37Å; Y335-L445 PolarHBondContact OH-O 3.38Å; S429-L445 WeakPolarHBondContact OG-CD2 3.15Å; H430-L445 WeakPolarHBondContact CE1-CD1 3.38Å; H430-L445 WeakPolarHBondContact ND1-CD1 3.46Å; Q443-L445 PolarHBondContact O-N 3.26Å; L445-L447 PolarHBondContact O-N 3.37Å
446	L	57	Low	52.8	Low	60 Å²	60	68.5 Å²	68.5	31%	0.314	39%	0.392	S	S	.	.	S	Bend	trans	-67.2	133.2	165.9	-67.3	167.7	0	0	0	107.1	V374 N375 Q443 A448	V374-L446 HydrophobicContact CB-CD2 4.2Å; V374-L446 HydrophobicContact CG1-CD2 3.76Å; N375-L446 WeakPolarHBondContact OD1-CD2 3.49Å; Q443-L446 PolarHBondContact O-N 3Å; L446-A448 PolarHBondContact O-N 2.93Å
447	L	59.8	Low	54.7	Low	19 Å²	19	66.2 Å²	66.2	10%	0.099	37%	0.37	C	S	.	.			trans	-61.5	98.7	160.4	-63.6	174.3	0	0	0	103.7	R135 V331 L342 Y361 T418 L445 G449	R135-L447 PolarHBondContact NH2-O 3.14Å; V331-L447 HydrophobicContact CB-CD2 4.29Å; V331-L447 HydrophobicContact CG1-CD2 3.7Å; V331-L447 HydrophobicContact CG2-CD2 3.57Å; L342-L447 HydrophobicContact CB-CD1 3.79Å; L342-L447 HydrophobicContact CD1-CB 4.07Å; L342-L447 HydrophobicContact CD1-CD1 4.42Å; Y361-L447 HydrophobicContact CD2-CD1 3.82Å; Y361-L447 HydrophobicContact CE2-CD1 3.82Å; T418-L447 HydrophobicContact CG2-CD1 4.05Å; T418-L447 HydrophobicContact CG2-CG 4.1Å; T418-L447 PolarHBondContact OG1-N 3Å; L445-L447 PolarHBondContact O-N 3.37Å; L447-G449 PolarHBondContact O-N 3.26Å
448	A	54.2	Low	57	Low	67 Å²	67	60.4 Å²	60.4	55%	0.554	35%	0.348	S	S	*	.			trans	-23.1	120.1	-167.9	0	0	0	0	0	113.7	R135 L446	R135-A448 PolarHBondContact NH1-O 3.21Å; R135-A448 PolarHBondContact NH2-O 3.15Å; L446-A448 PolarHBondContact O-N 2.93Å
449	G	54.7	Low	59.4	Low	48 Å²	48	57.5 Å²	57.5	50%	0.495	33%	0.327	S	S	.	.			trans	-51	155.6	179.6	0	0	0	0	0	112.9	L447 S451	L447-G449 PolarHBondContact O-N 3.26Å; G449-S451 PolarHBondContact O-N 3.35Å
450	V	58.2	Low	61.8	Low	29 Å²	29	53.9 Å²	53.9	18%	0.176	30%	0.303	C	S	.	.			trans	-63.7	122.1	171.9	-178.3	0	0	0	0	107.4	L452	V450-L452 HydrophobicContact CB-CD2 4.28Å; V450-L452 HydrophobicContact CB-CG 4.4Å; V450-L452 HydrophobicContact CG1-CD2 3.67Å; V450-L452 HydrophobicContact CG1-CG 4.16Å; V450-L452 PolarHBondContact O-N 3.42Å
451	S	60	Low	64.1	Low	91 Å²	91	50.4 Å²	50.4	64%	0.636	27%	0.274	S	S	*	.			trans	-72.4	96.8	171.2	51.1	0	0	0	0	108	G449	G449-S451 PolarHBondContact O-N 3.35Å
452	L	64.1	Low	66.4	Low	63 Å²	63	52.9 Å²	52.9	33%	0.33	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-82.7	123.4	-179	-63.2	165.4	0	0	0	109	I128 V450 P484	I128-L452 HydrophobicContact CD1-CD2 4.3Å; I128-L452 HydrophobicContact CG2-CD2 4.3Å; V450-L452 HydrophobicContact CB-CD2 4.28Å; V450-L452 HydrophobicContact CB-CG 4.4Å; V450-L452 HydrophobicContact CG1-CD2 3.67Å; V450-L452 HydrophobicContact CG1-CG 4.16Å; V450-L452 PolarHBondContact O-N 3.42Å; L452-P484 HydrophobicContact CD1-CB 3.64Å; L452-P484 HydrophobicContact CD1-CG 3.86Å; L452-P484 HydrophobicContact CD2-CB 4.3Å; L452-P484 HydrophobicContact CD2-CG 3.69Å; L452-P484 HydrophobicContact CG-CG 4.42Å
453	P	64.7	Low	69	Low	46 Å²	46	45.1 Å²	45.1	30%	0.299	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-62.8	154.2	170	28.1	-33.6	0	0	0	110.4	I128 M502	I128-P453 HydrophobicContact CD1-CG 3.85Å; I128-P453 HydrophobicContact CG1-CG 4.37Å; P453-M502 HydrophobicContact CG-CE 3.81Å; P453-M502 HydrophobicContact CG-SD 4Å
454	D	65.7	Low	71.2	Confident	40 Å²	40	39.7 Å²	39.7	21%	0.214	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-70.9	138.7	171.9	-80.3	-41.1	0	0	0	110.3	V456 R487	D454-V456 PolarHBondContact O-N 3.31Å; D454-R487 IonicContact OD1-CZ 3.56Å; D454-R487 VanDerWaalsContact OD1-CZ 3.27Å; D454-R487 IonicContact OD1-NH1 3.71Å; D454-R487 PolarHBondContact OD1-NH1 2.88Å; D454-R487 IonicContact OD1-NH2 3.78Å; D454-R487 PolarHBondContact OD1-NH2 2.89Å
455	P	74.5	Confident	73.1	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-66.4	135.6	176.9	29.2	-33.7	0	0	0	109.8	R487 E500 N530	P455-R487 VanDerWaalsContact CD-CZ 3.43Å; P455-R487 HydrophobicContact CG-CG 4.17Å; P455-E500 HydrophobicContact CB-CB 3.69Å; P455-E500 HydrophobicContact CG-CB 3.65Å; P455-E500 HydrophobicContact CG-CG 4.45Å; P455-E500 VanDerWaalsContact CG-OE2 3.27Å; P455-E500 WeakPolarHBondContact CG-OE2 3.42Å; P455-N530 PolarHBondContact O-ND2 3.07Å
456	V	75	Confident	74.9	Confident	14 Å²	14	44 Å²	44	9%	0.085	27%	0.273	C	S	.	.			trans	-100.4	-22	-171	-69.6	0	0	0	0	112.8	D454 G501 M502 N530 L704 F728	D454-V456 PolarHBondContact O-N 3.31Å; V456-G501 PolarHBondContact N-O 3.41Å; V456-G501 VanDerWaalsContact N-O 3.08Å; V456-M502 WeakPolarHBondContact CG2-O 3.49Å; V456-N530 PolarHBondContact O-N 3.01Å; V456-N530 VanDerWaalsContact O-N 3.15Å; V456-L704 HydrophobicContact CB-CD2 3.7Å; V456-L704 HydrophobicContact CG1-CD2 4.43Å; V456-L704 HydrophobicContact CG2-CD2 4.4Å; V456-F728 HydrophobicContact CG1-CB 4.38Å; V456-F728 HydrophobicContact CG1-CD2 4.36Å
457	Y	80.9	Confident	76.4	Confident	40 Å²	40	44.1 Å²	44.1	16%	0.157	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	149.4	176.2	-67.7	-76.4	0	0	0	111.3	E500 G501 L527 Q528	Y457-E500 CarbonylContact O-C 3.58Å; Y457-E500 VanDerWaalsContact O-CA 3.24Å; Y457-E500 WeakPolarHBondContact O-CA 3.34Å; Y457-G501 PolarHBondContact N-O 3.04Å; Y457-G501 VanDerWaalsContact N-O 3.08Å; Y457-G501 PolarHBondContact O-N 3.29Å; Y457-L527 HydrophobicContact CD1-CD1 4.27Å; Y457-L527 HydrophobicContact CD1-CD2 3.52Å; Y457-L527 HydrophobicContact CD1-CG 3.62Å; Y457-L527 HydrophobicContact CE1-CD2 3.85Å; Y457-L527 HydrophobicContact CE1-CG 4.34Å; Y457-L527 HydrophobicContact CG-CD1 4.21Å; Y457-L527 HydrophobicContact CG-CD2 3.88Å; Y457-L527 HydrophobicContact CG-CG 4.04Å; Y457-Q528 WeakPolarHBondContact CA-O 2.98Å
458	K	86.1	Confident	77.9	Confident	21 Å²	21	48 Å²	48	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.9	171	67.7	178.3	-175.7	172.6	0	110.8	V498 L499 E500 Q528	K458-V498 HydrophobicContact CB-CG1 4.04Å; K458-V498 HydrophobicContact CD-CG1 4.46Å; K458-L499 CarbonylContact C-O 3.52Å; K458-L499 VanDerWaalsContact CA-O 3.3Å; K458-L499 WeakPolarHBondContact CA-O 3.4Å; K458-E500 HydrophobicContact CB-CG 4.12Å; K458-Q528 HydrophobicContact CG-CB 3.96Å; K458-Q528 PolarHBondContact N-O 3.37Å; K458-Q528 PolarHBondContact O-N 3.03Å
459	C	89	Confident	79.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151.3	171.5	62.3	0	0	0	0	110.1	L499 L527	C459-L499 PolarHBondContact N-O 2.85Å; C459-L499 PolarHBondContact O-N 3.05Å; C459-L527 HydrophobicContact CB-CD1 4.29Å
460	V	90.8	Very high	81.3	Confident	27 Å²	27	48.9 Å²	48.9	16%	0.164	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	139.1	169.8	177.1	0	0	0	0	109.1	E462 E496 T497 L524 G525	V460-E462 HydrophobicContact CG1-CG 4.04Å; V460-E496 HydrophobicContact CG1-CB 3.8Å; V460-E496 HydrophobicContact CG1-CG 4.29Å; V460-T497 WeakPolarHBondContact CA-O 3.3Å; V460-L524 CarbonylContact O-C 3.51Å; V460-L524 WeakPolarHBondContact O-CA 3.34Å; V460-G525 PolarHBondContact O-N 3.47Å
461	I	92.5	Very high	82.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.6	175.1	-175.2	167.7	0	0	0	110.5	L472 L476 T497 L499 L514 V522 F523 L524	I461-L472 HydrophobicContact CD1-CD1 4.22Å; I461-L472 HydrophobicContact CG1-CD2 4.48Å; I461-L476 HydrophobicContact CD1-CD2 4.24Å; I461-L476 HydrophobicContact CG2-CD1 4.1Å; I461-T497 HydrophobicContact CG2-CG2 3.77Å; I461-T497 PolarHBondContact N-O 3.24Å; I461-L499 HydrophobicContact CD1-CD2 4.46Å; I461-L499 HydrophobicContact CG2-CB 4.03Å; I461-L514 HydrophobicContact CD1-CD1 3.51Å; I461-V522 HydrophobicContact CD1-CB 4.22Å; I461-V522 HydrophobicContact CD1-CG1 4.37Å; I461-V522 HydrophobicContact CD1-CG2 4.05Å; I461-V522 HydrophobicContact CG1-CB 4.06Å; I461-V522 HydrophobicContact CG1-CG1 4.44Å; I461-V522 HydrophobicContact CG1-CG2 4.32Å; I461-F523 WeakPolarHBondContact CA-O 3.15Å; I461-L524 HydrophobicContact CB-CD2 3.9Å; I461-L524 HydrophobicContact CD1-CD2 3.86Å; I461-L524 HydrophobicContact CG1-CD2 3.77Å
462	E	91	Very high	84.4	Confident	88 Å²	88	48.8 Å²	48.8	41%	0.411	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.7	179.9	-61.9	-169.1	146.5	0	0	111.3	V460 V522 F523	V460-E462 HydrophobicContact CG1-CG 4.04Å; E462-V522 CarbonylContact O-C 3.6Å; E462-V522 VanDerWaalsContact O-CA 3.24Å; E462-V522 WeakPolarHBondContact O-CA 3.32Å; E462-V522 WeakPolarHBondContact O-CB 3.03Å; E462-F523 PolarHBondContact N-O 3.03Å; E462-F523 PolarHBondContact O-N 3.35Å
463	P	92	Very high	85.7	Confident	16 Å²	16	48.1 Å²	48.1	10%	0.104	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	153.4	172.9	32.3	-32.8	0	0	0	110.4	T465 Q469 L472	P463-T465 PolarHBondContact O-N 3.45Å; P463-Q469 HydrophobicContact CG-CB 4.46Å; P463-Q469 VanDerWaalsContact CG-OE1 3.31Å; P463-L472 HydrophobicContact CB-CD2 4.23Å; P463-L472 HydrophobicContact CG-CD2 4.23Å
464	S	89	Confident	86.9	Confident	41 Å²	41	50.3 Å²	50.3	29%	0.287	28%	0.282	S	S	.	.	S	Bend	trans	-60.6	-18.8	176.7	63	0	0	0	0	114.5	E521	S464-E521 WeakPolarHBondContact CB-O 3.42Å; S464-E521 PolarHBondContact N-O 3.36Å; S464-E521 PolarHBondContact OG-O 3.05Å
465	T	87.5	Confident	88.2	Confident	83 Å²	83	48.4 Å²	48.4	51%	0.509	27%	0.272	S	S	.	.	S	Bend	trans	-148.3	140.6	174.1	-54.4	0	0	0	0	109.6	P463 G467 Y468	P463-T465 PolarHBondContact O-N 3.45Å; T465-G467 PolarHBondContact O-N 2.89Å; T465-Y468 PolarHBondContact O-N 3.32Å
466	V	86.6	Confident	89.1	Confident	130 Å²	130	48.6 Å²	48.6	79%	0.788	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-52.6	-30.7	179.8	-174.6	0	0	0	0	113.2	Y468 Q469	V466-Y468 PolarHBondContact O-N 3.02Å; V466-Y468 VanDerWaalsContact O-N 3.13Å; V466-Q469 WeakPolarHBondContact O-CB 3.42Å; V466-Q469 PolarHBondContact O-N 2.66Å; V466-Q469 VanDerWaalsContact O-N 3.14Å
467	G	87.7	Confident	89.7	Confident	62 Å²	62	54.8 Å²	54.8	64%	0.639	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-62.1	-17.8	176.8	0	0	0	0	0	114.8	T465	T465-G467 PolarHBondContact O-N 2.89Å
468	Y	90.6	Very high	90.1	Very high	101 Å²	101	56.2 Å²	56.2	40%	0.396	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-95.1	-1.6	178	-67.9	-66.8	0	0	0	114.1	T465 V466 S470 K471 L472 L520	T465-Y468 PolarHBondContact O-N 3.32Å; V466-Y468 PolarHBondContact O-N 3.02Å; V466-Y468 VanDerWaalsContact O-N 3.13Å; Y468-S470 PolarHBondContact O-N 3.37Å; Y468-K471 HydrophobicContact CD1-CD 4.11Å; Y468-K471 WeakPolarHBondContact O-CB 3.26Å; Y468-K471 PolarHBondContact O-N 2.98Å; Y468-L472 PolarHBondContact O-N 3.11Å; Y468-L520 HydrophobicContact CD1-CD2 3.98Å; Y468-L520 HydrophobicContact CG-CD2 4.26Å
469	Q	89.5	Confident	90.2	Very high	56 Å²	56	55.3 Å²	55.3	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-54.3	-47.2	-177	-172.1	64.5	35.6	0	0	112.9	P463 V466 K471 L472 D473 T497	P463-Q469 HydrophobicContact CG-CB 4.46Å; P463-Q469 VanDerWaalsContact CG-OE1 3.31Å; V466-Q469 WeakPolarHBondContact O-CB 3.42Å; V466-Q469 PolarHBondContact O-N 2.66Å; V466-Q469 VanDerWaalsContact O-N 3.14Å; Q469-K471 PolarHBondContact O-N 3.31Å; Q469-L472 WeakPolarHBondContact O-CB 3.47Å; Q469-L472 PolarHBondContact O-N 3.2Å; Q469-L472 VanDerWaalsContact O-N 3.1Å; Q469-D473 PolarHBondContact NE2-OD1 3.47Å; Q469-D473 VanDerWaalsContact O-CG 3.24Å; Q469-D473 PolarHBondContact O-N 3.35Å; Q469-T497 PolarHBondContact NE2-OG1 2.91Å
470	S	90.7	Very high	90.2	Very high	76 Å²	76	57.3 Å²	57.3	53%	0.531	32%	0.315	S	S	.	.	H	α-helix	trans	-63.9	-29.5	179.5	60.1	0	0	0	0	113.5	Y468 N474	Y468-S470 PolarHBondContact O-N 3.37Å; S470-N474 VanDerWaalsContact O-CG 3.27Å; S470-N474 PolarHBondContact O-N 3.13Å; S470-N474 PolarHBondContact O-ND2 3.25Å; S470-N474 VanDerWaalsContact O-ND2 3.1Å
471	K	91.7	Very high	89.9	Confident	118 Å²	118	57.6 Å²	57.6	51%	0.513	31%	0.313	S	S	.	.	H	α-helix	trans	-75.8	-39.3	174.1	-64.6	-167.4	-170.8	171.4	0	111.1	Y468 Q469 N474 A475 L520	Y468-K471 HydrophobicContact CD1-CD 4.11Å; Y468-K471 WeakPolarHBondContact O-CB 3.26Å; Y468-K471 PolarHBondContact O-N 2.98Å; Q469-K471 PolarHBondContact O-N 3.31Å; K471-N474 PolarHBondContact O-N 3.34Å; K471-A475 WeakPolarHBondContact O-CB 3.43Å; K471-A475 PolarHBondContact O-N 3.49Å; K471-L520 HydrophobicContact CB-CD1 4.13Å; K471-L520 HydrophobicContact CB-CD2 3.93Å; K471-L520 HydrophobicContact CD-CD2 4.39Å
472	L	92.8	Very high	89.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-51	174.2	179.9	63.7	0	0	0	110.6	I461 P463 Y468 Q469 N474 A475 L476 L514 V522	I461-L472 HydrophobicContact CD1-CD1 4.22Å; I461-L472 HydrophobicContact CG1-CD2 4.48Å; P463-L472 HydrophobicContact CB-CD2 4.23Å; P463-L472 HydrophobicContact CG-CD2 4.23Å; Y468-L472 PolarHBondContact O-N 3.11Å; Q469-L472 WeakPolarHBondContact O-CB 3.47Å; Q469-L472 PolarHBondContact O-N 3.2Å; Q469-L472 VanDerWaalsContact O-N 3.1Å; L472-N474 PolarHBondContact O-N 2.94Å; L472-A475 PolarHBondContact O-N 2.63Å; L472-A475 VanDerWaalsContact O-N 3.16Å; L472-L476 HydrophobicContact CD1-CD1 3.89Å; L472-L476 HydrophobicContact CD1-CD2 4.37Å; L472-L476 HydrophobicContact CD1-CG 3.87Å; L472-L476 HydrophobicContact CD2-CD1 4.37Å; L472-L476 HydrophobicContact CG-CD1 3.75Å; L472-L476 HydrophobicContact CG-CG 4.13Å; L472-L476 VanDerWaalsContact O-CB 3.26Å; L472-L476 WeakPolarHBondContact O-CB 3.33Å; L472-L476 VanDerWaalsContact O-CG 3.29Å; L472-L476 WeakPolarHBondContact O-CG 3.26Å; L472-L476 PolarHBondContact O-N 2.96Å; L472-L514 HydrophobicContact CD1-CD1 4.09Å; L472-L514 HydrophobicContact CD1-CD2 4.21Å; L472-V522 HydrophobicContact CD1-CG1 3.73Å
473	D	91.8	Very high	89.1	Confident	50 Å²	50	55.6 Å²	55.6	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-57.3	-38.7	179.9	-62	-17	0	0	0	112.4	Q469 K477	Q469-D473 PolarHBondContact NE2-OD1 3.47Å; Q469-D473 VanDerWaalsContact O-CG 3.24Å; Q469-D473 PolarHBondContact O-N 3.35Å; D473-K477 WeakPolarHBondContact O-CB 3.44Å; D473-K477 WeakPolarHBondContact O-CD 3.38Å; D473-K477 WeakPolarHBondContact O-CG 3.49Å; D473-K477 PolarHBondContact O-N 2.59Å; D473-K477 VanDerWaalsContact O-N 3.09Å
474	N	90.2	Very high	88.5	Confident	91 Å²	91	56 Å²	56	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-71.1	-45.9	177.5	-70.9	-24	0	0	0	111.8	S470 K471 L472 L476 K477 E478	S470-N474 VanDerWaalsContact O-CG 3.27Å; S470-N474 PolarHBondContact O-N 3.13Å; S470-N474 PolarHBondContact O-ND2 3.25Å; S470-N474 VanDerWaalsContact O-ND2 3.1Å; K471-N474 PolarHBondContact O-N 3.34Å; L472-N474 PolarHBondContact O-N 2.94Å; N474-L476 VanDerWaalsContact C-N 3.32Å; N474-L476 PolarHBondContact O-N 2.8Å; N474-K477 PolarHBondContact O-N 2.84Å; N474-E478 WeakPolarHBondContact O-CG 3.44Å; N474-E478 PolarHBondContact O-N 2.94Å
475	A	92.2	Very high	88	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-42.8	177.4	0	0	0	0	0	111.5	K471 L472 E478 L479 L514 Y518 L520	K471-A475 WeakPolarHBondContact O-CB 3.43Å; K471-A475 PolarHBondContact O-N 3.49Å; L472-A475 PolarHBondContact O-N 2.63Å; L472-A475 VanDerWaalsContact O-N 3.16Å; A475-E478 WeakPolarHBondContact O-CB 3.29Å; A475-E478 PolarHBondContact O-N 2.82Å; A475-L479 VanDerWaalsContact O-CG 3.3Å; A475-L479 WeakPolarHBondContact O-CG 3.46Å; A475-L479 PolarHBondContact O-N 3.25Å; A475-L514 HydrophobicContact CB-CD2 3.6Å; A475-Y518 HydrophobicContact CB-CD1 3.49Å; A475-Y518 VanDerWaalsContact CB-CD1 3.49Å; A475-Y518 HydrophobicContact CB-CD2 4.03Å; A475-Y518 HydrophobicContact CB-CE1 3.66Å; A475-Y518 HydrophobicContact CB-CE2 4.19Å; A475-Y518 HydrophobicContact CB-CG 3.67Å; A475-L520 HydrophobicContact CB-CD1 3.99Å
476	L	92.5	Very high	88	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-42	176.3	-78.1	-174.6	0	0	0	112.6	I461 L472 N474 E478 L479 V480 I488 T497 L514	I461-L476 HydrophobicContact CD1-CD2 4.24Å; I461-L476 HydrophobicContact CG2-CD1 4.1Å; L472-L476 HydrophobicContact CD1-CD1 3.89Å; L472-L476 HydrophobicContact CD1-CD2 4.37Å; L472-L476 HydrophobicContact CD1-CG 3.87Å; L472-L476 HydrophobicContact CD2-CD1 4.37Å; L472-L476 HydrophobicContact CG-CD1 3.75Å; L472-L476 HydrophobicContact CG-CG 4.13Å; L472-L476 VanDerWaalsContact O-CB 3.26Å; L472-L476 WeakPolarHBondContact O-CB 3.33Å; L472-L476 VanDerWaalsContact O-CG 3.29Å; L472-L476 WeakPolarHBondContact O-CG 3.26Å; L472-L476 PolarHBondContact O-N 2.96Å; N474-L476 VanDerWaalsContact C-N 3.32Å; N474-L476 PolarHBondContact O-N 2.8Å; L476-E478 VanDerWaalsContact C-N 3.33Å; L476-E478 PolarHBondContact O-N 2.82Å; L476-L479 PolarHBondContact O-N 3.09Å; L476-V480 VanDerWaalsContact O-CG2 3.32Å; L476-V480 WeakPolarHBondContact O-CG2 3.43Å; L476-V480 PolarHBondContact O-N 3.35Å; L476-I488 HydrophobicContact CB-CD1 3.44Å; L476-I488 VanDerWaalsContact CB-CD1 3.44Å; L476-I488 HydrophobicContact CD1-CD1 4.04Å; L476-I488 HydrophobicContact CD1-CG2 4.31Å; L476-I488 HydrophobicContact CD2-CD1 3.67Å; L476-I488 HydrophobicContact CG-CD1 3.86Å; L476-T497 HydrophobicContact CD1-CG2 3.92Å; L476-L514 HydrophobicContact CD2-CD1 4Å; L476-L514 HydrophobicContact CD2-CD2 4.38Å
477	K	89.4	Confident	87.9	Confident	145 Å²	145	48 Å²	48	63%	0.63	25%	0.248	S	C	*	.	H	α-helix	trans	-61.6	-40.4	173.3	-77	168.8	-173.8	170.3	0	112.4	D473 N474 R481	D473-K477 WeakPolarHBondContact O-CB 3.44Å; D473-K477 WeakPolarHBondContact O-CD 3.38Å; D473-K477 WeakPolarHBondContact O-CG 3.49Å; D473-K477 PolarHBondContact O-N 2.59Å; D473-K477 VanDerWaalsContact O-N 3.09Å; N474-K477 PolarHBondContact O-N 2.84Å; K477-R481 WeakPolarHBondContact O-CB 3.34Å; K477-R481 PolarHBondContact O-N 3.47Å; K477-R481 VanDerWaalsContact O-N 3.14Å
478	E	88.1	Confident	88	Confident	69 Å²	69	47.7 Å²	47.7	32%	0.322	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-45	176.1	-71	179	-175.9	0	0	111.2	H348 N474 A475 L476 R481 E482 Y518	H348-E478 PolarHBondContact CE1-O 3.23Å; N474-E478 WeakPolarHBondContact O-CG 3.44Å; N474-E478 PolarHBondContact O-N 2.94Å; A475-E478 WeakPolarHBondContact O-CB 3.29Å; A475-E478 PolarHBondContact O-N 2.82Å; L476-E478 VanDerWaalsContact C-N 3.33Å; L476-E478 PolarHBondContact O-N 2.82Å; E478-R481 WeakPolarHBondContact O-CB 3.37Å; E478-R481 PolarHBondContact O-N 3.31Å; E478-R481 VanDerWaalsContact O-N 3.17Å; E478-E482 WeakPolarHBondContact O-CG 3.48Å; E478-E482 PolarHBondContact O-N 2.87Å; E478-E482 VanDerWaalsContact O-N 3.07Å; E478-Y518 WeakPolarHBondContact CB-OH 3.19Å; E478-Y518 WeakPolarHBondContact OE2-CE1 3.46Å; E478-Y518 PolarHBondContact OE2-OH 2.9Å
479	L	88.9	Confident	87.9	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-43	178.2	-70	172.6	0	0	0	113.1	A475 L476 R481 E482 D483 V510 R513 L514 Y518	A475-L479 VanDerWaalsContact O-CG 3.3Å; A475-L479 WeakPolarHBondContact O-CG 3.46Å; A475-L479 PolarHBondContact O-N 3.25Å; L476-L479 PolarHBondContact O-N 3.09Å; L479-R481 PolarHBondContact O-N 3.24Å; L479-E482 PolarHBondContact O-N 3.29Å; L479-D483 PolarHBondContact O-N 3.46Å; L479-V510 HydrophobicContact CD1-CG1 4.12Å; L479-R513 VanDerWaalsContact CD2-NH1 3.33Å; L479-L514 HydrophobicContact CD1-CD2 3.71Å; L479-L514 HydrophobicContact CD1-CG 3.91Å; L479-Y518 HydrophobicContact CD2-CE2 4.39Å; L479-Y518 HydrophobicContact CG-CE2 4.4Å
480	V	88.4	Confident	87.7	Confident	43 Å²	43	47.7 Å²	47.7	26%	0.261	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-33.5	174.4	169.5	0	0	0	0	111.6	L476 D483 L486 I488	L476-V480 VanDerWaalsContact O-CG2 3.32Å; L476-V480 WeakPolarHBondContact O-CG2 3.43Å; L476-V480 PolarHBondContact O-N 3.35Å; V480-D483 CarbonylContact O-C 3.54Å; V480-D483 VanDerWaalsContact O-O 3.13Å; V480-L486 HydrophobicContact CG2-CB 4.19Å; V480-I488 HydrophobicContact CG2-CB 4.29Å; V480-I488 HydrophobicContact CG2-CD1 3.28Å; V480-I488 HydrophobicContact CG2-CG1 3.53Å
481	R	85.6	Confident	87.2	Confident	34 Å²	34	45.2 Å²	45.2	13%	0.128	22%	0.215	C	C	.	.	H	α-helix	trans	-69.5	-36.1	177.1	-170.5	179.3	177.6	-162	-5.8	111.9	I346 C354 L410 Q411 T413 K477 E478 L479	I346-R481 HydrophobicContact CD1-CG 4.07Å; I346-R481 HydrophobicContact CG2-CG 4.49Å; C354-R481 PolarHBondContact SG-NH1 3.07Å; L410-R481 PolarHBondContact O-NH2 2.92Å; Q411-R481 PolarHBondContact O-NH1 2.68Å; Q411-R481 PolarHBondContact O-NH2 3.45Å; Q411-R481 VanDerWaalsContact O-NH2 3.1Å; T413-R481 PolarHBondContact O-NE 3.4Å; T413-R481 VanDerWaalsContact O-NE 3.11Å; T413-R481 PolarHBondContact O-NH2 3.45Å; K477-R481 WeakPolarHBondContact O-CB 3.34Å; K477-R481 PolarHBondContact O-N 3.47Å; K477-R481 VanDerWaalsContact O-N 3.14Å; E478-R481 WeakPolarHBondContact O-CB 3.37Å; E478-R481 PolarHBondContact O-N 3.31Å; E478-R481 VanDerWaalsContact O-N 3.17Å; L479-R481 PolarHBondContact O-N 3.24Å
482	E	84.4	Confident	86.3	Confident	16 Å²	16	46 Å²	46	8%	0.075	22%	0.221	C	C	.	.	H	α-helix	trans	-69.4	-51.6	173.8	-66.3	-176.9	175.6	0	0	112	I346 H348 T415 E478 L479 R513	I346-E482 HydrophobicContact CB-CG 4.49Å; I346-E482 HydrophobicContact CG2-CG 4.18Å; I346-E482 WeakPolarHBondContact O-CG 3.34Å; H348-E482 IonicContact CE1-OE1 2.88Å; H348-E482 IonicContact CG-OE1 2.76Å; H348-E482 PolarHBondContact N-OE1 3Å; H348-E482 WeakPolarHBondContact ND1-CG 3.41Å; H348-E482 IonicContact ND1-OE1 3.27Å; H348-E482 PolarHBondContact ND1-OE1 3.26Å; T415-E482 PolarHBondContact OG1-O 3.34Å; E478-E482 WeakPolarHBondContact O-CG 3.48Å; E478-E482 PolarHBondContact O-N 2.87Å; E478-E482 VanDerWaalsContact O-N 3.07Å; L479-E482 PolarHBondContact O-N 3.29Å; E482-R513 IonicContact OE1-NH2 3.95Å; E482-R513 IonicContact OE2-CZ 2.92Å; E482-R513 IonicContact OE2-NH1 3.91Å; E482-R513 PolarHBondContact OE2-NH1 3.29Å; E482-R513 IonicContact OE2-NH2 3.66Å; E482-R513 PolarHBondContact OE2-NH2 3.22Å
483	D	82.3	Confident	85.2	Confident	30 Å²	30	51.8 Å²	51.8	16%	0.16	25%	0.252	C	S	.	.			trans	-115.6	98.1	178.5	-166.7	-0.8	0	0	0	112.1	K132 L479 V480 S485 L486 H506	K132-D483 IonicContact NZ-OD1 2.64Å; L479-D483 PolarHBondContact O-N 3.46Å; V480-D483 CarbonylContact O-C 3.54Å; V480-D483 VanDerWaalsContact O-O 3.13Å; D483-S485 PolarHBondContact O-N 3Å; D483-S485 WeakPolarHBondContact OD1-CB 3.26Å; D483-S485 PolarHBondContact OD1-N 3.37Å; D483-S485 PolarHBondContact OD1-OG 3.03Å; D483-S485 PolarHBondContact OD2-OG 3.31Å; D483-L486 HydrophobicContact CB-CD1 4.18Å; D483-L486 HydrophobicContact CB-CG 4.37Å; D483-L486 WeakPolarHBondContact O-CB 3.23Å; D483-L486 PolarHBondContact O-N 2.9Å; D483-L486 VanDerWaalsContact O-N 3.07Å; D483-H506 IonicContact OD2-CE1 2.94Å; D483-H506 PolarHBondContact OD2-CE1 3.03Å; D483-H506 VanDerWaalsContact OD2-CE1 3.29Å; D483-H506 IonicContact OD2-NE2 3.52Å; D483-H506 PolarHBondContact OD2-NE2 3.41Å
484	P	78.9	Confident	84.6	Confident	25 Å²	25	51.6 Å²	51.6	16%	0.162	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-0.7	-179.5	33.3	-38.7	0	0	0	113.6	L452 L486	L452-P484 HydrophobicContact CD1-CB 3.64Å; L452-P484 HydrophobicContact CD1-CG 3.86Å; L452-P484 HydrophobicContact CD2-CB 4.3Å; L452-P484 HydrophobicContact CD2-CG 3.69Å; L452-P484 HydrophobicContact CG-CG 4.42Å; P484-L486 VanDerWaalsContact C-N 3.34Å
485	S	79	Confident	84.1	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.014	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-16.9	170.5	78.8	0	0	0	0	113.4	D483 H506	D483-S485 PolarHBondContact O-N 3Å; D483-S485 WeakPolarHBondContact OD1-CB 3.26Å; D483-S485 PolarHBondContact OD1-N 3.37Å; D483-S485 PolarHBondContact OD1-OG 3.03Å; D483-S485 PolarHBondContact OD2-OG 3.31Å; S485-H506 PolarHBondContact OG-CE1 2.86Å; S485-H506 VanDerWaalsContact OG-CE1 3.28Å
486	L	86.7	Confident	83.8	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.037	27%	0.273	C	S	.	.			trans	-80.4	131.3	167.3	-66	171.4	0	0	0	109.2	V480 D483 P484 L499 E500 H506 V510	V480-L486 HydrophobicContact CG2-CB 4.19Å; D483-L486 HydrophobicContact CB-CD1 4.18Å; D483-L486 HydrophobicContact CB-CG 4.37Å; D483-L486 WeakPolarHBondContact O-CB 3.23Å; D483-L486 PolarHBondContact O-N 2.9Å; D483-L486 VanDerWaalsContact O-N 3.07Å; P484-L486 VanDerWaalsContact C-N 3.34Å; L486-L499 HydrophobicContact CD2-CD1 4.24Å; L486-E500 WeakPolarHBondContact CA-O 3.49Å; L486-H506 WeakPolarHBondContact CD2-CE1 3.43Å; L486-H506 WeakPolarHBondContact CD2-NE2 3.18Å; L486-V510 HydrophobicContact CD1-CG2 3.49Å; L486-V510 VanDerWaalsContact CD1-CG2 3.49Å; L486-V510 HydrophobicContact CD2-CG2 3.9Å; L486-V510 HydrophobicContact CG-CG2 4.34Å
487	R	84.8	Confident	83.7	Confident	77 Å²	77	56.5 Å²	56.5	29%	0.291	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144	172.2	-59.9	-174.7	-176.2	158.8	3.4	109.4	D454 P455 E500	D454-R487 IonicContact OD1-CZ 3.56Å; D454-R487 VanDerWaalsContact OD1-CZ 3.27Å; D454-R487 IonicContact OD1-NH1 3.71Å; D454-R487 PolarHBondContact OD1-NH1 2.88Å; D454-R487 IonicContact OD1-NH2 3.78Å; D454-R487 PolarHBondContact OD1-NH2 2.89Å; P455-R487 VanDerWaalsContact CD-CZ 3.43Å; P455-R487 HydrophobicContact CG-CG 4.17Å; R487-E500 HydrophobicContact CB-CB 4.14Å; R487-E500 HydrophobicContact CB-CG 4.35Å; R487-E500 WeakPolarHBondContact CB-OE2 3.48Å; R487-E500 WeakPolarHBondContact CD-OE2 3.33Å; R487-E500 PolarHBondContact N-O 2.84Å; R487-E500 VanDerWaalsContact N-O 3.12Å; R487-E500 PolarHBondContact O-N 3.17Å
488	I	90.2	Very high	83.7	Confident	54 Å²	54	50 Å²	50	28%	0.277	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.2	-177.3	-55.8	179.3	0	0	0	107.6	L476 V480 T497 V498 L499	L476-I488 HydrophobicContact CB-CD1 3.44Å; L476-I488 VanDerWaalsContact CB-CD1 3.44Å; L476-I488 HydrophobicContact CD1-CD1 4.04Å; L476-I488 HydrophobicContact CD1-CG2 4.31Å; L476-I488 HydrophobicContact CD2-CD1 3.67Å; L476-I488 HydrophobicContact CG-CD1 3.86Å; V480-I488 HydrophobicContact CG2-CB 4.29Å; V480-I488 HydrophobicContact CG2-CD1 3.28Å; V480-I488 HydrophobicContact CG2-CG1 3.53Å; I488-T497 HydrophobicContact CG2-CG2 3.76Å; I488-V498 WeakPolarHBondContact CA-O 3.38Å; I488-L499 HydrophobicContact CD1-CD1 3.89Å; I488-L499 HydrophobicContact CG1-CD1 3.68Å
489	Y	87.2	Confident	83.8	Confident	63 Å²	63	46.8 Å²	46.8	25%	0.247	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160	172.6	66.7	-88.3	0	0	0	109.1	D491 V498 E500	Y489-D491 HydrophobicContact CE2-CB 4.47Å; Y489-V498 HydrophobicContact CD1-CB 4.32Å; Y489-V498 HydrophobicContact CD2-CB 4.39Å; Y489-V498 HydrophobicContact CE1-CB 3.89Å; Y489-V498 HydrophobicContact CE1-CG1 3.77Å; Y489-V498 HydrophobicContact CE2-CB 3.96Å; Y489-V498 HydrophobicContact CE2-CG1 4.44Å; Y489-V498 HydrophobicContact CE2-CG2 4Å; Y489-V498 PolarHBondContact N-O 2.87Å; Y489-V498 PolarHBondContact O-N 2.81Å; Y489-E500 HydrophobicContact CD1-CG 4.43Å; Y489-E500 HydrophobicContact CE1-CG 3.92Å
490	I	85.8	Confident	83.8	Confident	95 Å²	95	47.5 Å²	47.5	49%	0.487	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.7	172.1	-61.8	170.4	0	0	0	105.8	E492 E496	I490-E492 PolarHBondContact O-N 2.91Å; I490-E496 WeakPolarHBondContact CA-O 3.46Å
491	D	79.9	Confident	83.5	Confident	23 Å²	23	45.4 Å²	45.4	12%	0.123	22%	0.223	C	C	.	.			trans	-68.5	124.7	175.1	-170.2	76.5	0	0	0	109.3	Y489 D493 S494 Q495 E496 V498	Y489-D491 HydrophobicContact CE2-CB 4.47Å; D491-D493 VanDerWaalsContact C-N 3.25Å; D491-D493 PolarHBondContact O-N 3.12Å; D491-D493 WeakPolarHBondContact OD2-CB 3.19Å; D491-D493 PolarHBondContact OD2-N 2.84Å; D491-S494 PolarHBondContact OD2-N 3.31Å; D491-S494 PolarHBondContact OD2-OG 3.34Å; D491-Q495 WeakPolarHBondContact O-CA 3.44Å; D491-Q495 PolarHBondContact O-N 2.89Å; D491-E496 PolarHBondContact N-O 3.21Å; D491-V498 HydrophobicContact CB-CG2 4.11Å
492	E	74.3	Confident	83	Confident	135 Å²	135	45.8 Å²	45.8	63%	0.631	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-28.5	-175.2	-67.9	-168.5	166.2	0	0	112	I490 Q495	I490-E492 PolarHBondContact O-N 2.91Å; E492-Q495 PolarHBondContact O-NE2 3.48Å
493	D	68.8	Low	82.5	Confident	122 Å²	122	45.2 Å²	45.2	65%	0.652	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-49.7	-176.4	-65	-44.1	0	0	0	111.5	D491 S612	D491-D493 VanDerWaalsContact C-N 3.25Å; D491-D493 PolarHBondContact O-N 3.12Å; D491-D493 WeakPolarHBondContact OD2-CB 3.19Å; D491-D493 PolarHBondContact OD2-N 2.84Å; D493-S612 PolarHBondContact OD2-OG 3.06Å
494	S	78.2	Confident	82.3	Confident	46 Å²	46	49.3 Å²	49.3	32%	0.322	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-17.7	-179.8	75.3	0	0	0	0	114	D491 E496	D491-S494 PolarHBondContact OD2-N 3.31Å; D491-S494 PolarHBondContact OD2-OG 3.34Å; S494-E496 WeakPolarHBondContact CB-OE2 3.45Å; S494-E496 PolarHBondContact O-N 3.23Å; S494-E496 VanDerWaalsContact OG-CB 3.25Å; S494-E496 WeakPolarHBondContact OG-CB 3.27Å; S494-E496 VanDerWaalsContact OG-CG 3.27Å; S494-E496 WeakPolarHBondContact OG-CG 3.22Å; S494-E496 PolarHBondContact OG-N 3.4Å; S494-E496 PolarHBondContact OG-OE2 2.79Å
495	Q	81.1	Confident	82.3	Confident	139 Å²	139	50 Å²	50	65%	0.65	25%	0.246	S	C	*	.			trans	59	16.9	-169.6	-61.4	-68.7	-56	0	0	113.5	D491 E492	D491-Q495 WeakPolarHBondContact O-CA 3.44Å; D491-Q495 PolarHBondContact O-N 2.89Å; E492-Q495 PolarHBondContact O-NE2 3.48Å
496	E	85.5	Confident	82.4	Confident	51 Å²	51	50.3 Å²	50.3	24%	0.238	25%	0.247	C	C	.	.			trans	-86.8	153.9	176.8	-60	166.9	155.5	0	0	110.5	V460 I490 D491 S494	V460-E496 HydrophobicContact CG1-CB 3.8Å; V460-E496 HydrophobicContact CG1-CG 4.29Å; I490-E496 WeakPolarHBondContact CA-O 3.46Å; D491-E496 PolarHBondContact N-O 3.21Å; S494-E496 WeakPolarHBondContact CB-OE2 3.45Å; S494-E496 PolarHBondContact O-N 3.23Å; S494-E496 VanDerWaalsContact OG-CB 3.25Å; S494-E496 WeakPolarHBondContact OG-CB 3.27Å; S494-E496 VanDerWaalsContact OG-CG 3.27Å; S494-E496 WeakPolarHBondContact OG-CG 3.22Å; S494-E496 PolarHBondContact OG-N 3.4Å; S494-E496 PolarHBondContact OG-OE2 2.79Å
497	T	89.7	Confident	82.4	Confident	9 Å²	9	50.2 Å²	50.2	6%	0.055	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.8	174.9	-55.2	0	0	0	0	109.4	V460 I461 Q469 L476 I488	V460-T497 WeakPolarHBondContact CA-O 3.3Å; I461-T497 HydrophobicContact CG2-CG2 3.77Å; I461-T497 PolarHBondContact N-O 3.24Å; Q469-T497 PolarHBondContact NE2-OG1 2.91Å; L476-T497 HydrophobicContact CD1-CG2 3.92Å; I488-T497 HydrophobicContact CG2-CG2 3.76Å
498	V	89.5	Confident	82.5	Confident	9 Å²	9	49.6 Å²	49.6	6%	0.055	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	128.7	178.7	-176.4	0	0	0	0	109.7	K458 I488 Y489 D491	K458-V498 HydrophobicContact CB-CG1 4.04Å; K458-V498 HydrophobicContact CD-CG1 4.46Å; I488-V498 WeakPolarHBondContact CA-O 3.38Å; Y489-V498 HydrophobicContact CD1-CB 4.32Å; Y489-V498 HydrophobicContact CD2-CB 4.39Å; Y489-V498 HydrophobicContact CE1-CB 3.89Å; Y489-V498 HydrophobicContact CE1-CG1 3.77Å; Y489-V498 HydrophobicContact CE2-CB 3.96Å; Y489-V498 HydrophobicContact CE2-CG1 4.44Å; Y489-V498 HydrophobicContact CE2-CG2 4Å; Y489-V498 PolarHBondContact N-O 2.87Å; Y489-V498 PolarHBondContact O-N 2.81Å; D491-V498 HydrophobicContact CB-CG2 4.11Å
499	L	91.1	Very high	82.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.3	174.7	177.5	67.2	0	0	0	109.4	K458 C459 I461 L486 I488 I507 V510	K458-L499 CarbonylContact C-O 3.52Å; K458-L499 VanDerWaalsContact CA-O 3.3Å; K458-L499 WeakPolarHBondContact CA-O 3.4Å; C459-L499 PolarHBondContact N-O 2.85Å; C459-L499 PolarHBondContact O-N 3.05Å; I461-L499 HydrophobicContact CD1-CD2 4.46Å; I461-L499 HydrophobicContact CG2-CB 4.03Å; L486-L499 HydrophobicContact CD2-CD1 4.24Å; I488-L499 HydrophobicContact CD1-CD1 3.89Å; I488-L499 HydrophobicContact CG1-CD1 3.68Å; L499-I507 HydrophobicContact CD2-CD1 3.84Å; L499-I507 HydrophobicContact CD2-CG2 4.44Å; L499-I507 HydrophobicContact CG-CD1 3.89Å; L499-V510 HydrophobicContact CD2-CB 4.35Å; L499-V510 HydrophobicContact CD2-CG1 3.76Å
500	E	87.6	Confident	82.4	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.075	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.9	173.3	-44.9	-174.8	131.7	0	0	111	P455 Y457 K458 L486 R487 Y489 N530	P455-E500 HydrophobicContact CB-CB 3.69Å; P455-E500 HydrophobicContact CG-CB 3.65Å; P455-E500 HydrophobicContact CG-CG 4.45Å; P455-E500 VanDerWaalsContact CG-OE2 3.27Å; P455-E500 WeakPolarHBondContact CG-OE2 3.42Å; Y457-E500 CarbonylContact O-C 3.58Å; Y457-E500 VanDerWaalsContact O-CA 3.24Å; Y457-E500 WeakPolarHBondContact O-CA 3.34Å; K458-E500 HydrophobicContact CB-CG 4.12Å; L486-E500 WeakPolarHBondContact CA-O 3.49Å; R487-E500 HydrophobicContact CB-CB 4.14Å; R487-E500 HydrophobicContact CB-CG 4.35Å; R487-E500 WeakPolarHBondContact CB-OE2 3.48Å; R487-E500 WeakPolarHBondContact CD-OE2 3.33Å; R487-E500 PolarHBondContact N-O 2.84Å; R487-E500 VanDerWaalsContact N-O 3.12Å; R487-E500 PolarHBondContact O-N 3.17Å; Y489-E500 HydrophobicContact CD1-CG 4.43Å; Y489-E500 HydrophobicContact CE1-CG 3.92Å; E500-N530 PolarHBondContact OE1-ND2 2.72Å
501	G	82.5	Confident	82.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	179.7	179.7	0	0	0	0	0	113.9	V456 Y457	V456-G501 PolarHBondContact N-O 3.41Å; V456-G501 VanDerWaalsContact N-O 3.08Å; Y457-G501 PolarHBondContact N-O 3.04Å; Y457-G501 VanDerWaalsContact N-O 3.08Å; Y457-G501 PolarHBondContact O-N 3.29Å
502	M	76	Confident	83.1	Confident	42 Å²	42	44.6 Å²	44.6	21%	0.207	22%	0.223	C	C	.	.	S	Bend	trans	-85.2	-19.8	-174.1	-70.2	-170.2	64	0	0	115.1	I128 P453 V456 H506	I128-M502 HydrophobicContact CD1-CE 4.4Å; I128-M502 HydrophobicContact CD1-SD 3.26Å; I128-M502 WeakPolarHBondContact CD1-SD 3.22Å; I128-M502 HydrophobicContact CG1-SD 3.89Å; P453-M502 HydrophobicContact CG-CE 3.81Å; P453-M502 HydrophobicContact CG-SD 4Å; V456-M502 WeakPolarHBondContact CG2-O 3.49Å; M502-H506 PolarHBondContact N-ND1 2.8Å
503	G	73.8	Confident	83.8	Confident	4 Å²	4	39.7 Å²	39.7	4%	0.041	20%	0.199	C	C	.	.			trans	-172.6	164.9	-171.4	0	0	0	0	0	111.9	H506 I507	G503-H506 WeakPolarHBondContact O-CB 3.25Å; G503-H506 PolarHBondContact O-N 2.83Å; G503-I507 PolarHBondContact O-N 3Å
504	E	76.8	Confident	84.9	Confident	116 Å²	116	33.9 Å²	33.9	54%	0.542	17%	0.168	S	C	.	.	H	α-helix	trans	-59.9	-49.1	178.8	-175.1	-179.6	-177.7	0	0	111.9	H506 I507 D508 L527	E504-H506 PolarHBondContact O-N 2.83Å; E504-I507 PolarHBondContact O-N 3.29Å; E504-I507 VanDerWaalsContact O-N 3.15Å; E504-D508 PolarHBondContact O-N 3.29Å; E504-L527 HydrophobicContact CB-CD2 3.97Å; E504-L527 HydrophobicContact CG-CD2 4.25Å
505	L	79.9	Confident	85.5	Confident	40 Å²	40	35.4 Å²	35.4	21%	0.209	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-35.6	178.1	-171.2	71.2	0	0	0	112.3	D125 F126 D508 I509	D125-L505 HydrophobicContact CB-CD2 4.46Å; D125-L505 WeakPolarHBondContact OD2-CB 3.16Å; D125-L505 VanDerWaalsContact OD2-CD2 3.27Å; D125-L505 WeakPolarHBondContact OD2-CD2 3.37Å; F126-L505 HydrophobicContact CE2-CD2 4.32Å; F126-L505 HydrophobicContact CZ-CD2 4.22Å; L505-D508 PolarHBondContact O-N 3.24Å; L505-I509 HydrophobicContact CG-CD1 4.19Å; L505-I509 WeakPolarHBondContact O-CD1 3.48Å; L505-I509 WeakPolarHBondContact O-CG1 3.07Å; L505-I509 PolarHBondContact O-N 3.2Å
506	H	81.5	Confident	85.7	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-65.2	-48.6	179.1	-176.1	-170.1	0	0	0	110.3	D483 S485 L486 M502 G503 E504 D508 I509 V510	D483-H506 IonicContact OD2-CE1 2.94Å; D483-H506 PolarHBondContact OD2-CE1 3.03Å; D483-H506 VanDerWaalsContact OD2-CE1 3.29Å; D483-H506 IonicContact OD2-NE2 3.52Å; D483-H506 PolarHBondContact OD2-NE2 3.41Å; S485-H506 PolarHBondContact OG-CE1 2.86Å; S485-H506 VanDerWaalsContact OG-CE1 3.28Å; L486-H506 WeakPolarHBondContact CD2-CE1 3.43Å; L486-H506 WeakPolarHBondContact CD2-NE2 3.18Å; M502-H506 PolarHBondContact N-ND1 2.8Å; G503-H506 WeakPolarHBondContact O-CB 3.25Å; G503-H506 PolarHBondContact O-N 2.83Å; E504-H506 PolarHBondContact O-N 2.83Å; H506-D508 VanDerWaalsContact C-N 3.34Å; H506-D508 PolarHBondContact O-N 2.89Å; H506-I509 PolarHBondContact O-N 3.02Å; H506-V510 WeakPolarHBondContact O-CG2 3.43Å; H506-V510 PolarHBondContact O-N 3.06Å; H506-V510 VanDerWaalsContact O-N 3.14Å
507	I	86.9	Confident	85.7	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-40.6	176	-63.1	-62	0	0	0	111.6	L499 G503 E504 I509 V510 K511 L524 L527	L499-I507 HydrophobicContact CD2-CD1 3.84Å; L499-I507 HydrophobicContact CD2-CG2 4.44Å; L499-I507 HydrophobicContact CG-CD1 3.89Å; G503-I507 PolarHBondContact O-N 3Å; E504-I507 PolarHBondContact O-N 3.29Å; E504-I507 VanDerWaalsContact O-N 3.15Å; I507-I509 VanDerWaalsContact C-N 3.32Å; I507-I509 PolarHBondContact O-N 3.41Å; I507-V510 WeakPolarHBondContact O-CB 3.39Å; I507-V510 PolarHBondContact O-N 3.02Å; I507-K511 PolarHBondContact O-N 2.93Å; I507-L524 HydrophobicContact CG2-CD1 3.57Å; I507-L527 HydrophobicContact CG1-CD1 4.22Å
508	D	86.5	Confident	85.7	Confident	65 Å²	65	37.5 Å²	37.5	35%	0.348	18%	0.175	S	C	.	.	H	α-helix	trans	-62.3	-37.4	177.5	-82.7	-16.6	0	0	0	113.1	E504 L505 H506 K511 D512	E504-D508 PolarHBondContact O-N 3.29Å; L505-D508 PolarHBondContact O-N 3.24Å; H506-D508 VanDerWaalsContact C-N 3.34Å; H506-D508 PolarHBondContact O-N 2.89Å; D508-K511 PolarHBondContact O-N 3.09Å; D508-D512 PolarHBondContact O-N 3.44Å
509	I	86.4	Confident	85.5	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.036	20%	0.201	C	C	.	.	H	α-helix	trans	-68.1	-40.7	175.5	-72.5	164.1	0	0	0	110.5	I101 F126 L505 H506 I507 K511 D512 R513	I101-I509 HydrophobicContact CD1-CD1 3.92Å; I101-I509 HydrophobicContact CD1-CG1 4.36Å; I101-I509 HydrophobicContact CG1-CD1 4.23Å; I101-I509 HydrophobicContact CG2-CD1 4.17Å; I101-I509 HydrophobicContact CG2-CG2 4.29Å; F126-I509 HydrophobicContact CE1-CD1 3.68Å; F126-I509 HydrophobicContact CE2-CD1 4.15Å; F126-I509 HydrophobicContact CZ-CD1 3.14Å; L505-I509 HydrophobicContact CG-CD1 4.19Å; L505-I509 WeakPolarHBondContact O-CD1 3.48Å; L505-I509 WeakPolarHBondContact O-CG1 3.07Å; L505-I509 PolarHBondContact O-N 3.2Å; H506-I509 PolarHBondContact O-N 3.02Å; I507-I509 VanDerWaalsContact C-N 3.32Å; I507-I509 PolarHBondContact O-N 3.41Å; I509-K511 VanDerWaalsContact C-N 3.3Å; I509-K511 PolarHBondContact O-N 2.64Å; I509-D512 PolarHBondContact O-N 3.19Å; I509-R513 HydrophobicContact CG2-CG 4.07Å; I509-R513 WeakPolarHBondContact O-CB 3.25Å; I509-R513 VanDerWaalsContact O-CG 3.25Å; I509-R513 WeakPolarHBondContact O-CG 3.26Å; I509-R513 PolarHBondContact O-N 3.21Å
510	V	89.7	Confident	85.5	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.03	20%	0.203	C	C	.	.	H	α-helix	trans	-57.4	-46.3	175.2	171.2	0	0	0	0	110.8	L479 L486 L499 H506 I507 D512 R513 L514	L479-V510 HydrophobicContact CD1-CG1 4.12Å; L486-V510 HydrophobicContact CD1-CG2 3.49Å; L486-V510 VanDerWaalsContact CD1-CG2 3.49Å; L486-V510 HydrophobicContact CD2-CG2 3.9Å; L486-V510 HydrophobicContact CG-CG2 4.34Å; L499-V510 HydrophobicContact CD2-CB 4.35Å; L499-V510 HydrophobicContact CD2-CG1 3.76Å; H506-V510 WeakPolarHBondContact O-CG2 3.43Å; H506-V510 PolarHBondContact O-N 3.06Å; H506-V510 VanDerWaalsContact O-N 3.14Å; I507-V510 WeakPolarHBondContact O-CB 3.39Å; I507-V510 PolarHBondContact O-N 3.02Å; V510-D512 PolarHBondContact O-N 3.16Å; V510-R513 PolarHBondContact O-N 3.2Å; V510-L514 HydrophobicContact CG1-CD1 4.13Å; V510-L514 WeakPolarHBondContact O-CG 3.25Å; V510-L514 PolarHBondContact O-N 3Å
511	K	90.8	Very high	85.6	Confident	89 Å²	89	45.7 Å²	45.7	39%	0.387	23%	0.228	S	C	.	.	H	α-helix	trans	-57.9	-49	175.1	-179.8	-175.7	-175	177.7	0	112.4	I507 D508 I509 R513 L514 L515 V522 L524	I507-K511 PolarHBondContact O-N 2.93Å; D508-K511 PolarHBondContact O-N 3.09Å; I509-K511 VanDerWaalsContact C-N 3.3Å; I509-K511 PolarHBondContact O-N 2.64Å; K511-R513 VanDerWaalsContact C-N 3.35Å; K511-L514 PolarHBondContact O-N 2.96Å; K511-L515 PolarHBondContact O-N 2.79Å; K511-L515 VanDerWaalsContact O-N 3.09Å; K511-V522 HydrophobicContact CB-CG2 4.47Å; K511-V522 HydrophobicContact CG-CG2 3.86Å; K511-L524 HydrophobicContact CB-CD1 3.89Å; K511-L524 HydrophobicContact CB-CG 4.39Å; K511-L524 HydrophobicContact CD-CD1 3.81Å; K511-L524 HydrophobicContact CD-CG 4.01Å; K511-L524 HydrophobicContact CG-CD1 4.25Å; K511-L524 HydrophobicContact CG-CG 4.37Å
512	D	88.6	Confident	86.1	Confident	28 Å²	28	46.2 Å²	46.2	15%	0.15	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-37.4	-178.6	-177.5	89.9	0	0	0	111.9	Q93 D508 I509 V510 L515 R516	Q93-D512 WeakPolarHBondContact CG-OD2 3.33Å; Q93-D512 PolarHBondContact NE2-OD2 3.3Å; D508-D512 PolarHBondContact O-N 3.44Å; I509-D512 PolarHBondContact O-N 3.19Å; V510-D512 PolarHBondContact O-N 3.16Å; D512-L515 PolarHBondContact O-N 2.9Å; D512-R516 WeakPolarHBondContact O-CG 3.2Å; D512-R516 PolarHBondContact O-N 3.12Å; D512-R516 IonicContact OD1-CZ 3.97Å; D512-R516 IonicContact OD1-NE 3.61Å; D512-R516 PolarHBondContact OD1-NE 2.93Å; D512-R516 IonicContact OD1-NH2 2.84Å; D512-R516 PolarHBondContact OD1-NH2 3.39Å; D512-R516 VanDerWaalsContact OD2-CD 3.27Å; D512-R516 WeakPolarHBondContact OD2-CD 3.44Å; D512-R516 IonicContact OD2-CZ 2.84Å; D512-R516 IonicContact OD2-NE 3.41Å; D512-R516 PolarHBondContact OD2-NE 3.48Å; D512-R516 IonicContact OD2-NH2 3.06Å
513	R	88.9	Confident	86.8	Confident	33 Å²	33	50.7 Å²	50.7	13%	0.125	25%	0.25	C	C	.	.	H	α-helix	trans	-62.4	-44.9	173.1	-72.1	-173.9	70.5	-163.5	-7.4	111.9	L479 E482 I509 V510 K511 L515 R516 E517	L479-R513 VanDerWaalsContact CD2-NH1 3.33Å; E482-R513 IonicContact OE1-NH2 3.95Å; E482-R513 IonicContact OE2-CZ 2.92Å; E482-R513 IonicContact OE2-NH1 3.91Å; E482-R513 PolarHBondContact OE2-NH1 3.29Å; E482-R513 IonicContact OE2-NH2 3.66Å; E482-R513 PolarHBondContact OE2-NH2 3.22Å; I509-R513 HydrophobicContact CG2-CG 4.07Å; I509-R513 WeakPolarHBondContact O-CB 3.25Å; I509-R513 VanDerWaalsContact O-CG 3.25Å; I509-R513 WeakPolarHBondContact O-CG 3.26Å; I509-R513 PolarHBondContact O-N 3.21Å; V510-R513 PolarHBondContact O-N 3.2Å; K511-R513 VanDerWaalsContact C-N 3.35Å; R513-L515 VanDerWaalsContact C-N 3.26Å; R513-L515 PolarHBondContact O-N 2.95Å; R513-R516 PolarHBondContact O-N 3.07Å; R513-E517 WeakPolarHBondContact CG-OE1 3.21Å; R513-E517 IonicContact CZ-OE1 2.68Å; R513-E517 IonicContact CZ-OE2 3.34Å; R513-E517 IonicContact NE-OE1 3.58Å; R513-E517 PolarHBondContact NE-OE1 2.81Å; R513-E517 IonicContact NE-OE2 3.5Å; R513-E517 PolarHBondContact NE-OE2 2.76Å; R513-E517 IonicContact NH2-OE1 2.7Å; R513-E517 IonicContact NH2-OE2 3.38Å; R513-E517 PolarHBondContact NH2-OE2 3.16Å; R513-E517 VanDerWaalsContact O-CB 3.29Å; R513-E517 WeakPolarHBondContact O-CB 3.49Å; R513-E517 PolarHBondContact O-N 3.14Å
514	L	91.6	Very high	87.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57	-41.9	174.6	-72.9	168.4	0	0	0	111.5	I461 L472 A475 L476 L479 V510 K511 Y518 G519 L520 V522	I461-L514 HydrophobicContact CD1-CD1 3.51Å; L472-L514 HydrophobicContact CD1-CD1 4.09Å; L472-L514 HydrophobicContact CD1-CD2 4.21Å; A475-L514 HydrophobicContact CB-CD2 3.6Å; L476-L514 HydrophobicContact CD2-CD1 4Å; L476-L514 HydrophobicContact CD2-CD2 4.38Å; L479-L514 HydrophobicContact CD1-CD2 3.71Å; L479-L514 HydrophobicContact CD1-CG 3.91Å; V510-L514 HydrophobicContact CG1-CD1 4.13Å; V510-L514 WeakPolarHBondContact O-CG 3.25Å; V510-L514 PolarHBondContact O-N 3Å; K511-L514 PolarHBondContact O-N 2.96Å; L514-Y518 HydrophobicContact CD2-CD2 4.3Å; L514-Y518 CarbonylContact O-C 3.54Å; L514-Y518 WeakPolarHBondContact O-CB 3.32Å; L514-Y518 PolarHBondContact O-N 3.25Å; L514-G519 PolarHBondContact O-N 2.95Å; L514-L520 CarbonylContact C-O 3.53Å; L514-L520 PolarHBondContact O-N 3.23Å; L514-V522 HydrophobicContact CB-CG1 4.48Å; L514-V522 HydrophobicContact CB-CG2 4.48Å; L514-V522 HydrophobicContact CD1-CG1 4.18Å; L514-V522 HydrophobicContact CD1-CG2 4.09Å
515	L	90.7	Very high	88	Confident	78 Å²	78	48.5 Å²	48.5	41%	0.408	25%	0.248	S	C	.	.	H	α-helix	trans	-66.7	-49.8	177.1	-177.9	58.1	0	0	0	112.5	K511 D512 R513 G519 L520 E521	K511-L515 PolarHBondContact O-N 2.79Å; K511-L515 VanDerWaalsContact O-N 3.09Å; D512-L515 PolarHBondContact O-N 2.9Å; R513-L515 VanDerWaalsContact C-N 3.26Å; R513-L515 PolarHBondContact O-N 2.95Å; L515-G519 WeakPolarHBondContact O-CA 3.25Å; L515-G519 PolarHBondContact O-N 3.35Å; L515-G519 VanDerWaalsContact O-N 3.12Å; L515-L520 VanDerWaalsContact CA-O 3.32Å; L515-L520 WeakPolarHBondContact CA-O 3.4Å; L515-L520 PolarHBondContact N-O 3.27Å; L515-E521 HydrophobicContact CD1-CB 4.4Å; L515-E521 HydrophobicContact CD1-CG 3.41Å; L515-E521 VanDerWaalsContact CD1-CG 3.41Å
516	R	86.2	Confident	88.2	Confident	98 Å²	98	50.8 Å²	50.8	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-84.6	-42.6	-169.9	-64.2	-173.8	-164.7	-145.1	5.4	114.3	E96 D512 R513	E96-R516 IonicContact OE1-CZ 3.21Å; E96-R516 IonicContact OE1-NH1 3.05Å; E96-R516 PolarHBondContact OE1-NH1 3.15Å; E96-R516 IonicContact OE1-NH2 2.99Å; E96-R516 PolarHBondContact OE1-NH2 2.89Å; E96-R516 IonicContact OE2-CZ 2.74Å; E96-R516 IonicContact OE2-NH1 3.66Å; E96-R516 PolarHBondContact OE2-NH1 2.94Å; E96-R516 IonicContact OE2-NH2 3.13Å; E96-R516 PolarHBondContact OE2-NH2 2.92Å; D512-R516 WeakPolarHBondContact O-CG 3.2Å; D512-R516 PolarHBondContact O-N 3.12Å; D512-R516 IonicContact OD1-CZ 3.97Å; D512-R516 IonicContact OD1-NE 3.61Å; D512-R516 PolarHBondContact OD1-NE 2.93Å; D512-R516 IonicContact OD1-NH2 2.84Å; D512-R516 PolarHBondContact OD1-NH2 3.39Å; D512-R516 VanDerWaalsContact OD2-CD 3.27Å; D512-R516 WeakPolarHBondContact OD2-CD 3.44Å; D512-R516 IonicContact OD2-CZ 2.84Å; D512-R516 IonicContact OD2-NE 3.41Å; D512-R516 PolarHBondContact OD2-NE 3.48Å; D512-R516 IonicContact OD2-NH2 3.06Å; R513-R516 PolarHBondContact O-N 3.07Å
517	E	86	Confident	88.3	Confident	80 Å²	80	53.5 Å²	53.5	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-82.6	-40.6	-176.2	-63.3	172.8	-157.9	0	0	111	R513	R513-E517 WeakPolarHBondContact CG-OE1 3.21Å; R513-E517 IonicContact CZ-OE1 2.68Å; R513-E517 IonicContact CZ-OE2 3.34Å; R513-E517 IonicContact NE-OE1 3.58Å; R513-E517 PolarHBondContact NE-OE1 2.81Å; R513-E517 IonicContact NE-OE2 3.5Å; R513-E517 PolarHBondContact NE-OE2 2.76Å; R513-E517 IonicContact NH2-OE1 2.7Å; R513-E517 IonicContact NH2-OE2 3.38Å; R513-E517 PolarHBondContact NH2-OE2 3.16Å; R513-E517 VanDerWaalsContact O-CB 3.29Å; R513-E517 WeakPolarHBondContact O-CB 3.49Å; R513-E517 PolarHBondContact O-N 3.14Å
518	Y	87.7	Confident	88	Confident	64 Å²	64	54.9 Å²	54.9	25%	0.251	29%	0.286	S	S	.	.	H	α-helix	trans	-102.4	-12.3	-175	-62.4	-88.5	0	0	0	113.8	A475 E478 L479 L514 L520	A475-Y518 HydrophobicContact CB-CD1 3.49Å; A475-Y518 VanDerWaalsContact CB-CD1 3.49Å; A475-Y518 HydrophobicContact CB-CD2 4.03Å; A475-Y518 HydrophobicContact CB-CE1 3.66Å; A475-Y518 HydrophobicContact CB-CE2 4.19Å; A475-Y518 HydrophobicContact CB-CG 3.67Å; E478-Y518 WeakPolarHBondContact CB-OH 3.19Å; E478-Y518 WeakPolarHBondContact OE2-CE1 3.46Å; E478-Y518 PolarHBondContact OE2-OH 2.9Å; L479-Y518 HydrophobicContact CD2-CE2 4.39Å; L479-Y518 HydrophobicContact CG-CE2 4.4Å; L514-Y518 HydrophobicContact CD2-CD2 4.3Å; L514-Y518 CarbonylContact O-C 3.54Å; L514-Y518 WeakPolarHBondContact O-CB 3.32Å; L514-Y518 PolarHBondContact O-N 3.25Å; Y518-L520 VanDerWaalsContact C-N 3.25Å; Y518-L520 PolarHBondContact O-N 3.04Å
519	G	87.1	Confident	87.9	Confident	58 Å²	58	53 Å²	53	60%	0.598	28%	0.275	S	S	*	.			trans	68.3	26	-175.7	0	0	0	0	0	112.8	L514 L515	L514-G519 PolarHBondContact O-N 2.95Å; L515-G519 WeakPolarHBondContact O-CA 3.25Å; L515-G519 PolarHBondContact O-N 3.35Å; L515-G519 VanDerWaalsContact O-N 3.12Å
520	L	89.8	Confident	87.6	Confident	9 Å²	9	53 Å²	53	5%	0.047	28%	0.276	C	S	.	.			trans	-105.9	108.5	-175.5	-66.1	175.1	0	0	0	110.3	Y468 K471 A475 L514 L515 Y518 V522	Y468-L520 HydrophobicContact CD1-CD2 3.98Å; Y468-L520 HydrophobicContact CG-CD2 4.26Å; K471-L520 HydrophobicContact CB-CD1 4.13Å; K471-L520 HydrophobicContact CB-CD2 3.93Å; K471-L520 HydrophobicContact CD-CD2 4.39Å; A475-L520 HydrophobicContact CB-CD1 3.99Å; L514-L520 CarbonylContact C-O 3.53Å; L514-L520 PolarHBondContact O-N 3.23Å; L515-L520 VanDerWaalsContact CA-O 3.32Å; L515-L520 WeakPolarHBondContact CA-O 3.4Å; L515-L520 PolarHBondContact N-O 3.27Å; Y518-L520 VanDerWaalsContact C-N 3.25Å; Y518-L520 PolarHBondContact O-N 3.04Å; L520-V522 HydrophobicContact CB-CG1 4.43Å; L520-V522 PolarHBondContact O-N 2.88Å
521	E	90.7	Very high	87.5	Confident	131 Å²	131	53.7 Å²	53.7	61%	0.612	28%	0.278	S	S	*	.			trans	-74.1	122	166.4	-73.9	178.8	-176.7	0	0	109.6	S464 L515	S464-E521 WeakPolarHBondContact CB-O 3.42Å; S464-E521 PolarHBondContact N-O 3.36Å; S464-E521 PolarHBondContact OG-O 3.05Å; L515-E521 HydrophobicContact CD1-CB 4.4Å; L515-E521 HydrophobicContact CD1-CG 3.41Å; L515-E521 VanDerWaalsContact CD1-CG 3.41Å
522	V	92.1	Very high	87.4	Confident	11 Å²	11	49.7 Å²	49.7	7%	0.067	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143	-179	-59.2	0	0	0	0	111.2	I461 E462 L472 K511 L514 L520	I461-V522 HydrophobicContact CD1-CB 4.22Å; I461-V522 HydrophobicContact CD1-CG1 4.37Å; I461-V522 HydrophobicContact CD1-CG2 4.05Å; I461-V522 HydrophobicContact CG1-CB 4.06Å; I461-V522 HydrophobicContact CG1-CG1 4.44Å; I461-V522 HydrophobicContact CG1-CG2 4.32Å; E462-V522 CarbonylContact O-C 3.6Å; E462-V522 VanDerWaalsContact O-CA 3.24Å; E462-V522 WeakPolarHBondContact O-CA 3.32Å; E462-V522 WeakPolarHBondContact O-CB 3.03Å; L472-V522 HydrophobicContact CD1-CG1 3.73Å; K511-V522 HydrophobicContact CB-CG2 4.47Å; K511-V522 HydrophobicContact CG-CG2 3.86Å; L514-V522 HydrophobicContact CB-CG1 4.48Å; L514-V522 HydrophobicContact CB-CG2 4.48Å; L514-V522 HydrophobicContact CD1-CG1 4.18Å; L514-V522 HydrophobicContact CD1-CG2 4.09Å; L520-V522 HydrophobicContact CB-CG1 4.43Å; L520-V522 PolarHBondContact O-N 2.88Å
523	F	91.1	Very high	87.6	Confident	136 Å²	136	48.4 Å²	48.4	60%	0.596	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.5	168.5	-65.7	-70.5	0	0	0	108.7	I461 E462	I461-F523 WeakPolarHBondContact CA-O 3.15Å; E462-F523 PolarHBondContact N-O 3.03Å; E462-F523 PolarHBondContact O-N 3.35Å
524	L	90	Very high	87.7	Confident	45 Å²	45	47.3 Å²	47.3	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.2	170.2	-65.1	-173.8	0	0	0	108.3	V460 I461 I507 K511	V460-L524 CarbonylContact O-C 3.51Å; V460-L524 WeakPolarHBondContact O-CA 3.34Å; I461-L524 HydrophobicContact CB-CD2 3.9Å; I461-L524 HydrophobicContact CD1-CD2 3.86Å; I461-L524 HydrophobicContact CG1-CD2 3.77Å; I507-L524 HydrophobicContact CG2-CD1 3.57Å; K511-L524 HydrophobicContact CB-CD1 3.89Å; K511-L524 HydrophobicContact CB-CG 4.39Å; K511-L524 HydrophobicContact CD-CD1 3.81Å; K511-L524 HydrophobicContact CD-CG 4.01Å; K511-L524 HydrophobicContact CG-CD1 4.25Å; K511-L524 HydrophobicContact CG-CG 4.37Å
525	G	85.7	Confident	87.7	Confident	29 Å²	29	47.4 Å²	47.4	30%	0.299	25%	0.251	S	S	.	.			trans	-67	175.6	168.4	0	0	0	0	0	112	V460 L527	V460-G525 PolarHBondContact O-N 3.47Å; G525-L527 PolarHBondContact O-N 3.47Å
526	P	84.2	Confident	87.8	Confident	89 Å²	89	46.6 Å²	46.6	58%	0.578	25%	0.25	S	C	*	.			trans	-59.3	140.3	177.7	26.2	-34	0	0	0	111	Q528	P526-Q528 PolarHBondContact O-N 3.11Å
527	L	82.8	Confident	88.1	Confident	65 Å²	65	47.7 Å²	47.7	34%	0.34	26%	0.257	S	S	.	.			trans	-68.8	121.7	175.5	-164.9	70.2	0	0	0	109.5	Y457 C459 E504 I507 G525	Y457-L527 HydrophobicContact CD1-CD1 4.27Å; Y457-L527 HydrophobicContact CD1-CD2 3.52Å; Y457-L527 HydrophobicContact CD1-CG 3.62Å; Y457-L527 HydrophobicContact CE1-CD2 3.85Å; Y457-L527 HydrophobicContact CE1-CG 4.34Å; Y457-L527 HydrophobicContact CG-CD1 4.21Å; Y457-L527 HydrophobicContact CG-CD2 3.88Å; Y457-L527 HydrophobicContact CG-CG 4.04Å; C459-L527 HydrophobicContact CB-CD1 4.29Å; E504-L527 HydrophobicContact CB-CD2 3.97Å; E504-L527 HydrophobicContact CG-CD2 4.25Å; I507-L527 HydrophobicContact CG1-CD1 4.22Å; G525-L527 PolarHBondContact O-N 3.47Å
528	Q	82.1	Confident	88.4	Confident	32 Å²	32	47.8 Å²	47.8	15%	0.15	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	156.7	-177.7	-71.3	179.2	-4	0	0	110.7	Y457 K458 P526 Y746	Y457-Q528 WeakPolarHBondContact CA-O 2.98Å; K458-Q528 HydrophobicContact CG-CB 3.96Å; K458-Q528 PolarHBondContact N-O 3.37Å; K458-Q528 PolarHBondContact O-N 3.03Å; P526-Q528 PolarHBondContact O-N 3.11Å; Q528-Y746 HydrophobicContact CB-CE1 4.42Å; Q528-Y746 HydrophobicContact CG-CE1 4.29Å
529	I	82.8	Confident	88.7	Confident	25 Å²	25	46 Å²	46	13%	0.128	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	142	175.7	-68.7	167.3	0	0	0	109.5	Y531 P658 L704 Y746	I529-Y531 HydrophobicContact CB-CD2 4.32Å; I529-Y531 HydrophobicContact CB-CE2 3.78Å; I529-Y531 HydrophobicContact CG2-CD2 4.27Å; I529-Y531 HydrophobicContact CG2-CE1 4.28Å; I529-Y531 HydrophobicContact CG2-CE2 3.97Å; I529-Y531 WeakPolarHBondContact O-CD2 3.43Å; I529-Y531 PolarHBondContact O-N 3.21Å; I529-P658 HydrophobicContact CG2-CG 3.58Å; I529-L704 HydrophobicContact CD1-CG 4.46Å; I529-L704 HydrophobicContact CG1-CD2 4.36Å; I529-L704 HydrophobicContact CG1-CG 4.48Å; I529-L704 HydrophobicContact CG2-CD2 4.23Å; I529-Y746 PolarHBondContact O-OH 2.9Å
530	N	81.9	Confident	89	Confident	9 Å²	9	48.7 Å²	48.7	5%	0.048	26%	0.256	C	S	.	.			trans	-80.8	94.1	174.3	-156.8	1.4	0	0	0	110.5	P455 V456 E500	P455-N530 PolarHBondContact O-ND2 3.07Å; V456-N530 PolarHBondContact O-N 3.01Å; V456-N530 VanDerWaalsContact O-N 3.15Å; E500-N530 PolarHBondContact OE1-ND2 2.72Å
531	Y	86.9	Confident	89.2	Confident	18 Å²	18	49.9 Å²	49.9	7%	0.071	26%	0.261	C	S	.	.			trans	-81.3	156.7	172.4	-65.3	-82.4	0	0	0	111	I529 A613 L656 E657 L734 V742 Y746	I529-Y531 HydrophobicContact CB-CD2 4.32Å; I529-Y531 HydrophobicContact CB-CE2 3.78Å; I529-Y531 HydrophobicContact CG2-CD2 4.27Å; I529-Y531 HydrophobicContact CG2-CE1 4.28Å; I529-Y531 HydrophobicContact CG2-CE2 3.97Å; I529-Y531 WeakPolarHBondContact O-CD2 3.43Å; I529-Y531 PolarHBondContact O-N 3.21Å; Y531-A613 WeakPolarHBondContact O-CB 3.37Å; Y531-L656 WeakPolarHBondContact CA-O 3.31Å; Y531-E657 HydrophobicContact CD1-CB 3.99Å; Y531-E657 HydrophobicContact CE1-CB 3.79Å; Y531-L734 HydrophobicContact CD1-CD1 4.04Å; Y531-L734 HydrophobicContact CE1-CD1 3.89Å; Y531-V742 HydrophobicContact CD2-CG1 4.13Å; Y531-V742 HydrophobicContact CE1-CG1 4.37Å; Y531-V742 HydrophobicContact CE1-CG2 4.48Å; Y531-V742 HydrophobicContact CE2-CG1 3.73Å; Y531-Y746 HydrophobicContact CD2-CE2 4.03Å; Y531-Y746 WeakPolarHBondContact CD2-OH 3.37Å; Y531-Y746 AromaticContact CE2-CE2 3.75Å; Y531-Y746 HydrophobicContact CE2-CE2 3.75Å; Y531-Y746 WeakPolarHBondContact CE2-OH 3.28Å
532	H	88.7	Confident	89.4	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.028	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	172.9	170.6	-72	-16.3	0	0	0	110.5	R614 Q616 L655 L656 Y731	H532-R614 CarbonylContact C-O 3.53Å; H532-R614 WeakPolarHBondContact CA-O 3.46Å; H532-R614 VanDerWaalsContact CB-O 3.31Å; H532-R614 WeakPolarHBondContact CB-O 3.21Å; H532-Q616 HydrophobicContact CB-CG 4.41Å; H532-Q616 PolarHBondContact CD2-NE2 3.34Å; H532-Q616 PolarHBondContact CD2-OE1 3.05Å; H532-Q616 PolarHBondContact NE2-NE2 2.91Å; H532-Q616 VanDerWaalsContact NE2-NE2 3.14Å; H532-L655 CarbonylContact O-C 3.58Å; H532-L655 WeakPolarHBondContact O-CA 3.32Å; H532-L656 HydrophobicContact CB-CB 3.86Å; H532-L656 HydrophobicContact CB-CD1 4.05Å; H532-L656 PolarHBondContact N-O 3.21Å; H532-L656 PolarHBondContact O-N 3.48Å; H532-Y731 HydrophobicContact CB-CD1 4.22Å; H532-Y731 HydrophobicContact CB-CE1 4.29Å; H532-Y731 AromaticContact CD2-CD1 3.81Å; H532-Y731 AromaticContact CD2-CD2 3.55Å; H532-Y731 AromaticContact CD2-CE1 3.44Å; H532-Y731 VanDerWaalsContact CD2-CE1 3.44Å; H532-Y731 WeakPolarHBondContact CD2-CE1 3.23Å; H532-Y731 AromaticContact CD2-CE2 3.18Å; H532-Y731 WeakPolarHBondContact CD2-CE2 3.37Å; H532-Y731 AromaticContact CD2-CG 3.88Å; H532-Y731 AromaticContact CD2-CZ 3.13Å; H532-Y731 AromaticContact CG-CE1 3.85Å; H532-Y731 AromaticContact CG-CZ 3.94Å; H532-Y731 AromaticContact NE2-CE1 3.96Å; H532-Y731 AromaticContact NE2-CE2 3.38Å; H532-Y731 WeakPolarHBondContact NE2-CE2 3.26Å; H532-Y731 AromaticContact NE2-CZ 3.24Å; H532-Y731 PolarHBondContact NE2-OH 3.47Å
533	E	91.7	Very high	89.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.4	179.9	-72.5	-177.8	-140.1	0	0	110.9	G608 P609 L610 L611 A613 R614 V615 Q616 I654 L655	E533-G608 WeakPolarHBondContact OE2-CA 3.4Å; E533-P609 WeakPolarHBondContact OE2-CD 3.35Å; E533-L610 HydrophobicContact CG-CB 4.27Å; E533-L610 HydrophobicContact CG-CD1 4.43Å; E533-L610 PolarHBondContact OE1-N 3.27Å; E533-L610 VanDerWaalsContact OE1-N 3.14Å; E533-L610 WeakPolarHBondContact OE2-CB 3.48Å; E533-L610 PolarHBondContact OE2-N 3.03Å; E533-L611 PolarHBondContact OE1-N 3.03Å; E533-A613 HydrophobicContact CG-CB 4.03Å; E533-A613 PolarHBondContact OE1-N 3.37Å; E533-R614 PolarHBondContact N-O 2.83Å; E533-V615 HydrophobicContact CB-CG2 4.29Å; E533-V615 CarbonylContact O-C 3.56Å; E533-V615 VanDerWaalsContact O-CA 3.28Å; E533-V615 WeakPolarHBondContact O-CA 3.45Å; E533-Q616 PolarHBondContact O-N 3.44Å; E533-I654 WeakPolarHBondContact CA-O 3.43Å; E533-L655 HydrophobicContact CG-CD2 3.82Å
534	T	92	Very high	89.6	Confident	11 Å²	11	47.9 Å²	47.9	7%	0.067	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	160.4	172.1	-167.1	0	0	0	0	111.4	Q616 D617 P653 I654 L656	T534-Q616 VanDerWaalsContact CB-O 3.28Å; T534-Q616 WeakPolarHBondContact CB-O 3.12Å; T534-Q616 PolarHBondContact OG1-O 3.42Å; T534-D617 PolarHBondContact OG1-O 3.49Å; T534-P653 CarbonylContact O-C 3.5Å; T534-P653 WeakPolarHBondContact O-CA 3.35Å; T534-I654 HydrophobicContact CG2-CD1 4.09Å; T534-I654 HydrophobicContact CG2-CG1 3.59Å; T534-I654 PolarHBondContact N-O 3.4Å; T534-I654 PolarHBondContact O-N 2.9Å; T534-L656 HydrophobicContact CG2-CD1 4.3Å; T534-L656 HydrophobicContact CG2-CD2 3.71Å; T534-L656 HydrophobicContact CG2-CG 3.85Å
535	A	92.1	Very high	89.6	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.008	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	141.1	175.8	0	0	0	0	0	110.7	P564 V618 I648 A651	A535-P564 VanDerWaalsContact O-CB 3.26Å; A535-P564 WeakPolarHBondContact O-CB 3.05Å; A535-V618 HydrophobicContact CB-CG1 3.82Å; A535-I648 HydrophobicContact CB-CD1 4.14Å; A535-A651 HydrophobicContact CB-CB 3.7Å
536	T	91.3	Very high	89.8	Confident	61 Å²	61	52.9 Å²	52.9	37%	0.374	27%	0.266	S	S	.	.	S	Bend	trans	-99.3	-20.9	176.7	59.2	0	0	0	0	113.7	A651 S652 I654	T536-A651 PolarHBondContact N-O 3.07Å; T536-A651 VanDerWaalsContact N-O 3.07Å; T536-A651 PolarHBondContact OG1-O 2.81Å; T536-S652 WeakPolarHBondContact CG2-O 3.37Å; T536-S652 PolarHBondContact N-O 2.88Å; T536-S652 VanDerWaalsContact OG1-CB 3.27Å; T536-S652 WeakPolarHBondContact OG1-CB 3.36Å; T536-S652 PolarHBondContact OG1-O 3.37Å; T536-I654 HydrophobicContact CG2-CB 4.27Å; T536-I654 HydrophobicContact CG2-CD1 3.54Å; T536-I654 HydrophobicContact CG2-CG1 3.68Å; T536-I654 HydrophobicContact CG2-CG2 3.67Å
537	K	92.6	Very high	89.8	Confident	121 Å²	121	52.8 Å²	52.8	53%	0.526	26%	0.257	S	S	.	.	S	Bend	trans	-122.6	153.1	-178.5	-65.4	174	-172.3	155.7	0	110.5	A651 S652	K537-A651 PolarHBondContact N-O 2.84Å; K537-A651 WeakPolarHBondContact O-CB 3.27Å; K537-S652 PolarHBondContact NZ-OG 2.7Å; K537-S652 VanDerWaalsContact NZ-OG 3.09Å
538	T	93.9	Very high	89.8	Confident	82 Å²	82	55.7 Å²	55.7	50%	0.503	27%	0.271	S	S	.	.			trans	-82.9	126.6	167.6	-58.1	0	0	0	0	109.3	T561 V562 F619	T538-T561 HydrophobicContact CG2-CG2 3.54Å; T538-V562 CarbonylContact C-O 3.55Å; T538-V562 VanDerWaalsContact CA-O 3.27Å; T538-V562 WeakPolarHBondContact CA-O 3.34Å; T538-F619 HydrophobicContact CG2-CZ 3.85Å
539	V	93.5	Very high	89.5	Confident	26 Å²	26	55.9 Å²	55.9	16%	0.158	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.2	179.4	172.5	0	0	0	0	109.8	T561 V562 K650 A651	V539-T561 WeakPolarHBondContact O-CA 3.24Å; V539-V562 PolarHBondContact N-O 2.91Å; V539-V562 PolarHBondContact O-N 3.34Å; V539-K650 HydrophobicContact CG1-CB 3.93Å; V539-K650 HydrophobicContact CG2-CB 4.4Å; V539-A651 HydrophobicContact CB-CB 4.28Å; V539-A651 HydrophobicContact CG2-CB 3.94Å
540	Q	93.3	Very high	89.2	Confident	116 Å²	116	60.8 Å²	60.8	54%	0.542	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.5	166.1	-58.8	-164.9	-32.4	0	0	108.7	L560 T561	Q540-L560 WeakPolarHBondContact CA-O 3.48Å; Q540-T561 HydrophobicContact CG-CG2 4.01Å; Q540-T561 WeakPolarHBondContact CG-OG1 3.12Å; Q540-T561 PolarHBondContact NE2-OG1 2.86Å; Q540-T561 VanDerWaalsContact NE2-OG1 3.17Å
541	F	93.6	Very high	89	Confident	34 Å²	34	63.5 Å²	63.5	15%	0.149	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.8	177.3	-171.9	-115	0	0	0	110.7	H543 K559 L560 C643 E646 A647 K650	F541-H543 HydrophobicContact CE1-CB 3.94Å; F541-K559 WeakPolarHBondContact O-CA 3.42Å; F541-L560 PolarHBondContact N-O 3.19Å; F541-L560 PolarHBondContact O-N 2.79Å; F541-C643 WeakPolarHBondContact CD1-O 3.29Å; F541-C643 PolarHBondContact O-SG 2.79Å; F541-E646 HydrophobicContact CD1-CB 3.76Å; F541-E646 HydrophobicContact CE1-CB 3.33Å; F541-E646 HydrophobicContact CE1-CG 4.13Å; F541-E646 HydrophobicContact CZ-CB 3.9Å; F541-E646 HydrophobicContact CZ-CG 4.45Å; F541-A647 HydrophobicContact CB-CB 3.87Å; F541-K650 HydrophobicContact CD2-CD 4.13Å; F541-K650 VanDerWaalsContact CD2-NZ 3.34Å; F541-K650 HydrophobicContact CE2-CD 4.48Å
542	E	94.5	Very high	88.6	Confident	81 Å²	81	71.3 Å²	71.3	38%	0.379	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.1	177.5	-175.2	174.3	177	0	0	108	H544 V558 K559	E542-H544 IonicContact OE1-CE1 3.21Å; E542-H544 PolarHBondContact OE1-CE1 2.78Å; E542-H544 IonicContact OE1-NE2 2.71Å; E542-V558 WeakPolarHBondContact CA-O 3.12Å; E542-K559 HydrophobicContact CB-CB 4.28Å; E542-K559 HydrophobicContact CB-CG 4.15Å; E542-K559 HydrophobicContact CG-CB 4.19Å
543	H	94.1	Very high	88.4	Confident	39 Å²	39	77 Å²	77	18%	0.181	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.2	178.8	-169.8	54.1	0	0	0	110.5	F541 S557 V558 Q642 C643	F541-H543 HydrophobicContact CE1-CB 3.94Å; H543-S557 VanDerWaalsContact O-CA 3.3Å; H543-S557 WeakPolarHBondContact O-CA 3.37Å; H543-V558 PolarHBondContact N-O 3.32Å; H543-V558 PolarHBondContact O-N 3.12Å; H543-Q642 PolarHBondContact NE2-OE1 3.3Å; H543-C643 HydrophobicContact CB-CB 3.67Å
544	H	93.6	Very high	88.1	Confident	115 Å²	115	78.8 Å²	78.8	53%	0.532	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.1	179	-56.1	-77.9	0	0	0	109.9	E542 V556 S557	E542-H544 IonicContact OE1-CE1 3.21Å; E542-H544 PolarHBondContact OE1-CE1 2.78Å; E542-H544 IonicContact OE1-NE2 2.71Å; H544-V556 CarbonylContact C-O 3.5Å; H544-V556 WeakPolarHBondContact CA-O 3.32Å; H544-S557 WeakPolarHBondContact ND1-CB 3.47Å
545	L	91.3	Very high	88	Confident	38 Å²	38	80 Å²	80	20%	0.199	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.2	175.3	-174.6	65.7	0	0	0	109.7	A555 V556 T635 A638 C639	L545-A555 WeakPolarHBondContact O-CA 3.42Å; L545-V556 PolarHBondContact N-O 3.41Å; L545-V556 PolarHBondContact O-N 2.7Å; L545-T635 HydrophobicContact CD2-CG2 3.77Å; L545-T635 HydrophobicContact CG-CG2 4.45Å; L545-A638 HydrophobicContact CD2-CB 4.3Å; L545-C639 HydrophobicContact CB-CB 3.84Å; L545-C639 HydrophobicContact CD2-CB 4Å
546	K	88.5	Confident	87.9	Confident	142 Å²	142	80 Å²	80	62%	0.617	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.9	173.7	-63.7	-178.4	-177.2	179.1	0	109.1	Q553 K554 A555	K546-Q553 HydrophobicContact CB-CG 4.5Å; K546-K554 CarbonylContact C-O 3.51Å; K546-K554 WeakPolarHBondContact CA-O 3.47Å; K546-A555 HydrophobicContact CG-CB 4.27Å
547	Q	83.8	Confident	88	Confident	86 Å²	86	77.8 Å²	77.8	40%	0.402	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.4	179.3	-165.7	172.9	20.9	0	0	110.9	I549 K554 T635	Q547-I549 HydrophobicContact CB-CD1 4.21Å; Q547-I549 HydrophobicContact CB-CG1 4.19Å; Q547-I549 HydrophobicContact CG-CD1 4.2Å; Q547-I549 HydrophobicContact CG-CG1 3.93Å; Q547-K554 PolarHBondContact N-O 3.01Å; Q547-K554 PolarHBondContact O-N 2.92Å; Q547-T635 HydrophobicContact CB-CG2 4.09Å; Q547-T635 PolarHBondContact OE1-OG1 3.34Å
548	M	83.5	Confident	88	Confident	126 Å²	126	72 Å²	72	62%	0.621	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	116.5	171.8	-78	-68.8	-73.5	0	0	109.5	Q553	M548-Q553 HydrophobicContact SD-CB 3.8Å; M548-Q553 HydrophobicContact SD-CG 4.34Å
549	I	76.4	Confident	88	Confident	37 Å²	37	71.3 Å²	71.3	19%	0.19	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	120	-176.3	-52.2	-179.3	0	0	0	108	Q547 G551 R552 K554 P632	Q547-I549 HydrophobicContact CB-CD1 4.21Å; Q547-I549 HydrophobicContact CB-CG1 4.19Å; Q547-I549 HydrophobicContact CG-CD1 4.2Å; Q547-I549 HydrophobicContact CG-CG1 3.93Å; I549-G551 PolarHBondContact O-N 3.24Å; I549-G551 VanDerWaalsContact O-N 3.16Å; I549-R552 PolarHBondContact N-O 2.76Å; I549-R552 PolarHBondContact O-N 3.44Å; I549-K554 HydrophobicContact CB-CG 4.46Å; I549-K554 HydrophobicContact CD1-CB 4.43Å; I549-K554 HydrophobicContact CD1-CG 4.5Å; I549-P632 HydrophobicContact CD1-CG 3.66Å; I549-P632 HydrophobicContact CG2-CG 4.11Å
550	S	75.8	Confident	88	Confident	127 Å²	127	70 Å²	70	89%	0.888	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	39	-175.7	-55.2	0	0	0	0	113.5	R552	S550-R552 VanDerWaalsContact C-N 3.27Å; S550-R552 PolarHBondContact O-N 3.04Å
551	G	77.1	Confident	87.9	Confident	66 Å²	66	64.8 Å²	64.8	68%	0.68	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	0.7	179.3	0	0	0	0	0	115.7	I549	I549-G551 PolarHBondContact O-N 3.24Å; I549-G551 VanDerWaalsContact O-N 3.16Å
552	R	80.4	Confident	87.9	Confident	183 Å²	183	63.1 Å²	63.1	69%	0.691	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.2	172.7	-66.1	-177.7	179.4	172.8	-0.6	109.9	I549 S550	I549-R552 PolarHBondContact N-O 2.76Å; I549-R552 PolarHBondContact O-N 3.44Å; S550-R552 VanDerWaalsContact C-N 3.27Å; S550-R552 PolarHBondContact O-N 3.04Å
553	Q	83.3	Confident	87.6	Confident	125 Å²	125	59.3 Å²	59.3	58%	0.584	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	128.4	170.9	-164.3	173.2	25.8	0	0	108.6	K546 M548	K546-Q553 HydrophobicContact CB-CG 4.5Å; M548-Q553 HydrophobicContact SD-CB 3.8Å; M548-Q553 HydrophobicContact SD-CG 4.34Å
554	K	86.5	Confident	87.5	Confident	38 Å²	38	59.4 Å²	59.4	17%	0.165	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.6	175.5	-65.4	-65.9	176.1	-175.7	0	108.8	K546 Q547 I549 D628 Q629 T631	K546-K554 CarbonylContact C-O 3.51Å; K546-K554 WeakPolarHBondContact CA-O 3.47Å; Q547-K554 PolarHBondContact N-O 3.01Å; Q547-K554 PolarHBondContact O-N 2.92Å; I549-K554 HydrophobicContact CB-CG 4.46Å; I549-K554 HydrophobicContact CD1-CB 4.43Å; I549-K554 HydrophobicContact CD1-CG 4.5Å; K554-D628 WeakPolarHBondContact CA-OD2 3.42Å; K554-D628 HydrophobicContact CB-CB 4.49Å; K554-D628 HydrophobicContact CD-CB 3.78Å; K554-Q629 WeakPolarHBondContact CE-O 3.31Å; K554-Q629 PolarHBondContact NZ-O 2.86Å; K554-T631 HydrophobicContact CB-CG2 4.45Å
555	A	88.3	Confident	87.2	Confident	35 Å²	35	55.9 Å²	55.9	29%	0.289	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.6	177	0	0	0	0	0	110.8	L545 K546 D628	L545-A555 WeakPolarHBondContact O-CA 3.42Å; K546-A555 HydrophobicContact CG-CB 4.27Å; A555-D628 PolarHBondContact N-OD2 3.18Å; A555-D628 PolarHBondContact O-N 2.7Å; A555-D628 VanDerWaalsContact O-N 3.1Å
556	V	91.7	Very high	86.8	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.3	168.6	-179.9	0	0	0	0	107.7	H544 L545 V558 D626 V627 T631 T635 V636 C639	H544-V556 CarbonylContact C-O 3.5Å; H544-V556 WeakPolarHBondContact CA-O 3.32Å; L545-V556 PolarHBondContact N-O 3.41Å; L545-V556 PolarHBondContact O-N 2.7Å; V556-V558 HydrophobicContact CG1-CG2 4.07Å; V556-D626 CarbonylContact C-O 3.53Å; V556-D626 WeakPolarHBondContact CA-O 3.37Å; V556-V627 HydrophobicContact CG1-CG2 4.1Å; V556-V627 HydrophobicContact CG2-CG1 4.49Å; V556-T631 HydrophobicContact CG2-CG2 3.42Å; V556-T631 VanDerWaalsContact CG2-CG2 3.42Å; V556-T635 HydrophobicContact CG2-CG2 4.2Å; V556-V636 HydrophobicContact CG1-CG2 4.39Å; V556-V636 HydrophobicContact CG2-CG2 4.15Å; V556-C639 HydrophobicContact CB-CB 4.24Å; V556-C639 HydrophobicContact CG1-CB 3.86Å
557	S	93	Very high	86.3	Confident	14 Å²	14	56 Å²	56	10%	0.098	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.3	167	74.9	0	0	0	0	110.2	H543 H544 I625 D626	H543-S557 VanDerWaalsContact O-CA 3.3Å; H543-S557 WeakPolarHBondContact O-CA 3.37Å; H544-S557 WeakPolarHBondContact ND1-CB 3.47Å; S557-I625 WeakPolarHBondContact O-CA 2.98Å; S557-D626 PolarHBondContact N-O 3.27Å; S557-D626 PolarHBondContact O-N 2.83Å; S557-D626 WeakPolarHBondContact OG-CB 3.37Å; S557-D626 PolarHBondContact OG-N 2.84Å
558	V	92.6	Very high	86.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	130.1	176.5	-176.6	0	0	0	0	107.7	E542 H543 V556 L560 V597 L622 I625 C639 A640 C643	E542-V558 WeakPolarHBondContact CA-O 3.12Å; H543-V558 PolarHBondContact N-O 3.32Å; H543-V558 PolarHBondContact O-N 3.12Å; V556-V558 HydrophobicContact CG1-CG2 4.07Å; V558-L560 HydrophobicContact CG1-CD1 4.46Å; V558-L560 HydrophobicContact CG1-CD2 3.87Å; V558-L560 HydrophobicContact CG1-CG 3.92Å; V558-V597 HydrophobicContact CG1-CG1 4.25Å; V558-L622 HydrophobicContact CG1-CD1 3.83Å; V558-I625 HydrophobicContact CG2-CD1 4.4Å; V558-I625 HydrophobicContact CG2-CG1 4.47Å; V558-C639 HydrophobicContact CG2-CB 4.36Å; V558-A640 HydrophobicContact CG1-CB 4.49Å; V558-C643 PolarHBondContact O-SG 3.45Å; V558-C643 VanDerWaalsContact O-SG 3.33Å
559	K	93.6	Very high	85.9	Confident	66 Å²	66	51 Å²	51	29%	0.287	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.1	175.7	-172.6	175.4	-179.7	174.4	0	110.3	F541 E542 E623 D624	F541-K559 WeakPolarHBondContact O-CA 3.42Å; E542-K559 HydrophobicContact CB-CB 4.28Å; E542-K559 HydrophobicContact CB-CG 4.15Å; E542-K559 HydrophobicContact CG-CB 4.19Å; K559-E623 HydrophobicContact CB-CB 4.45Å; K559-E623 HydrophobicContact CD-CB 4.31Å; K559-E623 HydrophobicContact CG-CB 4.13Å; K559-E623 PolarHBondContact O-N 3.5Å; K559-D624 HydrophobicContact CB-CB 4.08Å; K559-D624 HydrophobicContact CD-CB 4.46Å; K559-D624 PolarHBondContact N-O 2.89Å; K559-D624 PolarHBondContact O-N 3.11Å
560	L	92.8	Very high	86	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	139.8	-178.6	-59.4	178.1	0	0	0	110.8	Q540 F541 V558 V562 L574 V620 R621 L622 C643 F644	Q540-L560 WeakPolarHBondContact CA-O 3.48Å; F541-L560 PolarHBondContact N-O 3.19Å; F541-L560 PolarHBondContact O-N 2.79Å; V558-L560 HydrophobicContact CG1-CD1 4.46Å; V558-L560 HydrophobicContact CG1-CD2 3.87Å; V558-L560 HydrophobicContact CG1-CG 3.92Å; L560-V562 HydrophobicContact CB-CG2 4.35Å; L560-L574 HydrophobicContact CD2-CD1 4.45Å; L560-V620 HydrophobicContact CD1-CG1 4.37Å; L560-V620 HydrophobicContact CD2-CG1 4.25Å; L560-R621 CarbonylContact C-O 3.54Å; L560-R621 WeakPolarHBondContact CA-O 3.43Å; L560-L622 HydrophobicContact CD2-CB 4.29Å; L560-L622 HydrophobicContact CD2-CD1 3.73Å; L560-C643 HydrophobicContact CD1-CB 3.99Å; L560-C643 HydrophobicContact CG-CB 4.47Å; L560-F644 HydrophobicContact CD1-CB 4.11Å
561	T	92.6	Very high	86.1	Confident	5 Å²	5	46 Å²	46	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.1	161.3	-56.2	0	0	0	0	108.1	T538 V539 Q540 F619 R621 E623	T538-T561 HydrophobicContact CG2-CG2 3.54Å; V539-T561 WeakPolarHBondContact O-CA 3.24Å; Q540-T561 HydrophobicContact CG-CG2 4.01Å; Q540-T561 WeakPolarHBondContact CG-OG1 3.12Å; Q540-T561 PolarHBondContact NE2-OG1 2.86Å; Q540-T561 VanDerWaalsContact NE2-OG1 3.17Å; T561-F619 HydrophobicContact CG2-CE2 4.2Å; T561-R621 PolarHBondContact N-O 3.22Å; T561-R621 PolarHBondContact O-N 3.09Å; T561-E623 WeakPolarHBondContact OG1-CG 3.34Å; T561-E623 PolarHBondContact OG1-OE1 3.15Å
562	V	92	Very high	85.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.2	177.9	-175.4	0	0	0	0	109.3	T538 V539 L560 V618 F619 V620 F644 A647 I648	T538-V562 CarbonylContact C-O 3.55Å; T538-V562 VanDerWaalsContact CA-O 3.27Å; T538-V562 WeakPolarHBondContact CA-O 3.34Å; V539-V562 PolarHBondContact N-O 2.91Å; V539-V562 PolarHBondContact O-N 3.34Å; L560-V562 HydrophobicContact CB-CG2 4.35Å; V562-V618 HydrophobicContact CG1-CB 4.48Å; V562-F619 WeakPolarHBondContact CA-O 3.27Å; V562-V620 HydrophobicContact CG2-CG1 4.17Å; V562-V620 HydrophobicContact CG2-CG2 4.41Å; V562-F644 HydrophobicContact CG1-CE2 4.31Å; V562-F644 HydrophobicContact CG2-CD2 4.11Å; V562-F644 HydrophobicContact CG2-CE2 4.38Å; V562-A647 HydrophobicContact CB-CB 4.16Å; V562-A647 HydrophobicContact CG2-CB 3.7Å; V562-I648 HydrophobicContact CG1-CD1 3.41Å; V562-I648 VanDerWaalsContact CG1-CD1 3.41Å; V562-I648 HydrophobicContact CG1-CG1 4.22Å
563	G	89.8	Confident	85.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	172.5	176.2	0	0	0	0	0	113.8	V618 F619	G563-V618 CarbonylContact O-C 3.58Å; G563-V618 VanDerWaalsContact O-CA 3.25Å; G563-V618 WeakPolarHBondContact O-CA 3.32Å; G563-F619 VanDerWaalsContact C-CE1 3.41Å; G563-F619 VanDerWaalsContact CA-CE1 3.44Å; G563-F619 PolarHBondContact N-O 3.4Å; G563-F619 VanDerWaalsContact N-O 3.15Å; G563-F619 WeakPolarHBondContact O-CD1 3.47Å; G563-F619 PolarHBondContact O-N 3.27Å
564	P	90.9	Very high	84.6	Confident	41 Å²	41	38 Å²	38	27%	0.266	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.8	179.9	20.3	-29.7	0	0	0	112.5	A535 F619	A535-P564 VanDerWaalsContact O-CB 3.26Å; A535-P564 WeakPolarHBondContact O-CB 3.05Å; P564-F619 WeakPolarHBondContact O-CD1 3.4Å
565	C	88.1	Confident	83.8	Confident	41 Å²	41	40.2 Å²	40.2	28%	0.277	25%	0.246	S	C	.	.			trans	-135	78.2	164.4	-159.4	0	0	0	0	109.4	G567 E568 D617 F619	C565-G567 PolarHBondContact O-N 3.31Å; C565-E568 HydrophobicContact CB-CB 4.36Å; C565-E568 WeakPolarHBondContact CB-OE2 3.43Å; C565-E568 PolarHBondContact O-N 3.06Å; C565-E568 PolarHBondContact SG-OE2 3.32Å; C565-D617 CarbonylContact C-O 3.56Å; C565-D617 PolarHBondContact N-O 3.29Å; C565-D617 CarbonylContact O-C 3.57Å; C565-D617 WeakPolarHBondContact O-CA 3.48Å; C565-D617 WeakPolarHBondContact O-CB 3.3Å; C565-F619 HydrophobicContact CB-CB 4.25Å; C565-F619 HydrophobicContact CB-CD1 4.31Å
566	P	81.9	Confident	82.7	Confident	113 Å²	113	39.4 Å²	39.4	73%	0.734	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	131.4	-173.7	-24	34.7	0	0	0	112.8
567	G	78.9	Confident	81.2	Confident	70 Å²	70	40.7 Å²	40.7	72%	0.722	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	6.1	176.7	0	0	0	0	0	116.2	C565 G569 D617	C565-G567 PolarHBondContact O-N 3.31Å; G567-G569 VanDerWaalsContact C-N 3.31Å; G567-D617 PolarHBondContact N-OD1 2.83Å; G567-D617 PolarHBondContact N-OD2 3.33Å
568	E	79.1	Confident	79.8	Confident	88 Å²	88	40.8 Å²	40.8	41%	0.411	25%	0.246	S	C	.	.			trans	-77.3	-22.1	175.2	-161.8	176.2	179.1	0	0	112.2	C565 D617	C565-E568 HydrophobicContact CB-CB 4.36Å; C565-E568 WeakPolarHBondContact CB-OE2 3.43Å; C565-E568 PolarHBondContact O-N 3.06Å; C565-E568 PolarHBondContact SG-OE2 3.32Å; E568-D617 PolarHBondContact N-OD1 3.33Å; E568-D617 VanDerWaalsContact N-OD1 3.17Å
569	G	79.2	Confident	78.1	Confident	19 Å²	19	48.5 Å²	48.5	20%	0.196	28%	0.28	C	S	.	.			trans	82.6	-149.2	-177.3	0	0	0	0	0	111.9	G567 D617	G567-G569 VanDerWaalsContact C-N 3.31Å; G569-D617 WeakPolarHBondContact CA-OD1 2.91Å; G569-D617 PolarHBondContact N-OD1 2.95Å; G569-D617 PolarHBondContact O-N 3.48Å
570	P	77.7	Confident	76.2	Confident	35 Å²	35	50.6 Å²	50.6	23%	0.227	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-64.9	149.7	-179.6	27.3	-34.4	0	0	0	112	K572 R614 Q616	P570-K572 WeakPolarHBondContact O-CG 3.43Å; P570-K572 PolarHBondContact O-N 3.46Å; P570-R614 VanDerWaalsContact CB-CZ 3.47Å; P570-Q616 HydrophobicContact CB-CG 4.34Å
571	L	79.2	Confident	74.6	Confident	23 Å²	23	52.2 Å²	52.2	12%	0.12	31%	0.308	C	S	.	.			trans	-59	107.1	176.8	-173.8	67.9	0	0	0	110.3	G573 L602 A605 V618 V620 F644	L571-G573 VanDerWaalsContact CD1-O 3.3Å; L571-G573 WeakPolarHBondContact CD1-O 3.33Å; L571-L602 HydrophobicContact CB-CD2 4.45Å; L571-L602 HydrophobicContact CD2-CD2 4.23Å; L571-L602 HydrophobicContact CG-CD2 4.11Å; L571-L602 WeakPolarHBondContact O-CD2 3.38Å; L571-A605 HydrophobicContact CB-CB 4.22Å; L571-A605 HydrophobicContact CD2-CB 4.02Å; L571-V618 HydrophobicContact CD1-CG2 4.5Å; L571-V618 WeakPolarHBondContact CD1-O 3.29Å; L571-V620 HydrophobicContact CD1-CB 4.46Å; L571-V620 HydrophobicContact CD1-CG2 3.77Å; L571-V620 HydrophobicContact CD2-CG2 3.75Å; L571-V620 HydrophobicContact CG-CG2 4.45Å; L571-F644 HydrophobicContact CD2-CE2 4.3Å
572	K	69	Low	73.1	Confident	162 Å²	162	58.9 Å²	58.9	70%	0.704	34%	0.339	S	S	*	.			trans	-88.1	-23	-179.6	-70	170.2	-169.9	159.6	0	112.9	P570	P570-K572 WeakPolarHBondContact O-CG 3.43Å; P570-K572 PolarHBondContact O-N 3.46Å
573	G	67.2	Low	71.8	Confident	31 Å²	31	65.9 Å²	65.9	32%	0.32	37%	0.369	S	S	.	.			trans	-168.3	172.3	-173.9	0	0	0	0	0	113.4	L571	L571-G573 VanDerWaalsContact CD1-O 3.3Å; L571-G573 WeakPolarHBondContact CD1-O 3.33Å
574	L	72.3	Confident	71	Confident	14 Å²	14	68.8 Å²	68.8	7%	0.073	38%	0.382	C	S	.	.			trans	-107	122.2	176.9	-178.3	70	0	0	0	107.5	L560 V597 R598 V620 L622	L560-L574 HydrophobicContact CD2-CD1 4.45Å; L574-V597 HydrophobicContact CD2-CB 4.46Å; L574-V597 HydrophobicContact CD2-CG1 3.84Å; L574-R598 HydrophobicContact CB-CB 4.38Å; L574-R598 HydrophobicContact CB-CG 4.16Å; L574-R598 HydrophobicContact CD2-CB 4.38Å; L574-V620 HydrophobicContact CD1-CB 3.62Å; L574-V620 HydrophobicContact CD1-CG1 3.19Å; L574-L622 HydrophobicContact CD1-CB 4.5Å; L574-L622 HydrophobicContact CD2-CB 4.06Å; L574-L622 HydrophobicContact CD2-CD2 4.45Å; L574-L622 HydrophobicContact CG-CB 4.32Å
575	Q	70.6	Confident	70.1	Confident	84 Å²	84	66.9 Å²	66.9	39%	0.393	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	129.4	170.3	-68.2	176.5	6.6	0	0	108	V620 R621 L622	Q575-V620 WeakPolarHBondContact CB-O 3.44Å; Q575-V620 PolarHBondContact N-O 2.78Å; Q575-R621 HydrophobicContact CB-CG 3.78Å; Q575-R621 CarbonylContact O-C 3.57Å; Q575-R621 VanDerWaalsContact O-CA 3.23Å; Q575-R621 WeakPolarHBondContact O-CA 3.32Å; Q575-L622 PolarHBondContact O-N 2.98Å
576	I	65.3	Low	69.5	Low	19 Å²	19	69.5 Å²	69.5	10%	0.097	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	109.4	175	-58.7	177.2	0	0	0	106.2	L585 E586 L594	I576-L585 HydrophobicContact CG2-CB 3.93Å; I576-L585 HydrophobicContact CG2-CD1 3.91Å; I576-L585 HydrophobicContact CG2-CG 4.47Å; I576-E586 HydrophobicContact CD1-CG 4.37Å; I576-L594 HydrophobicContact CD1-CD1 4.2Å
577	A	60.3	Low	69.2	Low	30 Å²	30	70.6 Å²	70.6	25%	0.248	38%	0.377	C	S	.	.			trans	-134.1	106.7	-178.6	0	0	0	0	0	108.1	R621 L622	A577-R621 HydrophobicContact CB-CB 4.45Å; A577-R621 HydrophobicContact CB-CG 4.3Å; A577-L622 CarbonylContact C-O 3.5Å; A577-L622 PolarHBondContact N-O 2.92Å
578	H	61.8	Low	69.3	Low	15 Å²	15	72.9 Å²	72.9	7%	0.069	36%	0.364	C	S	.	.			trans	-110.1	149.3	176	-171.3	-91.6	0	0	0	109.7	Q580 G581 F584 L585 E623	H578-Q580 WeakPolarHBondContact ND1-CB 3.43Å; H578-Q580 PolarHBondContact ND1-N 3.21Å; H578-Q580 VanDerWaalsContact ND1-N 3.12Å; H578-Q580 PolarHBondContact O-N 3.45Å; H578-G581 PolarHBondContact O-N 3.44Å; H578-F584 HydrophobicContact CB-CB 4.44Å; H578-F584 AromaticContact CD2-CD1 3.79Å; H578-F584 AromaticContact CE1-CD1 3.15Å; H578-F584 WeakPolarHBondContact CE1-CD1 3.32Å; H578-F584 AromaticContact CE1-CE1 3.29Å; H578-F584 WeakPolarHBondContact CE1-CE1 3.39Å; H578-F584 AromaticContact CE1-CG 3.96Å; H578-F584 AromaticContact CG-CD1 3.66Å; H578-F584 AromaticContact ND1-CD1 3.23Å; H578-F584 WeakPolarHBondContact ND1-CD1 3.49Å; H578-F584 AromaticContact ND1-CE1 3.88Å; H578-F584 AromaticContact ND1-CG 3.73Å; H578-F584 AromaticContact NE2-CD1 3.5Å; H578-F584 AromaticContact NE2-CE1 3.51Å; H578-L585 HydrophobicContact CB-CD1 4.01Å; H578-L585 HydrophobicContact CB-CG 3.93Å; H578-E623 PolarHBondContact CD2-O 3.16Å
579	F	57.8	Low	69.5	Low	162 Å²	162	69.7 Å²	69.7	71%	0.711	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.5	179.9	74.8	-87.7	0	0	0	114
580	Q	53.9	Low	69.7	Low	111 Å²	111	72 Å²	72	52%	0.519	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	5.9	176.3	-56.5	-172	2	0	0	113.9	H578 F584	H578-Q580 WeakPolarHBondContact ND1-CB 3.43Å; H578-Q580 PolarHBondContact ND1-N 3.21Å; H578-Q580 VanDerWaalsContact ND1-N 3.12Å; H578-Q580 PolarHBondContact O-N 3.45Å; Q580-F584 HydrophobicContact CB-CB 4.08Å; Q580-F584 HydrophobicContact CB-CD2 4.03Å; Q580-F584 HydrophobicContact CB-CG 3.94Å
581	G	58.6	Low	70	Confident	34 Å²	34	75.3 Å²	75.3	35%	0.351	37%	0.373	S	S	.	.			trans	108.8	155	-178.5	0	0	0	0	0	113.4	H578 K583 F584	H578-G581 PolarHBondContact O-N 3.44Å; G581-K583 VanDerWaalsContact C-N 3.26Å; G581-K583 PolarHBondContact O-N 3.4Å; G581-F584 WeakPolarHBondContact O-CB 3.41Å; G581-F584 PolarHBondContact O-N 3.34Å; G581-F584 VanDerWaalsContact O-N 3.09Å
582	E	61.3	Low	70.3	Confident	144 Å²	144	79.5 Å²	79.5	67%	0.673	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.7	-174.9	-61.6	178.5	162.1	0	0	112.8	F584	E582-F584 VanDerWaalsContact C-N 3.29Å; E582-F584 PolarHBondContact O-N 2.71Å
583	K	64.2	Low	71.2	Confident	147 Å²	147	72.4 Å²	72.4	64%	0.639	36%	0.362	S	S	*	.	H	α-helix	trans	-71.4	-18	-179	-65.8	-169.9	176	-173	0	114.6	G581 L585 E586 D587	G581-K583 VanDerWaalsContact C-N 3.26Å; G581-K583 PolarHBondContact O-N 3.4Å; K583-L585 VanDerWaalsContact C-N 3.34Å; K583-L585 PolarHBondContact O-N 2.8Å; K583-E586 PolarHBondContact O-N 3.08Å; K583-D587 WeakPolarHBondContact O-CB 3.45Å; K583-D587 VanDerWaalsContact O-CG 3.23Å; K583-D587 PolarHBondContact O-N 3.5Å
584	F	73.6	Confident	72.1	Confident	62 Å²	62	71 Å²	71	27%	0.272	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-42.9	-172.3	178.6	-97.1	0	0	0	112.5	H578 Q580 G581 E582 R588	H578-F584 HydrophobicContact CB-CB 4.44Å; H578-F584 AromaticContact CD2-CD1 3.79Å; H578-F584 AromaticContact CE1-CD1 3.15Å; H578-F584 WeakPolarHBondContact CE1-CD1 3.32Å; H578-F584 AromaticContact CE1-CE1 3.29Å; H578-F584 WeakPolarHBondContact CE1-CE1 3.39Å; H578-F584 AromaticContact CE1-CG 3.96Å; H578-F584 AromaticContact CG-CD1 3.66Å; H578-F584 AromaticContact ND1-CD1 3.23Å; H578-F584 WeakPolarHBondContact ND1-CD1 3.49Å; H578-F584 AromaticContact ND1-CE1 3.88Å; H578-F584 AromaticContact ND1-CG 3.73Å; H578-F584 AromaticContact NE2-CD1 3.5Å; H578-F584 AromaticContact NE2-CE1 3.51Å; Q580-F584 HydrophobicContact CB-CB 4.08Å; Q580-F584 HydrophobicContact CB-CD2 4.03Å; Q580-F584 HydrophobicContact CB-CG 3.94Å; G581-F584 WeakPolarHBondContact O-CB 3.41Å; G581-F584 PolarHBondContact O-N 3.34Å; G581-F584 VanDerWaalsContact O-N 3.09Å; E582-F584 VanDerWaalsContact C-N 3.29Å; E582-F584 PolarHBondContact O-N 2.71Å; F584-R588 WeakPolarHBondContact O-CB 3.29Å; F584-R588 PolarHBondContact O-N 2.99Å; F584-R588 VanDerWaalsContact O-N 3.1Å
585	L	73.2	Confident	72.8	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-73.8	-36	178.6	-71	176.8	0	0	0	112.1	I576 H578 K583 D587 R588 F589 L622 I625	I576-L585 HydrophobicContact CG2-CB 3.93Å; I576-L585 HydrophobicContact CG2-CD1 3.91Å; I576-L585 HydrophobicContact CG2-CG 4.47Å; H578-L585 HydrophobicContact CB-CD1 4.01Å; H578-L585 HydrophobicContact CB-CG 3.93Å; K583-L585 VanDerWaalsContact C-N 3.34Å; K583-L585 PolarHBondContact O-N 2.8Å; L585-D587 VanDerWaalsContact C-N 3.3Å; L585-D587 PolarHBondContact O-N 3.4Å; L585-R588 PolarHBondContact O-N 3.23Å; L585-F589 HydrophobicContact CD2-CD2 4.41Å; L585-F589 HydrophobicContact CD2-CE2 4.42Å; L585-F589 PolarHBondContact O-N 3.13Å; L585-L622 HydrophobicContact CD1-CD2 4.14Å; L585-L622 HydrophobicContact CD1-CG 4.02Å; L585-I625 HydrophobicContact CD2-CG2 4.06Å
586	E	74.1	Confident	73.7	Confident	97 Å²	97	70.2 Å²	70.2	45%	0.453	34%	0.344	S	S	.	.	H	α-helix	trans	-62.8	-36.6	174.2	-62.1	-179	165.6	0	0	111.9	I576 K583 L594	I576-E586 HydrophobicContact CD1-CG 4.37Å; K583-E586 PolarHBondContact O-N 3.08Å; E586-L594 HydrophobicContact CG-CD1 4.22Å
587	D	75.8	Confident	75	Confident	135 Å²	135	69.3 Å²	69.3	72%	0.722	34%	0.339	S	S	*	.	H	α-helix	trans	-76.4	-30.8	177	-69.5	-28.8	0	0	0	112.2	K583 L585	K583-D587 WeakPolarHBondContact O-CB 3.45Å; K583-D587 VanDerWaalsContact O-CG 3.23Å; K583-D587 PolarHBondContact O-N 3.5Å; L585-D587 VanDerWaalsContact C-N 3.3Å; L585-D587 PolarHBondContact O-N 3.4Å
588	R	81.2	Confident	76.4	Confident	118 Å²	118	70.5 Å²	70.5	45%	0.445	34%	0.337	S	S	.	.	H	α-helix	trans	-83.8	-35.6	-175.8	-174.5	177	173.2	-158.7	-4.1	113.3	F584 L585 D624	F584-R588 WeakPolarHBondContact O-CB 3.29Å; F584-R588 PolarHBondContact O-N 2.99Å; F584-R588 VanDerWaalsContact O-N 3.1Å; L585-R588 PolarHBondContact O-N 3.23Å; R588-D624 IonicContact NH1-OD1 2.82Å
589	F	82.8	Confident	77.7	Confident	22 Å²	22	73 Å²	73	10%	0.096	35%	0.352	C	S	.	.	S	Bend	trans	-122.4	139.4	-175.1	-67.9	-81.7	0	0	0	111.7	L585 V593 L594 I625 V627	L585-F589 HydrophobicContact CD2-CD2 4.41Å; L585-F589 HydrophobicContact CD2-CE2 4.42Å; L585-F589 PolarHBondContact O-N 3.13Å; F589-V593 HydrophobicContact CB-CB 4.49Å; F589-V593 HydrophobicContact CD1-CG1 4.46Å; F589-L594 HydrophobicContact CB-CD2 4.49Å; F589-L594 HydrophobicContact CB-CG 4.46Å; F589-I625 HydrophobicContact CD2-CG2 3.65Å; F589-I625 HydrophobicContact CE2-CG2 3.46Å; F589-I625 VanDerWaalsContact CE2-CG2 3.46Å; F589-I625 WeakPolarHBondContact CE2-O 3.48Å; F589-I625 HydrophobicContact CG-CG2 4.37Å; F589-I625 HydrophobicContact CZ-CG2 4.03Å; F589-I625 WeakPolarHBondContact CZ-O 3.45Å; F589-V627 HydrophobicContact CE1-CB 4.32Å
590	P	83.3	Confident	79.2	Confident	66 Å²	66	65.4 Å²	65.4	43%	0.429	32%	0.318	S	S	.	.			trans	-58.3	146	174	-23.1	32.9	0	0	0	112.8	H592 V593 L594	P590-H592 WeakPolarHBondContact CB-CE1 3.35Å; P590-H592 WeakPolarHBondContact CB-ND1 3.26Å; P590-H592 PolarHBondContact O-N 3.45Å; P590-V593 HydrophobicContact CB-CG2 4.45Å; P590-V593 HydrophobicContact CG-CG2 4.48Å; P590-V593 WeakPolarHBondContact O-CB 3.29Å; P590-V593 PolarHBondContact O-N 3.07Å; P590-L594 PolarHBondContact O-N 3.21Å
591	E	84.1	Confident	81	Confident	105 Å²	105	60.1 Å²	60.1	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-53.4	-33.8	-178.9	-174.8	58	-154.6	0	0	113.4	V593 L594 Q595 R598	E591-V593 VanDerWaalsContact C-N 3.27Å; E591-V593 PolarHBondContact O-N 3.4Å; E591-L594 PolarHBondContact O-N 2.96Å; E591-Q595 VanDerWaalsContact O-CB 3.3Å; E591-Q595 WeakPolarHBondContact O-CB 3.18Å; E591-Q595 PolarHBondContact O-N 3.27Å; E591-R598 IonicContact OE1-NH1 3.09Å
592	H	85.8	Confident	82.4	Confident	111 Å²	111	60.9 Å²	60.9	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-27.5	177.9	59.6	-102	0	0	0	113.5	P590 S596 L633	P590-H592 WeakPolarHBondContact CB-CE1 3.35Å; P590-H592 WeakPolarHBondContact CB-ND1 3.26Å; P590-H592 PolarHBondContact O-N 3.45Å; H592-S596 WeakPolarHBondContact O-CB 3.37Å; H592-S596 PolarHBondContact O-N 2.86Å; H592-S596 VanDerWaalsContact O-N 3.13Å; H592-L633 HydrophobicContact CB-CD1 4.47Å
593	V	87.2	Confident	83.7	Confident	13 Å²	13	59 Å²	59	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-73.8	-46.9	174.2	-179.3	0	0	0	0	109.8	F589 P590 E591 Q595 S596 V597 I625 V627 L633 V636	F589-V593 HydrophobicContact CB-CB 4.49Å; F589-V593 HydrophobicContact CD1-CG1 4.46Å; P590-V593 HydrophobicContact CB-CG2 4.45Å; P590-V593 HydrophobicContact CG-CG2 4.48Å; P590-V593 WeakPolarHBondContact O-CB 3.29Å; P590-V593 PolarHBondContact O-N 3.07Å; E591-V593 VanDerWaalsContact C-N 3.27Å; E591-V593 PolarHBondContact O-N 3.4Å; V593-Q595 VanDerWaalsContact C-N 3.32Å; V593-Q595 PolarHBondContact O-N 3.01Å; V593-S596 WeakPolarHBondContact O-CA 3.4Å; V593-S596 VanDerWaalsContact O-CB 3.24Å; V593-S596 WeakPolarHBondContact O-CB 3.49Å; V593-S596 PolarHBondContact O-N 2.8Å; V593-V597 PolarHBondContact O-N 2.81Å; V593-V597 VanDerWaalsContact O-N 3.08Å; V593-I625 HydrophobicContact CG1-CD1 4.12Å; V593-V627 HydrophobicContact CG1-CG2 4.28Å; V593-L633 HydrophobicContact CG2-CD2 4.17Å; V593-V636 HydrophobicContact CG1-CG1 4.32Å
594	L	87	Confident	84.9	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-40.7	177.2	-63.8	175.1	0	0	0	111.5	I576 E586 F589 P590 E591 S596 V597 R598 L622	I576-L594 HydrophobicContact CD1-CD1 4.2Å; E586-L594 HydrophobicContact CG-CD1 4.22Å; F589-L594 HydrophobicContact CB-CD2 4.49Å; F589-L594 HydrophobicContact CB-CG 4.46Å; P590-L594 PolarHBondContact O-N 3.21Å; E591-L594 PolarHBondContact O-N 2.96Å; L594-S596 VanDerWaalsContact C-N 3.27Å; L594-S596 PolarHBondContact O-N 3.3Å; L594-V597 WeakPolarHBondContact O-CB 3.04Å; L594-V597 PolarHBondContact O-N 3.23Å; L594-R598 PolarHBondContact O-N 3.03Å; L594-L622 HydrophobicContact CD2-CD2 3.88Å
595	Q	87.1	Confident	85.6	Confident	69 Å²	69	49.5 Å²	49.5	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-34.3	173.4	-170.1	59.9	27.3	0	0	111.9	E591 V593 R598 N599	E591-Q595 VanDerWaalsContact O-CB 3.3Å; E591-Q595 WeakPolarHBondContact O-CB 3.18Å; E591-Q595 PolarHBondContact O-N 3.27Å; V593-Q595 VanDerWaalsContact C-N 3.32Å; V593-Q595 PolarHBondContact O-N 3.01Å; Q595-R598 PolarHBondContact O-N 2.67Å; Q595-N599 PolarHBondContact NE2-OD1 3.04Å; Q595-N599 WeakPolarHBondContact O-CB 3.29Å; Q595-N599 PolarHBondContact O-N 2.84Å; Q595-N599 PolarHBondContact O-OD1 3.1Å
596	S	90.4	Very high	86.2	Confident	11 Å²	11	53 Å²	53	8%	0.077	27%	0.265	C	S	.	.	H	α-helix	trans	-65.8	-39.6	174.8	-162.2	0	0	0	0	112.4	H592 V593 L594 G600 L633 A637	H592-S596 WeakPolarHBondContact O-CB 3.37Å; H592-S596 PolarHBondContact O-N 2.86Å; H592-S596 VanDerWaalsContact O-N 3.13Å; V593-S596 WeakPolarHBondContact O-CA 3.4Å; V593-S596 VanDerWaalsContact O-CB 3.24Å; V593-S596 WeakPolarHBondContact O-CB 3.49Å; V593-S596 PolarHBondContact O-N 2.8Å; L594-S596 VanDerWaalsContact C-N 3.27Å; L594-S596 PolarHBondContact O-N 3.3Å; S596-G600 PolarHBondContact O-N 3.21Å; S596-L633 PolarHBondContact OG-O 2.71Å; S596-A637 WeakPolarHBondContact O-CB 3.34Å
597	V	90.8	Very high	86.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-45.5	173.1	178.7	0	0	0	0	110.5	V558 L574 V593 L594 G600 C601 L622 I625 V636 A640	V558-V597 HydrophobicContact CG1-CG1 4.25Å; L574-V597 HydrophobicContact CD2-CB 4.46Å; L574-V597 HydrophobicContact CD2-CG1 3.84Å; V593-V597 PolarHBondContact O-N 2.81Å; V593-V597 VanDerWaalsContact O-N 3.08Å; L594-V597 WeakPolarHBondContact O-CB 3.04Å; L594-V597 PolarHBondContact O-N 3.23Å; V597-G600 PolarHBondContact O-N 3.31Å; V597-C601 PolarHBondContact O-N 3.05Å; V597-C601 PolarHBondContact O-SG 3.5Å; V597-L622 HydrophobicContact CG1-CD1 4.2Å; V597-L622 HydrophobicContact CG1-CD2 4.34Å; V597-I625 HydrophobicContact CG2-CD1 3.5Å; V597-I625 VanDerWaalsContact CG2-CD1 3.5Å; V597-V636 HydrophobicContact CG2-CG1 3.7Å; V597-A640 HydrophobicContact CB-CB 4.33Å; V597-A640 HydrophobicContact CG1-CB 3.87Å
598	R	89.7	Confident	87.2	Confident	55 Å²	55	44.2 Å²	44.2	21%	0.208	22%	0.221	C	C	.	.	H	α-helix	trans	-58.4	-50.4	177.3	-176.9	-179.6	-75.8	126.8	-3.3	111.1	L574 E591 L594 Q595 G600 C601 L602	L574-R598 HydrophobicContact CB-CB 4.38Å; L574-R598 HydrophobicContact CB-CG 4.16Å; L574-R598 HydrophobicContact CD2-CB 4.38Å; E591-R598 IonicContact OE1-NH1 3.09Å; L594-R598 PolarHBondContact O-N 3.03Å; Q595-R598 PolarHBondContact O-N 2.67Å; R598-G600 VanDerWaalsContact C-N 3.3Å; R598-G600 PolarHBondContact O-N 2.98Å; R598-C601 PolarHBondContact O-N 3.1Å; R598-L602 HydrophobicContact CG-CD1 3.95Å; R598-L602 HydrophobicContact CG-CG 4.41Å; R598-L602 WeakPolarHBondContact O-CB 3.42Å; R598-L602 VanDerWaalsContact O-CG 3.29Å; R598-L602 WeakPolarHBondContact O-CG 3.44Å; R598-L602 PolarHBondContact O-N 3.43Å
599	N	89.1	Confident	87.6	Confident	69 Å²	69	40.3 Å²	40.3	37%	0.369	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-40	176.5	-68.7	-6.7	0	0	0	111.5	Q595 L602 N603	Q595-N599 PolarHBondContact NE2-OD1 3.04Å; Q595-N599 WeakPolarHBondContact O-CB 3.29Å; Q595-N599 PolarHBondContact O-N 2.84Å; Q595-N599 PolarHBondContact O-OD1 3.1Å; N599-L602 PolarHBondContact O-N 2.8Å; N599-N603 WeakPolarHBondContact O-CB 3.38Å; N599-N603 PolarHBondContact O-N 2.95Å; N599-N603 PolarHBondContact O-OD1 3.08Å
600	G	90.4	Very high	87.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-45	175.3	0	0	0	0	0	113.2	S596 V597 R598 A604 A637	S596-G600 PolarHBondContact O-N 3.21Å; V597-G600 PolarHBondContact O-N 3.31Å; R598-G600 VanDerWaalsContact C-N 3.3Å; R598-G600 PolarHBondContact O-N 2.98Å; G600-A604 WeakPolarHBondContact O-CB 3.46Å; G600-A604 PolarHBondContact O-N 3.47Å; G600-A604 VanDerWaalsContact O-N 3.08Å; G600-A637 WeakPolarHBondContact CA-O 3.38Å
601	C	90.8	Very high	87.8	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-68.6	-42	176.5	-60.2	0	0	0	0	112.2	V597 R598 A604 A605 F644	V597-C601 PolarHBondContact O-N 3.05Å; V597-C601 PolarHBondContact O-SG 3.5Å; R598-C601 PolarHBondContact O-N 3.1Å; C601-A604 PolarHBondContact O-N 3.03Å; C601-A605 PolarHBondContact O-N 2.86Å; C601-F644 HydrophobicContact CB-CD2 4.45Å
602	L	88.6	Confident	87.7	Confident	49 Å²	49	36.8 Å²	36.8	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-63.8	-42.6	178.7	-71.5	173.5	0	0	0	111.7	L571 R598 N599 A604 A605	L571-L602 HydrophobicContact CB-CD2 4.45Å; L571-L602 HydrophobicContact CD2-CD2 4.23Å; L571-L602 HydrophobicContact CG-CD2 4.11Å; L571-L602 WeakPolarHBondContact O-CD2 3.38Å; R598-L602 HydrophobicContact CG-CD1 3.95Å; R598-L602 HydrophobicContact CG-CG 4.41Å; R598-L602 WeakPolarHBondContact O-CB 3.42Å; R598-L602 VanDerWaalsContact O-CG 3.29Å; R598-L602 WeakPolarHBondContact O-CG 3.44Å; R598-L602 PolarHBondContact O-N 3.43Å; N599-L602 PolarHBondContact O-N 2.8Å; L602-A604 VanDerWaalsContact C-N 3.34Å; L602-A605 PolarHBondContact O-N 2.83Å
603	N	87.9	Confident	87.6	Confident	105 Å²	105	31.8 Å²	31.8	56%	0.561	17%	0.173	S	C	*	.	H	α-helix	trans	-64.4	-40.4	174.9	-69.3	-3.1	0	0	0	111.2	N599 A605 V606	N599-N603 WeakPolarHBondContact O-CB 3.38Å; N599-N603 PolarHBondContact O-N 2.95Å; N599-N603 PolarHBondContact O-OD1 3.08Å; N603-A605 VanDerWaalsContact C-N 3.26Å; N603-A605 PolarHBondContact O-N 2.86Å; N603-V606 WeakPolarHBondContact O-CB 3.16Å; N603-V606 PolarHBondContact O-N 3.26Å
604	A	89.5	Confident	87.6	Confident	3 Å²	3	35.3 Å²	35.3	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-28	176.2	0	0	0	0	0	113.1	G600 C601 L602 V606 H607 N641 F644 V645	G600-A604 WeakPolarHBondContact O-CB 3.46Å; G600-A604 PolarHBondContact O-N 3.47Å; G600-A604 VanDerWaalsContact O-N 3.08Å; C601-A604 PolarHBondContact O-N 3.03Å; L602-A604 VanDerWaalsContact C-N 3.34Å; A604-V606 PolarHBondContact O-N 3.5Å; A604-H607 PolarHBondContact O-N 3.43Å; A604-H607 VanDerWaalsContact O-O 3.06Å; A604-N641 HydrophobicContact CB-CB 4.19Å; A604-N641 WeakPolarHBondContact CB-ND2 3.28Å; A604-N641 PolarHBondContact N-ND2 3.27Å; A604-F644 HydrophobicContact CB-CB 4.06Å; A604-F644 HydrophobicContact CB-CD1 3.4Å; A604-F644 VanDerWaalsContact CB-CD1 3.4Å; A604-F644 HydrophobicContact CB-CE1 4.16Å; A604-F644 HydrophobicContact CB-CG 4.02Å; A604-V645 HydrophobicContact CB-CG2 4.12Å
605	A	89.3	Confident	87.8	Confident	7 Å²	7	35.2 Å²	35.2	6%	0.058	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.2	176.2	0	0	0	0	0	113.4	L571 C601 L602 N603 V615 F644	L571-A605 HydrophobicContact CB-CB 4.22Å; L571-A605 HydrophobicContact CD2-CB 4.02Å; C601-A605 PolarHBondContact O-N 2.86Å; L602-A605 PolarHBondContact O-N 2.83Å; N603-A605 VanDerWaalsContact C-N 3.26Å; N603-A605 PolarHBondContact O-N 2.86Å; A605-V615 HydrophobicContact CB-CB 4.3Å; A605-V615 PolarHBondContact O-N 3.24Å; A605-F644 HydrophobicContact CB-CE1 4.13Å; A605-F644 HydrophobicContact CB-CZ 4.08Å
606	V	85.5	Confident	87.9	Confident	72 Å²	72	32.3 Å²	32.3	44%	0.436	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-35.7	174.6	-176.6	0	0	0	0	111.1	N603 A604 R614	N603-V606 WeakPolarHBondContact O-CB 3.16Å; N603-V606 PolarHBondContact O-N 3.26Å; A604-V606 PolarHBondContact O-N 3.5Å; V606-R614 VanDerWaalsContact O-CA 3.29Å; V606-R614 WeakPolarHBondContact O-CA 3.32Å; V606-R614 PolarHBondContact O-N 3.45Å
607	H	85.2	Confident	87.8	Confident	45 Å²	45	32.6 Å²	32.6	21%	0.208	17%	0.171	C	C	.	.	S	Bend	trans	-123.6	102.1	-177.5	-59.5	-68.4	0	0	0	111	A604 S612	A604-H607 PolarHBondContact O-N 3.43Å; A604-H607 VanDerWaalsContact O-O 3.06Å; H607-S612 PolarHBondContact ND1-O 2.94Å
608	G	86.5	Confident	87.8	Confident	4 Å²	4	32.7 Å²	32.7	4%	0.041	17%	0.172	C	C	.	.			trans	-77.1	161.2	177.1	0	0	0	0	0	113.4	E533 L610 S612 A613	E533-G608 WeakPolarHBondContact OE2-CA 3.4Å; G608-L610 PolarHBondContact O-N 2.87Å; G608-S612 WeakPolarHBondContact O-CA 3.41Å; G608-S612 PolarHBondContact O-N 3.07Å; G608-A613 VanDerWaalsContact CA-O 3.27Å; G608-A613 WeakPolarHBondContact CA-O 3.28Å; G608-A613 PolarHBondContact N-O 3.07Å
609	P	87.8	Confident	87.8	Confident	36 Å²	36	31.1 Å²	31.1	23%	0.234	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-7.2	-174.5	29.9	-37.2	0	0	0	116.5	E533 I648 R649 P653	E533-P609 WeakPolarHBondContact OE2-CD 3.35Å; P609-I648 HydrophobicContact CG-CB 4.34Å; P609-I648 HydrophobicContact CG-CG2 3.64Å; P609-R649 HydrophobicContact CB-CB 4.47Å; P609-P653 HydrophobicContact CG-CG 4.22Å
610	L	86.6	Confident	87.8	Confident	53 Å²	53	27.9 Å²	27.9	28%	0.277	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-55.6	-177.3	-64.6	177.2	0	0	0	113.6	E533 G608 P653 L655 T739 I743	E533-L610 HydrophobicContact CG-CB 4.27Å; E533-L610 HydrophobicContact CG-CD1 4.43Å; E533-L610 PolarHBondContact OE1-N 3.27Å; E533-L610 VanDerWaalsContact OE1-N 3.14Å; E533-L610 WeakPolarHBondContact OE2-CB 3.48Å; E533-L610 PolarHBondContact OE2-N 3.03Å; G608-L610 PolarHBondContact O-N 2.87Å; L610-P653 HydrophobicContact CD1-CB 4.02Å; L610-P653 HydrophobicContact CD1-CG 4.23Å; L610-P653 HydrophobicContact CD2-CG 4.02Å; L610-P653 HydrophobicContact CG-CB 4.19Å; L610-P653 HydrophobicContact CG-CG 4.01Å; L610-L655 HydrophobicContact CB-CD2 4.36Å; L610-L655 HydrophobicContact CD1-CD2 4.32Å; L610-L655 HydrophobicContact CD1-CG 4.23Å; L610-T739 HydrophobicContact CD1-CG2 4.25Å; L610-I743 HydrophobicContact CB-CD1 4.45Å; L610-I743 HydrophobicContact CD2-CD1 4.27Å
611	L	84	Confident	87.8	Confident	34 Å²	34	32.4 Å²	32.4	18%	0.178	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.1	22.9	-177.2	-73	-178.7	0	0	0	111.5	E533 A613 L655 V742 I743 Y746	E533-L611 PolarHBondContact OE1-N 3.03Å; L611-A613 HydrophobicContact CB-CB 4.25Å; L611-A613 PolarHBondContact O-N 3.09Å; L611-L655 HydrophobicContact CB-CD2 4.38Å; L611-L655 HydrophobicContact CD1-CD1 3.57Å; L611-L655 HydrophobicContact CD1-CD2 3.86Å; L611-L655 HydrophobicContact CD1-CG 4.38Å; L611-L655 HydrophobicContact CG-CD1 4.34Å; L611-L655 HydrophobicContact CG-CD2 4.19Å; L611-V742 HydrophobicContact CD1-CG1 4.13Å; L611-I743 HydrophobicContact CD1-CG1 4.47Å; L611-I743 HydrophobicContact CD2-CG1 4.16Å; L611-I743 HydrophobicContact CG-CG1 4.17Å; L611-Y746 HydrophobicContact CD1-CD2 4.24Å; L611-Y746 HydrophobicContact CD1-CE2 4.5Å; L611-Y746 HydrophobicContact CD1-CG 4.3Å; L611-Y746 HydrophobicContact CD2-CD1 4.46Å; L611-Y746 HydrophobicContact CD2-CG 4.13Å
612	S	82.6	Confident	87.7	Confident	32 Å²	32	32.4 Å²	32.4	22%	0.224	17%	0.166	C	C	.	.	S	Bend	trans	52.7	28.4	-171.1	-60.1	0	0	0	0	111.9	D493 H607 G608	D493-S612 PolarHBondContact OD2-OG 3.06Å; H607-S612 PolarHBondContact ND1-O 2.94Å; G608-S612 WeakPolarHBondContact O-CA 3.41Å; G608-S612 PolarHBondContact O-N 3.07Å
613	A	84.7	Confident	87.6	Confident	6 Å²	6	32.1 Å²	32.1	5%	0.05	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-93	150.4	-174.1	0	0	0	0	0	110.7	Y531 E533 G608 L611 V615	Y531-A613 WeakPolarHBondContact O-CB 3.37Å; E533-A613 HydrophobicContact CG-CB 4.03Å; E533-A613 PolarHBondContact OE1-N 3.37Å; G608-A613 VanDerWaalsContact CA-O 3.27Å; G608-A613 WeakPolarHBondContact CA-O 3.28Å; G608-A613 PolarHBondContact N-O 3.07Å; L611-A613 HydrophobicContact CB-CB 4.25Å; L611-A613 PolarHBondContact O-N 3.09Å; A613-V615 PolarHBondContact O-N 3.25Å
614	R	86.6	Confident	87.6	Confident	87 Å²	87	29.9 Å²	29.9	33%	0.328	15%	0.151	S	C	.	.	P	Polyproline II helix	trans	-58.4	130.2	-175.2	-173.7	178.2	-177.9	-178.5	8.9	112.1	H532 E533 P570 V606 Q616	H532-R614 CarbonylContact C-O 3.53Å; H532-R614 WeakPolarHBondContact CA-O 3.46Å; H532-R614 VanDerWaalsContact CB-O 3.31Å; H532-R614 WeakPolarHBondContact CB-O 3.21Å; E533-R614 PolarHBondContact N-O 2.83Å; P570-R614 VanDerWaalsContact CB-CZ 3.47Å; V606-R614 VanDerWaalsContact O-CA 3.29Å; V606-R614 WeakPolarHBondContact O-CA 3.32Å; V606-R614 PolarHBondContact O-N 3.45Å; R614-Q616 HydrophobicContact CG-CG 4.27Å
615	V	90	Very high	87.6	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-81	126.1	176	-172.1	0	0	0	0	110	E533 A605 A613 V618 F644 I648	E533-V615 HydrophobicContact CB-CG2 4.29Å; E533-V615 CarbonylContact O-C 3.56Å; E533-V615 VanDerWaalsContact O-CA 3.28Å; E533-V615 WeakPolarHBondContact O-CA 3.45Å; A605-V615 HydrophobicContact CB-CB 4.3Å; A605-V615 PolarHBondContact O-N 3.24Å; A613-V615 PolarHBondContact O-N 3.25Å; V615-V618 HydrophobicContact CG1-CG1 3.97Å; V615-V618 HydrophobicContact CG1-CG2 3.72Å; V615-F644 HydrophobicContact CB-CZ 4.48Å; V615-F644 HydrophobicContact CG1-CZ 4.19Å; V615-F644 HydrophobicContact CG2-CE1 4.38Å; V615-I648 HydrophobicContact CG1-CD1 3.97Å
616	Q	89.7	Confident	87.6	Confident	7 Å²	7	33.5 Å²	33.5	3%	0.033	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-136.7	167.6	179	-58.6	-162.5	-8.7	0	0	111.2	H532 E533 T534 P570 R614 V618 L656	H532-Q616 HydrophobicContact CB-CG 4.41Å; H532-Q616 PolarHBondContact CD2-NE2 3.34Å; H532-Q616 PolarHBondContact CD2-OE1 3.05Å; H532-Q616 PolarHBondContact NE2-NE2 2.91Å; H532-Q616 VanDerWaalsContact NE2-NE2 3.14Å; E533-Q616 PolarHBondContact O-N 3.44Å; T534-Q616 VanDerWaalsContact CB-O 3.28Å; T534-Q616 WeakPolarHBondContact CB-O 3.12Å; T534-Q616 PolarHBondContact OG1-O 3.42Å; P570-Q616 HydrophobicContact CB-CG 4.34Å; R614-Q616 HydrophobicContact CG-CG 4.27Å; Q616-V618 VanDerWaalsContact C-N 3.28Å; Q616-V618 PolarHBondContact O-N 2.82Å; Q616-L656 HydrophobicContact CB-CD1 4.15Å
617	D	89	Confident	87.7	Confident	17 Å²	17	31.4 Å²	31.4	9%	0.091	16%	0.157	C	C	.	.	S	Bend	trans	56.7	42	178.3	-72.1	-5.3	0	0	0	112.6	T534 C565 G567 E568 G569	T534-D617 PolarHBondContact OG1-O 3.49Å; C565-D617 CarbonylContact C-O 3.56Å; C565-D617 PolarHBondContact N-O 3.29Å; C565-D617 CarbonylContact O-C 3.57Å; C565-D617 WeakPolarHBondContact O-CA 3.48Å; C565-D617 WeakPolarHBondContact O-CB 3.3Å; G567-D617 PolarHBondContact N-OD1 2.83Å; G567-D617 PolarHBondContact N-OD2 3.33Å; E568-D617 PolarHBondContact N-OD1 3.33Å; E568-D617 VanDerWaalsContact N-OD1 3.17Å; G569-D617 WeakPolarHBondContact CA-OD1 2.91Å; G569-D617 PolarHBondContact N-OD1 2.95Å; G569-D617 PolarHBondContact O-N 3.48Å
618	V	90.1	Very high	87.8	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	140.7	176.5	-62.7	0	0	0	0	110.7	A535 V562 G563 L571 V615 Q616 F644 I648	A535-V618 HydrophobicContact CB-CG1 3.82Å; V562-V618 HydrophobicContact CG1-CB 4.48Å; G563-V618 CarbonylContact O-C 3.58Å; G563-V618 VanDerWaalsContact O-CA 3.25Å; G563-V618 WeakPolarHBondContact O-CA 3.32Å; L571-V618 HydrophobicContact CD1-CG2 4.5Å; L571-V618 WeakPolarHBondContact CD1-O 3.29Å; V615-V618 HydrophobicContact CG1-CG1 3.97Å; V615-V618 HydrophobicContact CG1-CG2 3.72Å; Q616-V618 VanDerWaalsContact C-N 3.28Å; Q616-V618 PolarHBondContact O-N 2.82Å; V618-F644 HydrophobicContact CG2-CZ 4.43Å; V618-I648 HydrophobicContact CG1-CD1 4.15Å
619	F	89.5	Confident	87.5	Confident	23 Å²	23	40.6 Å²	40.6	10%	0.101	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	146.4	164.9	72.2	-94.4	0	0	0	109.5	T538 T561 V562 G563 P564 C565 R621	T538-F619 HydrophobicContact CG2-CZ 3.85Å; T561-F619 HydrophobicContact CG2-CE2 4.2Å; V562-F619 WeakPolarHBondContact CA-O 3.27Å; G563-F619 VanDerWaalsContact C-CE1 3.41Å; G563-F619 VanDerWaalsContact CA-CE1 3.44Å; G563-F619 PolarHBondContact N-O 3.4Å; G563-F619 VanDerWaalsContact N-O 3.15Å; G563-F619 WeakPolarHBondContact O-CD1 3.47Å; G563-F619 PolarHBondContact O-N 3.27Å; P564-F619 WeakPolarHBondContact O-CD1 3.4Å; C565-F619 HydrophobicContact CB-CB 4.25Å; C565-F619 HydrophobicContact CB-CD1 4.31Å; F619-R621 HydrophobicContact CD2-CG 4.12Å; F619-R621 HydrophobicContact CE2-CG 4.44Å
620	V	90.1	Very high	87.2	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.7	173	-170.4	0	0	0	0	108.3	L560 V562 L571 L574 Q575 F644	L560-V620 HydrophobicContact CD1-CG1 4.37Å; L560-V620 HydrophobicContact CD2-CG1 4.25Å; V562-V620 HydrophobicContact CG2-CG1 4.17Å; V562-V620 HydrophobicContact CG2-CG2 4.41Å; L571-V620 HydrophobicContact CD1-CB 4.46Å; L571-V620 HydrophobicContact CD1-CG2 3.77Å; L571-V620 HydrophobicContact CD2-CG2 3.75Å; L571-V620 HydrophobicContact CG-CG2 4.45Å; L574-V620 HydrophobicContact CD1-CB 3.62Å; L574-V620 HydrophobicContact CD1-CG1 3.19Å; Q575-V620 WeakPolarHBondContact CB-O 3.44Å; Q575-V620 PolarHBondContact N-O 2.78Å; V620-F644 HydrophobicContact CG1-CD2 4.33Å; V620-F644 HydrophobicContact CG2-CD2 3.88Å; V620-F644 HydrophobicContact CG2-CE2 3.41Å; V620-F644 VanDerWaalsContact CG2-CE2 3.41Å
621	R	89.4	Confident	87.2	Confident	96 Å²	96	40.4 Å²	40.4	36%	0.362	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.9	174.5	-72.2	172.7	-170.9	163.5	6.7	110.6	L560 T561 Q575 A577 F619	L560-R621 CarbonylContact C-O 3.54Å; L560-R621 WeakPolarHBondContact CA-O 3.43Å; T561-R621 PolarHBondContact N-O 3.22Å; T561-R621 PolarHBondContact O-N 3.09Å; Q575-R621 HydrophobicContact CB-CG 3.78Å; Q575-R621 CarbonylContact O-C 3.57Å; Q575-R621 VanDerWaalsContact O-CA 3.23Å; Q575-R621 WeakPolarHBondContact O-CA 3.32Å; A577-R621 HydrophobicContact CB-CB 4.45Å; A577-R621 HydrophobicContact CB-CG 4.3Å; F619-R621 HydrophobicContact CD2-CG 4.12Å; F619-R621 HydrophobicContact CE2-CG 4.44Å
622	L	89.3	Confident	87.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	112.8	169.2	179.9	63.7	0	0	0	109.2	V558 L560 L574 Q575 A577 L585 L594 V597 I625	V558-L622 HydrophobicContact CG1-CD1 3.83Å; L560-L622 HydrophobicContact CD2-CB 4.29Å; L560-L622 HydrophobicContact CD2-CD1 3.73Å; L574-L622 HydrophobicContact CD1-CB 4.5Å; L574-L622 HydrophobicContact CD2-CB 4.06Å; L574-L622 HydrophobicContact CD2-CD2 4.45Å; L574-L622 HydrophobicContact CG-CB 4.32Å; Q575-L622 PolarHBondContact O-N 2.98Å; A577-L622 CarbonylContact C-O 3.5Å; A577-L622 PolarHBondContact N-O 2.92Å; L585-L622 HydrophobicContact CD1-CD2 4.14Å; L585-L622 HydrophobicContact CD1-CG 4.02Å; L594-L622 HydrophobicContact CD2-CD2 3.88Å; V597-L622 HydrophobicContact CG1-CD1 4.2Å; V597-L622 HydrophobicContact CG1-CD2 4.34Å; L622-I625 HydrophobicContact CD1-CB 4.49Å; L622-I625 HydrophobicContact CD2-CG2 4.47Å
623	E	86.2	Confident	87.6	Confident	44 Å²	44	43.3 Å²	43.3	21%	0.206	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-41.1	-177.7	-64.6	-74.3	168.5	0	0	112.2	K559 T561 H578	K559-E623 HydrophobicContact CB-CB 4.45Å; K559-E623 HydrophobicContact CD-CB 4.31Å; K559-E623 HydrophobicContact CG-CB 4.13Å; K559-E623 PolarHBondContact O-N 3.5Å; T561-E623 WeakPolarHBondContact OG1-CG 3.34Å; T561-E623 PolarHBondContact OG1-OE1 3.15Å; H578-E623 PolarHBondContact CD2-O 3.16Å
624	D	87.3	Confident	87.8	Confident	57 Å²	57	46.7 Å²	46.7	31%	0.305	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	155.8	179.3	-158.8	2.8	0	0	0	110.9	K559 R588	K559-D624 HydrophobicContact CB-CB 4.08Å; K559-D624 HydrophobicContact CD-CB 4.46Å; K559-D624 PolarHBondContact N-O 2.89Å; K559-D624 PolarHBondContact O-N 3.11Å; R588-D624 IonicContact NH1-OD1 2.82Å
625	I	89.4	Confident	88	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	136.3	176.7	177.6	165.8	0	0	0	109.9	S557 V558 L585 F589 V593 V597 L622 V627 V636	S557-I625 WeakPolarHBondContact O-CA 2.98Å; V558-I625 HydrophobicContact CG2-CD1 4.4Å; V558-I625 HydrophobicContact CG2-CG1 4.47Å; L585-I625 HydrophobicContact CD2-CG2 4.06Å; F589-I625 HydrophobicContact CD2-CG2 3.65Å; F589-I625 HydrophobicContact CE2-CG2 3.46Å; F589-I625 VanDerWaalsContact CE2-CG2 3.46Å; F589-I625 WeakPolarHBondContact CE2-O 3.48Å; F589-I625 HydrophobicContact CG-CG2 4.37Å; F589-I625 HydrophobicContact CZ-CG2 4.03Å; F589-I625 WeakPolarHBondContact CZ-O 3.45Å; V593-I625 HydrophobicContact CG1-CD1 4.12Å; V597-I625 HydrophobicContact CG2-CD1 3.5Å; V597-I625 VanDerWaalsContact CG2-CD1 3.5Å; L622-I625 HydrophobicContact CD1-CB 4.49Å; L622-I625 HydrophobicContact CD2-CG2 4.47Å; I625-V627 HydrophobicContact CD1-CG2 3.75Å; I625-V627 HydrophobicContact CG1-CG2 3.69Å; I625-V636 HydrophobicContact CD1-CG1 4.24Å
626	D	89.7	Confident	88.1	Confident	86 Å²	86	42.8 Å²	42.8	46%	0.46	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.7	170.4	-163.4	19.1	0	0	0	109.7	V556 S557	V556-D626 CarbonylContact C-O 3.53Å; V556-D626 WeakPolarHBondContact CA-O 3.37Å; S557-D626 PolarHBondContact N-O 3.27Å; S557-D626 PolarHBondContact O-N 2.83Å; S557-D626 WeakPolarHBondContact OG-CB 3.37Å; S557-D626 PolarHBondContact OG-N 2.84Å
627	V	88.2	Confident	88.2	Confident	28 Å²	28	43.4 Å²	43.4	17%	0.17	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	119.5	-175.3	177.7	0	0	0	0	108.8	V556 F589 V593 I625 V636	V556-V627 HydrophobicContact CG1-CG2 4.1Å; V556-V627 HydrophobicContact CG2-CG1 4.49Å; F589-V627 HydrophobicContact CE1-CB 4.32Å; V593-V627 HydrophobicContact CG1-CG2 4.28Å; I625-V627 HydrophobicContact CD1-CG2 3.75Å; I625-V627 HydrophobicContact CG1-CG2 3.69Å; V627-V636 HydrophobicContact CG1-CG2 4.06Å; V627-V636 HydrophobicContact CG2-CG2 4.11Å
628	D	87.2	Confident	88.3	Confident	62 Å²	62	44.6 Å²	44.6	33%	0.332	26%	0.263	S	S	.	.			trans	-61.4	139.8	173	-81.3	-20.7	0	0	0	111.2	K554 A555 G630 T631	K554-D628 WeakPolarHBondContact CA-OD2 3.42Å; K554-D628 HydrophobicContact CB-CB 4.49Å; K554-D628 HydrophobicContact CD-CB 3.78Å; A555-D628 PolarHBondContact N-OD2 3.18Å; A555-D628 PolarHBondContact O-N 2.7Å; A555-D628 VanDerWaalsContact O-N 3.1Å; D628-G630 PolarHBondContact O-N 2.95Å; D628-T631 WeakPolarHBondContact O-CB 3.31Å; D628-T631 PolarHBondContact O-N 2.88Å; D628-T631 VanDerWaalsContact O-N 3.12Å; D628-T631 PolarHBondContact O-OG1 2.94Å
629	Q	81	Confident	88.4	Confident	180 Å²	180	44.5 Å²	44.5	84%	0.841	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	130.4	177.7	-69.3	-175.1	-1	0	0	111.8	K554	K554-Q629 WeakPolarHBondContact CE-O 3.31Å; K554-Q629 PolarHBondContact NZ-O 2.86Å
630	G	81.3	Confident	88.6	Confident	70 Å²	70	43.4 Å²	43.4	72%	0.722	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	11.4	-179.9	0	0	0	0	0	114.9	D628	D628-G630 PolarHBondContact O-N 2.95Å
631	T	85.2	Confident	88.7	Confident	15 Å²	15	45.9 Å²	45.9	9%	0.092	27%	0.271	C	S	.	.			trans	-69.5	128	168.8	-54.2	0	0	0	0	110	K554 V556 D628 T635 V636	K554-T631 HydrophobicContact CB-CG2 4.45Å; V556-T631 HydrophobicContact CG2-CG2 3.42Å; V556-T631 VanDerWaalsContact CG2-CG2 3.42Å; D628-T631 WeakPolarHBondContact O-CB 3.31Å; D628-T631 PolarHBondContact O-N 2.88Å; D628-T631 VanDerWaalsContact O-N 3.12Å; D628-T631 PolarHBondContact O-OG1 2.94Å; T631-T635 HydrophobicContact CG2-CG2 3.95Å; T631-V636 HydrophobicContact CG2-CG2 4.38Å
632	P	87.6	Confident	88.9	Confident	54 Å²	54	45.3 Å²	45.3	35%	0.351	27%	0.273	S	S	.	.			trans	-60.2	144.8	174.9	-24.9	36.7	0	0	0	112.2	I549 A634 T635 V636	I549-P632 HydrophobicContact CD1-CG 3.66Å; I549-P632 HydrophobicContact CG2-CG 4.11Å; P632-A634 PolarHBondContact O-N 3.27Å; P632-T635 WeakPolarHBondContact O-CB 3.26Å; P632-T635 PolarHBondContact O-N 2.69Å; P632-V636 PolarHBondContact O-N 2.87Å
633	L	88.9	Confident	89.1	Confident	73 Å²	73	45.3 Å²	45.3	38%	0.382	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-34.7	179.3	-58.5	178.2	0	0	0	112.2	H592 V593 S596 T635 V636 A637	H592-L633 HydrophobicContact CB-CD1 4.47Å; V593-L633 HydrophobicContact CG2-CD2 4.17Å; S596-L633 PolarHBondContact OG-O 2.71Å; L633-T635 VanDerWaalsContact C-N 3.25Å; L633-T635 PolarHBondContact O-N 2.99Å; L633-V636 WeakPolarHBondContact O-CB 3.31Å; L633-V636 PolarHBondContact O-N 2.73Å; L633-A637 PolarHBondContact O-N 3.12Å
634	A	88.9	Confident	89.4	Confident	77 Å²	77	43.3 Å²	43.3	64%	0.636	26%	0.263	S	S	*	.	H	α-helix	trans	-56.3	-38.5	174.8	0	0	0	0	0	112.8	P632 A637 A638	P632-A634 PolarHBondContact O-N 3.27Å; A634-A637 PolarHBondContact O-N 3.5Å; A634-A638 WeakPolarHBondContact O-CB 3.48Å; A634-A638 PolarHBondContact O-N 3.45Å
635	T	90.1	Very high	89.6	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-38.6	176.5	-48	0	0	0	0	111.5	L545 Q547 V556 T631 P632 L633 A638 C639	L545-T635 HydrophobicContact CD2-CG2 3.77Å; L545-T635 HydrophobicContact CG-CG2 4.45Å; Q547-T635 HydrophobicContact CB-CG2 4.09Å; Q547-T635 PolarHBondContact OE1-OG1 3.34Å; V556-T635 HydrophobicContact CG2-CG2 4.2Å; T631-T635 HydrophobicContact CG2-CG2 3.95Å; P632-T635 WeakPolarHBondContact O-CB 3.26Å; P632-T635 PolarHBondContact O-N 2.69Å; L633-T635 VanDerWaalsContact C-N 3.25Å; L633-T635 PolarHBondContact O-N 2.99Å; T635-A638 PolarHBondContact O-N 3.49Å; T635-C639 WeakPolarHBondContact O-CB 3.45Å; T635-C639 PolarHBondContact O-N 2.93Å
636	V	91.3	Very high	89.8	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-45.6	175.5	-178.9	0	0	0	0	110.7	V556 V593 V597 I625 V627 T631 P632 L633 A638 C639 A640	V556-V636 HydrophobicContact CG1-CG2 4.39Å; V556-V636 HydrophobicContact CG2-CG2 4.15Å; V593-V636 HydrophobicContact CG1-CG1 4.32Å; V597-V636 HydrophobicContact CG2-CG1 3.7Å; I625-V636 HydrophobicContact CD1-CG1 4.24Å; V627-V636 HydrophobicContact CG1-CG2 4.06Å; V627-V636 HydrophobicContact CG2-CG2 4.11Å; T631-V636 HydrophobicContact CG2-CG2 4.38Å; P632-V636 PolarHBondContact O-N 2.87Å; L633-V636 WeakPolarHBondContact O-CB 3.31Å; L633-V636 PolarHBondContact O-N 2.73Å; V636-A638 PolarHBondContact O-N 2.65Å; V636-C639 PolarHBondContact O-N 3.4Å; V636-A640 WeakPolarHBondContact O-CB 3.35Å; V636-A640 PolarHBondContact O-N 2.92Å
637	A	91.6	Very high	90	Very high	20 Å²	20	40.8 Å²	40.8	17%	0.165	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-42.7	176.1	0	0	0	0	0	112	S596 G600 L633 A634 A640 N641	S596-A637 WeakPolarHBondContact O-CB 3.34Å; G600-A637 WeakPolarHBondContact CA-O 3.38Å; L633-A637 PolarHBondContact O-N 3.12Å; A634-A637 PolarHBondContact O-N 3.5Å; A637-A640 PolarHBondContact O-N 3.14Å; A637-N641 WeakPolarHBondContact O-CB 3.43Å; A637-N641 PolarHBondContact O-N 2.85Å
638	A	91.9	Very high	90.2	Very high	41 Å²	41	39.5 Å²	39.5	34%	0.339	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-41.1	176.7	0	0	0	0	0	112.5	L545 A634 T635 V636 N641 Q642	L545-A638 HydrophobicContact CD2-CB 4.3Å; A634-A638 WeakPolarHBondContact O-CB 3.48Å; A634-A638 PolarHBondContact O-N 3.45Å; T635-A638 PolarHBondContact O-N 3.49Å; V636-A638 PolarHBondContact O-N 2.65Å; A638-N641 PolarHBondContact O-N 2.91Å; A638-Q642 WeakPolarHBondContact O-CG 3.46Å; A638-Q642 PolarHBondContact O-N 3.21Å
639	C	93.3	Very high	90.5	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63.9	-44.6	175.7	-173.2	0	0	0	0	111.6	L545 V556 V558 T635 V636 Q642 C643	L545-C639 HydrophobicContact CB-CB 3.84Å; L545-C639 HydrophobicContact CD2-CB 4Å; V556-C639 HydrophobicContact CB-CB 4.24Å; V556-C639 HydrophobicContact CG1-CB 3.86Å; V558-C639 HydrophobicContact CG2-CB 4.36Å; T635-C639 WeakPolarHBondContact O-CB 3.45Å; T635-C639 PolarHBondContact O-N 2.93Å; V636-C639 PolarHBondContact O-N 3.4Å; C639-Q642 PolarHBondContact O-N 3.31Å; C639-C643 VanDerWaalsContact O-CB 3.31Å; C639-C643 WeakPolarHBondContact O-CB 3.46Å; C639-C643 PolarHBondContact O-N 2.98Å
640	A	92.8	Very high	91	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-41.1	176.1	0	0	0	0	0	112.4	V558 V597 V636 A637 C643 F644	V558-A640 HydrophobicContact CG1-CB 4.49Å; V597-A640 HydrophobicContact CB-CB 4.33Å; V597-A640 HydrophobicContact CG1-CB 3.87Å; V636-A640 WeakPolarHBondContact O-CB 3.35Å; V636-A640 PolarHBondContact O-N 2.92Å; A637-A640 PolarHBondContact O-N 3.14Å; A640-C643 PolarHBondContact O-N 2.98Å; A640-F644 WeakPolarHBondContact O-CB 3.29Å; A640-F644 PolarHBondContact O-N 3.28Å
641	N	92.2	Very high	91.5	Very high	53 Å²	53	36.2 Å²	36.2	28%	0.283	20%	0.197	S	C	.	.	H	α-helix	trans	-58.9	-53	175.4	175.6	-66.8	0	0	0	111.2	A604 A637 A638 C643 F644 V645	A604-N641 HydrophobicContact CB-CB 4.19Å; A604-N641 WeakPolarHBondContact CB-ND2 3.28Å; A604-N641 PolarHBondContact N-ND2 3.27Å; A637-N641 WeakPolarHBondContact O-CB 3.43Å; A637-N641 PolarHBondContact O-N 2.85Å; A638-N641 PolarHBondContact O-N 2.91Å; N641-C643 VanDerWaalsContact C-N 3.32Å; N641-C643 PolarHBondContact O-N 3.32Å; N641-F644 PolarHBondContact O-N 3.12Å; N641-F644 VanDerWaalsContact O-N 3.15Å; N641-V645 WeakPolarHBondContact O-CG2 3.49Å; N641-V645 PolarHBondContact O-N 2.91Å
642	Q	92.8	Very high	91.8	Very high	85 Å²	85	37.5 Å²	37.5	40%	0.397	21%	0.207	S	C	.	.	H	α-helix	trans	-62.2	-38.8	178.4	-70.9	177.5	-6.8	0	0	112.5	H543 A638 C639 F644 E646	H543-Q642 PolarHBondContact NE2-OE1 3.3Å; A638-Q642 WeakPolarHBondContact O-CG 3.46Å; A638-Q642 PolarHBondContact O-N 3.21Å; C639-Q642 PolarHBondContact O-N 3.31Å; Q642-F644 VanDerWaalsContact C-N 3.35Å; Q642-E646 WeakPolarHBondContact O-CB 3.32Å; Q642-E646 PolarHBondContact O-N 3.1Å; Q642-E646 VanDerWaalsContact O-N 3.13Å
643	C	93.8	Very high	92	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-46.3	174.6	-170.2	0	0	0	0	111.2	F541 H543 V558 L560 C639 A640 N641 A647	F541-C643 WeakPolarHBondContact CD1-O 3.29Å; F541-C643 PolarHBondContact O-SG 2.79Å; H543-C643 HydrophobicContact CB-CB 3.67Å; V558-C643 PolarHBondContact O-SG 3.45Å; V558-C643 VanDerWaalsContact O-SG 3.33Å; L560-C643 HydrophobicContact CD1-CB 3.99Å; L560-C643 HydrophobicContact CG-CB 4.47Å; C639-C643 VanDerWaalsContact O-CB 3.31Å; C639-C643 WeakPolarHBondContact O-CB 3.46Å; C639-C643 PolarHBondContact O-N 2.98Å; A640-C643 PolarHBondContact O-N 2.98Å; N641-C643 VanDerWaalsContact C-N 3.32Å; N641-C643 PolarHBondContact O-N 3.32Å; C643-A647 VanDerWaalsContact O-CB 3.24Å; C643-A647 WeakPolarHBondContact O-CB 3.46Å; C643-A647 PolarHBondContact O-N 2.95Å
644	F	93.1	Very high	92.2	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-47.7	179.5	178.7	-90	0	0	0	112.2	L560 V562 L571 C601 A604 A605 V615 V618 V620 A640 N641 Q642 E646 A647 I648	L560-F644 HydrophobicContact CD1-CB 4.11Å; V562-F644 HydrophobicContact CG1-CE2 4.31Å; V562-F644 HydrophobicContact CG2-CD2 4.11Å; V562-F644 HydrophobicContact CG2-CE2 4.38Å; L571-F644 HydrophobicContact CD2-CE2 4.3Å; C601-F644 HydrophobicContact CB-CD2 4.45Å; A604-F644 HydrophobicContact CB-CB 4.06Å; A604-F644 HydrophobicContact CB-CD1 3.4Å; A604-F644 VanDerWaalsContact CB-CD1 3.4Å; A604-F644 HydrophobicContact CB-CE1 4.16Å; A604-F644 HydrophobicContact CB-CG 4.02Å; A605-F644 HydrophobicContact CB-CE1 4.13Å; A605-F644 HydrophobicContact CB-CZ 4.08Å; V615-F644 HydrophobicContact CB-CZ 4.48Å; V615-F644 HydrophobicContact CG1-CZ 4.19Å; V615-F644 HydrophobicContact CG2-CE1 4.38Å; V618-F644 HydrophobicContact CG2-CZ 4.43Å; V620-F644 HydrophobicContact CG1-CD2 4.33Å; V620-F644 HydrophobicContact CG2-CD2 3.88Å; V620-F644 HydrophobicContact CG2-CE2 3.41Å; V620-F644 VanDerWaalsContact CG2-CE2 3.41Å; A640-F644 WeakPolarHBondContact O-CB 3.29Å; A640-F644 PolarHBondContact O-N 3.28Å; N641-F644 PolarHBondContact O-N 3.12Å; N641-F644 VanDerWaalsContact O-N 3.15Å; Q642-F644 VanDerWaalsContact C-N 3.35Å; F644-E646 PolarHBondContact O-N 2.8Å; F644-A647 WeakPolarHBondContact O-CB 3.42Å; F644-A647 PolarHBondContact O-N 2.96Å; F644-I648 HydrophobicContact CD1-CG1 4.13Å; F644-I648 HydrophobicContact CE1-CD1 4.37Å; F644-I648 HydrophobicContact CE1-CG1 3.7Å; F644-I648 HydrophobicContact CE2-CD1 4.22Å; F644-I648 HydrophobicContact CE2-CG1 4.13Å; F644-I648 HydrophobicContact CZ-CD1 3.89Å; F644-I648 HydrophobicContact CZ-CG1 3.71Å; F644-I648 WeakPolarHBondContact O-CG1 3.38Å; F644-I648 PolarHBondContact O-N 3.36Å
645	V	91.7	Very high	92.4	Very high	33 Å²	33	30.2 Å²	30.2	20%	0.2	16%	0.156	C	C	.	.	H	α-helix	trans	-58.8	-46.5	179.7	174.4	0	0	0	0	111.3	A604 N641 I648 R649	A604-V645 HydrophobicContact CB-CG2 4.12Å; N641-V645 WeakPolarHBondContact O-CG2 3.49Å; N641-V645 PolarHBondContact O-N 2.91Å; V645-I648 PolarHBondContact O-N 3.07Å; V645-R649 WeakPolarHBondContact O-CB 3.46Å; V645-R649 PolarHBondContact O-N 3.25Å
646	E	93.6	Very high	92.4	Very high	56 Å²	56	30 Å²	30	26%	0.262	16%	0.155	S	C	.	.	H	α-helix	trans	-69.3	-34.1	178	-77.2	-66	137.9	0	0	112.8	F541 Q642 F644 R649 K650	F541-E646 HydrophobicContact CD1-CB 3.76Å; F541-E646 HydrophobicContact CE1-CB 3.33Å; F541-E646 HydrophobicContact CE1-CG 4.13Å; F541-E646 HydrophobicContact CZ-CB 3.9Å; F541-E646 HydrophobicContact CZ-CG 4.45Å; Q642-E646 WeakPolarHBondContact O-CB 3.32Å; Q642-E646 PolarHBondContact O-N 3.1Å; Q642-E646 VanDerWaalsContact O-N 3.13Å; F644-E646 PolarHBondContact O-N 2.8Å; E646-R649 PolarHBondContact O-N 2.96Å; E646-R649 IonicContact OE1-CZ 3.5Å; E646-R649 IonicContact OE1-NE 3.3Å; E646-R649 IonicContact OE1-NH1 2.83Å; E646-R649 PolarHBondContact OE1-NH1 3.21Å; E646-K650 WeakPolarHBondContact O-CG 3.46Å; E646-K650 PolarHBondContact O-N 3.3Å
647	A	93.5	Very high	92.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-48.1	173	0	0	0	0	0	111.1	F541 V562 C643 F644 K650 A651	F541-A647 HydrophobicContact CB-CB 3.87Å; V562-A647 HydrophobicContact CB-CB 4.16Å; V562-A647 HydrophobicContact CG2-CB 3.7Å; C643-A647 VanDerWaalsContact O-CB 3.24Å; C643-A647 WeakPolarHBondContact O-CB 3.46Å; C643-A647 PolarHBondContact O-N 2.95Å; F644-A647 WeakPolarHBondContact O-CB 3.42Å; F644-A647 PolarHBondContact O-N 2.96Å; A647-K650 PolarHBondContact O-N 2.72Å; A647-A651 VanDerWaalsContact O-CB 3.27Å; A647-A651 WeakPolarHBondContact O-CB 3.45Å; A647-A651 PolarHBondContact O-N 2.79Å
648	I	93	Very high	92.2	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-61.8	-45	176.6	-66.2	-72.4	0	0	0	110.8	A535 V562 P609 V615 V618 F644 V645 K650 A651 P653	A535-I648 HydrophobicContact CB-CD1 4.14Å; V562-I648 HydrophobicContact CG1-CD1 3.41Å; V562-I648 VanDerWaalsContact CG1-CD1 3.41Å; V562-I648 HydrophobicContact CG1-CG1 4.22Å; P609-I648 HydrophobicContact CG-CB 4.34Å; P609-I648 HydrophobicContact CG-CG2 3.64Å; V615-I648 HydrophobicContact CG1-CD1 3.97Å; V618-I648 HydrophobicContact CG1-CD1 4.15Å; F644-I648 HydrophobicContact CD1-CG1 4.13Å; F644-I648 HydrophobicContact CE1-CD1 4.37Å; F644-I648 HydrophobicContact CE1-CG1 3.7Å; F644-I648 HydrophobicContact CE2-CD1 4.22Å; F644-I648 HydrophobicContact CE2-CG1 4.13Å; F644-I648 HydrophobicContact CZ-CD1 3.89Å; F644-I648 HydrophobicContact CZ-CG1 3.71Å; F644-I648 WeakPolarHBondContact O-CG1 3.38Å; F644-I648 PolarHBondContact O-N 3.36Å; V645-I648 PolarHBondContact O-N 3.07Å; I648-K650 VanDerWaalsContact C-N 3.26Å; I648-K650 PolarHBondContact O-N 3.2Å; I648-A651 WeakPolarHBondContact O-CA 3.35Å; I648-A651 WeakPolarHBondContact O-CB 3.49Å; I648-A651 PolarHBondContact O-N 2.79Å; I648-P653 HydrophobicContact CG2-CB 4.01Å; I648-P653 WeakPolarHBondContact O-CD 3.48Å
649	R	92.7	Very high	92	Very high	136 Å²	136	27.7 Å²	27.7	51%	0.513	13%	0.133	S	C	.	.	H	α-helix	trans	-56.3	-40.4	177.5	-175	178	-73.6	175.8	-9.9	112.1	P609 V645 E646 P653	P609-R649 HydrophobicContact CB-CB 4.47Å; V645-R649 WeakPolarHBondContact O-CB 3.46Å; V645-R649 PolarHBondContact O-N 3.25Å; E646-R649 PolarHBondContact O-N 2.96Å; E646-R649 IonicContact OE1-CZ 3.5Å; E646-R649 IonicContact OE1-NE 3.3Å; E646-R649 IonicContact OE1-NH1 2.83Å; E646-R649 PolarHBondContact OE1-NH1 3.21Å; R649-P653 WeakPolarHBondContact O-CD 3.42Å
650	K	92.9	Very high	91.7	Very high	108 Å²	108	27.7 Å²	27.7	47%	0.47	13%	0.133	S	C	.	.	H	α-helix	trans	-77.6	-23	176	-71.7	174.6	-175.9	174.7	0	113.3	V539 F541 E646 A647 I648 S652	V539-K650 HydrophobicContact CG1-CB 3.93Å; V539-K650 HydrophobicContact CG2-CB 4.4Å; F541-K650 HydrophobicContact CD2-CD 4.13Å; F541-K650 VanDerWaalsContact CD2-NZ 3.34Å; F541-K650 HydrophobicContact CE2-CD 4.48Å; E646-K650 WeakPolarHBondContact O-CG 3.46Å; E646-K650 PolarHBondContact O-N 3.3Å; A647-K650 PolarHBondContact O-N 2.72Å; I648-K650 VanDerWaalsContact C-N 3.26Å; I648-K650 PolarHBondContact O-N 3.2Å; K650-S652 PolarHBondContact O-N 3.03Å
651	A	91.6	Very high	91.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	13.8	179.6	0	0	0	0	0	114.4	A535 T536 K537 V539 A647 I648	A535-A651 HydrophobicContact CB-CB 3.7Å; T536-A651 PolarHBondContact N-O 3.07Å; T536-A651 VanDerWaalsContact N-O 3.07Å; T536-A651 PolarHBondContact OG1-O 2.81Å; K537-A651 PolarHBondContact N-O 2.84Å; K537-A651 WeakPolarHBondContact O-CB 3.27Å; V539-A651 HydrophobicContact CB-CB 4.28Å; V539-A651 HydrophobicContact CG2-CB 3.94Å; A647-A651 VanDerWaalsContact O-CB 3.27Å; A647-A651 WeakPolarHBondContact O-CB 3.45Å; A647-A651 PolarHBondContact O-N 2.79Å; I648-A651 WeakPolarHBondContact O-CA 3.35Å; I648-A651 WeakPolarHBondContact O-CB 3.49Å; I648-A651 PolarHBondContact O-N 2.79Å
652	S	90.9	Very high	91	Very high	42 Å²	42	28.1 Å²	28.1	29%	0.294	13%	0.134	S	C	.	.			trans	53.7	67.3	-179.7	-56.5	0	0	0	0	110.4	T536 K537 K650	T536-S652 WeakPolarHBondContact CG2-O 3.37Å; T536-S652 PolarHBondContact N-O 2.88Å; T536-S652 VanDerWaalsContact OG1-CB 3.27Å; T536-S652 WeakPolarHBondContact OG1-CB 3.36Å; T536-S652 PolarHBondContact OG1-O 3.37Å; K537-S652 PolarHBondContact NZ-OG 2.7Å; K537-S652 VanDerWaalsContact NZ-OG 3.09Å; K650-S652 PolarHBondContact O-N 3.03Å
653	P	91.7	Very high	90.5	Very high	23 Å²	23	25.5 Å²	25.5	15%	0.149	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	149.8	-173.4	29.3	-32.2	0	0	0	110.9	T534 P609 L610 I648 R649	T534-P653 CarbonylContact O-C 3.5Å; T534-P653 WeakPolarHBondContact O-CA 3.35Å; P609-P653 HydrophobicContact CG-CG 4.22Å; L610-P653 HydrophobicContact CD1-CB 4.02Å; L610-P653 HydrophobicContact CD1-CG 4.23Å; L610-P653 HydrophobicContact CD2-CG 4.02Å; L610-P653 HydrophobicContact CG-CB 4.19Å; L610-P653 HydrophobicContact CG-CG 4.01Å; I648-P653 HydrophobicContact CG2-CB 4.01Å; I648-P653 WeakPolarHBondContact O-CD 3.48Å; R649-P653 WeakPolarHBondContact O-CD 3.42Å
654	I	92.8	Very high	90	Very high	28 Å²	28	25.5 Å²	25.5	14%	0.144	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	159.7	174.6	61.1	173.7	0	0	0	109.9	E533 T534 T536 P733	E533-I654 WeakPolarHBondContact CA-O 3.43Å; T534-I654 HydrophobicContact CG2-CD1 4.09Å; T534-I654 HydrophobicContact CG2-CG1 3.59Å; T534-I654 PolarHBondContact N-O 3.4Å; T534-I654 PolarHBondContact O-N 2.9Å; T536-I654 HydrophobicContact CG2-CB 4.27Å; T536-I654 HydrophobicContact CG2-CD1 3.54Å; T536-I654 HydrophobicContact CG2-CG1 3.68Å; T536-I654 HydrophobicContact CG2-CG2 3.67Å; I654-P733 HydrophobicContact CD1-CB 3.43Å; I654-P733 VanDerWaalsContact CD1-CB 3.43Å
655	L	93.1	Very high	89.2	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	145.2	174.2	-68.3	172.3	0	0	0	110.9	H532 E533 L610 L611 L734 T739 V742 I743	H532-L655 CarbonylContact O-C 3.58Å; H532-L655 WeakPolarHBondContact O-CA 3.32Å; E533-L655 HydrophobicContact CG-CD2 3.82Å; L610-L655 HydrophobicContact CB-CD2 4.36Å; L610-L655 HydrophobicContact CD1-CD2 4.32Å; L610-L655 HydrophobicContact CD1-CG 4.23Å; L611-L655 HydrophobicContact CB-CD2 4.38Å; L611-L655 HydrophobicContact CD1-CD1 3.57Å; L611-L655 HydrophobicContact CD1-CD2 3.86Å; L611-L655 HydrophobicContact CD1-CG 4.38Å; L611-L655 HydrophobicContact CG-CD1 4.34Å; L611-L655 HydrophobicContact CG-CD2 4.19Å; L655-L734 HydrophobicContact CB-CD1 3.7Å; L655-L734 WeakPolarHBondContact O-CB 3.45Å; L655-L734 PolarHBondContact O-N 2.96Å; L655-T739 HydrophobicContact CB-CG2 4.17Å; L655-T739 HydrophobicContact CD1-CG2 3.9Å; L655-T739 HydrophobicContact CG-CG2 3.77Å; L655-T739 PolarHBondContact N-OG1 3.4Å; L655-V742 HydrophobicContact CD1-CB 4.07Å; L655-V742 HydrophobicContact CD1-CG1 3.87Å; L655-I743 HydrophobicContact CD1-CG1 4.19Å
656	L	91	Very high	88.7	Confident	2 Å²	2	24.4 Å²	24.4	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127	169.1	-72	178.6	0	0	0	107.9	Y531 H532 T534 Q616 Y731 E732 P733	Y531-L656 WeakPolarHBondContact CA-O 3.31Å; H532-L656 HydrophobicContact CB-CB 3.86Å; H532-L656 HydrophobicContact CB-CD1 4.05Å; H532-L656 PolarHBondContact N-O 3.21Å; H532-L656 PolarHBondContact O-N 3.48Å; T534-L656 HydrophobicContact CG2-CD1 4.3Å; T534-L656 HydrophobicContact CG2-CD2 3.71Å; T534-L656 HydrophobicContact CG2-CG 3.85Å; Q616-L656 HydrophobicContact CB-CD1 4.15Å; L656-Y731 HydrophobicContact CB-CD1 4.11Å; L656-Y731 HydrophobicContact CB-CG 4.44Å; L656-E732 CarbonylContact C-O 3.54Å; L656-E732 VanDerWaalsContact CA-O 3.29Å; L656-E732 WeakPolarHBondContact CA-O 3.3Å; L656-P733 HydrophobicContact CD2-CB 4.1Å
657	E	90.2	Very high	87.7	Confident	12 Å²	12	22.6 Å²	22.6	6%	0.056	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.6	173.1	70	179.6	148.5	0	0	111.5	Y531 V659 P703 S705 Y731 E732 L734	Y531-E657 HydrophobicContact CD1-CB 3.99Å; Y531-E657 HydrophobicContact CE1-CB 3.79Å; E657-V659 PolarHBondContact O-N 3.4Å; E657-P703 WeakPolarHBondContact OE2-CB 3.09Å; E657-S705 PolarHBondContact OE2-OG 3.13Å; E657-Y731 WeakPolarHBondContact O-CA 3.38Å; E657-E732 PolarHBondContact N-O 3.27Å; E657-E732 PolarHBondContact O-N 2.99Å; E657-L734 HydrophobicContact CB-CD1 4.09Å; E657-L734 HydrophobicContact CB-CD2 4.23Å; E657-L734 HydrophobicContact CB-CG 3.99Å; E657-L734 HydrophobicContact CG-CD2 3.93Å; E657-L734 HydrophobicContact CG-CG 4.01Å; E657-L734 WeakPolarHBondContact OE1-CD2 3.47Å
658	P	87.8	Confident	87	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.8	175	25.7	-28.9	0	0	0	110	I529 L704 F728 Y731	I529-P658 HydrophobicContact CG2-CG 3.58Å; P658-L704 HydrophobicContact CB-CD2 4.47Å; P658-L704 HydrophobicContact CG-CB 3.97Å; P658-L704 HydrophobicContact CG-CD2 3.8Å; P658-L704 WeakPolarHBondContact O-CB 3.46Å; P658-L704 PolarHBondContact O-N 3.42Å; P658-F728 HydrophobicContact CB-CD2 4.19Å; P658-F728 HydrophobicContact CB-CE2 3.99Å; P658-Y731 HydrophobicContact CB-CD1 4.22Å; P658-Y731 HydrophobicContact CB-CE1 3.71Å; P658-Y731 HydrophobicContact CG-CE1 4.15Å
659	V	88	Confident	86.5	Confident	1 Å²	1	36 Å²	36	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.6	176.6	173.8	0	0	0	0	108.9	E657 V701 V729 R730 E732	E657-V659 PolarHBondContact O-N 3.4Å; V659-V701 HydrophobicContact CG1-CG1 3.08Å; V659-V729 PolarHBondContact O-N 3.36Å; V659-R730 WeakPolarHBondContact CA-O 3.38Å; V659-R730 HydrophobicContact CB-CG 4.47Å; V659-R730 WeakPolarHBondContact CB-O 3.49Å; V659-R730 PolarHBondContact N-O 2.87Å; V659-R730 PolarHBondContact O-N 3.42Å; V659-E732 HydrophobicContact CB-CG 4.3Å; V659-E732 HydrophobicContact CG2-CB 3.69Å; V659-E732 HydrophobicContact CG2-CG 3.59Å
660	I	86.6	Confident	86.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.3	-176.7	55.6	165.1	0	0	0	110.9	V701 A702 L704 M707 I726 S727	I660-V701 CarbonylContact O-C 3.59Å; I660-V701 WeakPolarHBondContact O-CA 3.09Å; I660-A702 HydrophobicContact CG1-CB 4.48Å; I660-A702 WeakPolarHBondContact CG1-O 3.37Å; I660-A702 PolarHBondContact N-O 3.24Å; I660-A702 PolarHBondContact O-N 3.29Å; I660-L704 HydrophobicContact CD1-CD1 3.96Å; I660-L704 HydrophobicContact CG2-CB 4.48Å; I660-L704 HydrophobicContact CG2-CD1 4.24Å; I660-M707 HydrophobicContact CD1-CB 4.11Å; I660-M707 HydrophobicContact CD1-CG 3.91Å; I660-I726 HydrophobicContact CB-CG2 3.82Å; I660-I726 HydrophobicContact CD1-CB 4.38Å; I660-I726 HydrophobicContact CD1-CD1 3.8Å; I660-I726 HydrophobicContact CD1-CG1 3.94Å; I660-I726 HydrophobicContact CD1-CG2 3.59Å; I660-I726 HydrophobicContact CG1-CG2 4.31Å; I660-I726 HydrophobicContact CG2-CG2 3.73Å; I660-S727 CarbonylContact C-O 3.59Å; I660-S727 WeakPolarHBondContact CA-O 3.38Å
661	E	85	Confident	85.7	Confident	62 Å²	62	26.7 Å²	26.7	29%	0.29	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	127.5	161.5	178.3	173.7	-154.9	0	0	107.3	V663 H699 I726 S727 V729	E661-V663 HydrophobicContact CG-CG2 4.34Å; E661-H699 IonicContact OE1-ND1 3.54Å; E661-I726 WeakPolarHBondContact O-CA 3.11Å; E661-S727 PolarHBondContact N-O 3.3Å; E661-S727 PolarHBondContact O-N 3.16Å; E661-V729 HydrophobicContact CB-CG2 3.39Å; E661-V729 VanDerWaalsContact N-CG2 3.27Å
662	L	86.1	Confident	85.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.1	178	-175.3	76.6	0	0	0	107.6	V664 L678 A700 M707 Y710 F724 R725 I726	L662-V664 HydrophobicContact CD1-CG2 4.32Å; L662-V664 HydrophobicContact CD2-CG2 3.34Å; L662-V664 HydrophobicContact CG-CG2 3.5Å; L662-V664 VanDerWaalsContact CG-CG2 3.5Å; L662-L678 HydrophobicContact CD2-CD2 3.44Å; L662-L678 VanDerWaalsContact CD2-CD2 3.44Å; L662-A700 PolarHBondContact N-O 2.92Å; L662-A700 PolarHBondContact O-N 3.45Å; L662-M707 HydrophobicContact CD2-CE 3.66Å; L662-Y710 HydrophobicContact CD1-CD1 4.22Å; L662-Y710 HydrophobicContact CD1-CE1 4Å; L662-Y710 HydrophobicContact CD2-CD1 4.44Å; L662-Y710 HydrophobicContact CD2-CE1 3.75Å; L662-Y710 HydrophobicContact CG-CE1 4.42Å; L662-F724 HydrophobicContact CD1-CB 3.97Å; L662-F724 HydrophobicContact CD1-CD2 3.56Å; L662-F724 HydrophobicContact CD1-CG 4.15Å; L662-R725 WeakPolarHBondContact CA-O 3.46Å; L662-I726 HydrophobicContact CD1-CD1 4.48Å; L662-I726 HydrophobicContact CD1-CG1 3.75Å
663	V	81.8	Confident	85.6	Confident	29 Å²	29	33.6 Å²	33.6	18%	0.176	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	107.7	169.5	-176.1	0	0	0	0	107.1	E661 I698 F724 R725	E661-V663 HydrophobicContact CG-CG2 4.34Å; V663-I698 WeakPolarHBondContact CA-O 3.14Å; V663-F724 CarbonylContact O-C 3.54Å; V663-F724 WeakPolarHBondContact O-CA 3.48Å; V663-R725 HydrophobicContact CB-CB 4.45Å; V663-R725 PolarHBondContact N-O 3.05Å; V663-R725 PolarHBondContact O-N 3.43Å
664	V	83.6	Confident	85.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.8	179.7	-159.4	0	0	0	0	109.1	L662 V666 V674 L678 C697 I698 Y710 L714 S723 F724	L662-V664 HydrophobicContact CD1-CG2 4.32Å; L662-V664 HydrophobicContact CD2-CG2 3.34Å; L662-V664 HydrophobicContact CG-CG2 3.5Å; L662-V664 VanDerWaalsContact CG-CG2 3.5Å; V664-V666 HydrophobicContact CG1-CG1 3.61Å; V664-V674 HydrophobicContact CG1-CG1 3.99Å; V664-L678 HydrophobicContact CG2-CD1 4.25Å; V664-C697 CarbonylContact O-C 3.53Å; V664-C697 WeakPolarHBondContact O-CA 3.48Å; V664-I698 HydrophobicContact CB-CB 4.28Å; V664-I698 PolarHBondContact N-O 2.82Å; V664-I698 PolarHBondContact O-N 3.45Å; V664-Y710 HydrophobicContact CG2-CE1 4.31Å; V664-Y710 WeakPolarHBondContact CG2-OH 3.24Å; V664-L714 HydrophobicContact CG1-CD1 3.71Å; V664-L714 HydrophobicContact CG1-CD2 3.9Å; V664-L714 HydrophobicContact CG1-CG 4.49Å; V664-S723 CarbonylContact C-O 3.49Å; V664-S723 WeakPolarHBondContact CA-O 3.17Å; V664-S723 WeakPolarHBondContact CG1-O 3.17Å; V664-F724 HydrophobicContact CB-CB 4.5Å; V664-F724 HydrophobicContact CG1-CB 4.2Å; V664-F724 HydrophobicContact CG2-CB 4.29Å
665	T	75.6	Confident	85.4	Confident	13 Å²	13	33.7 Å²	33.7	8%	0.08	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.3	175	-55.2	0	0	0	0	108.8	V152 L695 N696 C697 G722 S723	V152-T665 HydrophobicContact CG2-CG2 3.76Å; T665-L695 HydrophobicContact CG2-CB 4.13Å; T665-L695 HydrophobicContact CG2-CD1 4.34Å; T665-N696 WeakPolarHBondContact CA-O 3.2Å; T665-C697 PolarHBondContact OG1-SG 3.22Å; T665-C697 VanDerWaalsContact OG1-SG 3.37Å; T665-G722 WeakPolarHBondContact O-CA 3.48Å; T665-S723 PolarHBondContact N-O 2.85Å; T665-S723 PolarHBondContact O-N 3.33Å
666	V	81.7	Confident	85.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	149.7	-173.7	-58.8	0	0	0	0	111.1	V664 V674 L695 N696 I698 L714 T718	V664-V666 HydrophobicContact CG1-CG1 3.61Å; V666-V674 HydrophobicContact CB-CG2 4.41Å; V666-V674 HydrophobicContact CG1-CG1 4.29Å; V666-V674 HydrophobicContact CG1-CG2 3.92Å; V666-V674 HydrophobicContact CG2-CG2 4.4Å; V666-L695 CarbonylContact O-C 3.57Å; V666-L695 WeakPolarHBondContact O-CA 3.39Å; V666-N696 PolarHBondContact N-O 3.29Å; V666-N696 PolarHBondContact O-N 3.45Å; V666-I698 HydrophobicContact CG2-CD1 4.06Å; V666-L714 HydrophobicContact CG1-CD1 4.11Å; V666-T718 HydrophobicContact CB-CG2 4.36Å; V666-T718 HydrophobicContact CG1-CG2 3.93Å
667	P	72.5	Confident	85.4	Confident	17 Å²	17	38.4 Å²	38.4	11%	0.11	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	150.3	169.7	-26.4	36.7	0	0	0	112.6	E669 H670 S671 Q694 L695 T721	P667-E669 HydrophobicContact CB-CG 3.93Å; P667-E669 PolarHBondContact O-N 2.98Å; P667-H670 PolarHBondContact O-N 3.43Å; P667-S671 PolarHBondContact O-N 3.35Å; P667-S671 PolarHBondContact O-OG 3.14Å; P667-S671 VanDerWaalsContact O-OG 3.09Å; P667-Q694 WeakPolarHBondContact CA-O 3.43Å; P667-L695 HydrophobicContact CB-CD2 4.49Å; P667-L695 HydrophobicContact CG-CD2 4.06Å; P667-T721 WeakPolarHBondContact CD-OG1 3.48Å; P667-T721 WeakPolarHBondContact CG-OG1 3.49Å
668	E	79.2	Confident	85.5	Confident	128 Å²	128	37.8 Å²	37.8	60%	0.598	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-52.9	-42.1	-179.9	-172.3	179.5	175.3	0	0	112.2	H670 S671 Q694	E668-H670 VanDerWaalsContact C-N 3.27Å; E668-H670 PolarHBondContact O-N 3.42Å; E668-S671 WeakPolarHBondContact CA-OG 3.35Å; E668-S671 VanDerWaalsContact O-CB 3.3Å; E668-S671 WeakPolarHBondContact O-CB 3.37Å; E668-S671 PolarHBondContact O-N 3.2Å; E668-S671 VanDerWaalsContact O-N 3.16Å; E668-S671 PolarHBondContact O-OG 3.05Å; E668-Q694 PolarHBondContact N-O 3.27Å
669	E	81.2	Confident	85.6	Confident	155 Å²	155	41 Å²	41	72%	0.724	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-59.9	-30.2	179.4	61	-172.6	177.4	0	0	114.4	P667	P667-E669 HydrophobicContact CB-CG 3.93Å; P667-E669 PolarHBondContact O-N 2.98Å
670	H	83.7	Confident	85.7	Confident	42 Å²	42	46.1 Å²	46.1	19%	0.194	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-98.9	-6.3	-179	-64.5	-59	0	0	0	113.3	P667 E668 H672 G673 V674 L717 T718	P667-H670 PolarHBondContact O-N 3.43Å; E668-H670 VanDerWaalsContact C-N 3.27Å; E668-H670 PolarHBondContact O-N 3.42Å; H670-H672 VanDerWaalsContact C-N 3.26Å; H670-H672 PolarHBondContact O-N 3.04Å; H670-G673 PolarHBondContact O-N 3.4Å; H670-V674 WeakPolarHBondContact O-CG2 3.41Å; H670-V674 PolarHBondContact O-N 2.57Å; H670-L717 PolarHBondContact ND1-O 3.13Å; H670-T718 HydrophobicContact CB-CG2 4.05Å
671	S	86.2	Confident	85.7	Confident	6 Å²	6	48 Å²	48	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-56.7	-39.6	-174.7	-64.9	0	0	0	0	112.5	P667 E668 V674 L675 N696	P667-S671 PolarHBondContact O-N 3.35Å; P667-S671 PolarHBondContact O-OG 3.14Å; P667-S671 VanDerWaalsContact O-OG 3.09Å; E668-S671 WeakPolarHBondContact CA-OG 3.35Å; E668-S671 VanDerWaalsContact O-CB 3.3Å; E668-S671 WeakPolarHBondContact O-CB 3.37Å; E668-S671 PolarHBondContact O-N 3.2Å; E668-S671 VanDerWaalsContact O-N 3.16Å; E668-S671 PolarHBondContact O-OG 3.05Å; S671-V674 PolarHBondContact O-N 3.44Å; S671-L675 WeakPolarHBondContact O-CB 3.39Å; S671-L675 VanDerWaalsContact O-CG 3.29Å; S671-L675 WeakPolarHBondContact O-CG 3.46Å; S671-L675 PolarHBondContact O-N 3.28Å; S671-N696 PolarHBondContact OG-ND2 3.07Å
672	H	88.8	Confident	85.7	Confident	156 Å²	156	47 Å²	47	72%	0.722	27%	0.274	S	S	*	.	H	α-helix	trans	-65.6	-44.5	-180	-175.1	70.2	0	0	0	113	H670 V674 L675 S676	H670-H672 VanDerWaalsContact C-N 3.26Å; H670-H672 PolarHBondContact O-N 3.04Å; H672-V674 VanDerWaalsContact C-N 3.28Å; H672-V674 PolarHBondContact O-N 2.84Å; H672-L675 PolarHBondContact O-N 2.95Å; H672-S676 PolarHBondContact O-N 2.85Å
673	G	90.6	Very high	85.7	Confident	31 Å²	31	47.7 Å²	47.7	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-62.9	-38.3	178.9	0	0	0	0	0	112	H670 S676 D677	H670-G673 PolarHBondContact O-N 3.4Å; G673-S676 PolarHBondContact O-N 3.18Å; G673-D677 PolarHBondContact O-N 2.88Å
674	V	89.9	Confident	86	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-70.8	-44.4	179	176.7	0	0	0	0	111.1	V664 V666 H670 S671 H672 S676 D677 L678 I698 L714 T718	V664-V674 HydrophobicContact CG1-CG1 3.99Å; V666-V674 HydrophobicContact CB-CG2 4.41Å; V666-V674 HydrophobicContact CG1-CG1 4.29Å; V666-V674 HydrophobicContact CG1-CG2 3.92Å; V666-V674 HydrophobicContact CG2-CG2 4.4Å; H670-V674 WeakPolarHBondContact O-CG2 3.41Å; H670-V674 PolarHBondContact O-N 2.57Å; S671-V674 PolarHBondContact O-N 3.44Å; H672-V674 VanDerWaalsContact C-N 3.28Å; H672-V674 PolarHBondContact O-N 2.84Å; V674-S676 VanDerWaalsContact C-N 3.28Å; V674-S676 PolarHBondContact O-N 3.18Å; V674-D677 PolarHBondContact O-N 3.33Å; V674-L678 HydrophobicContact CG1-CD1 4.13Å; V674-L678 HydrophobicContact CG1-CG 4.39Å; V674-L678 WeakPolarHBondContact O-CB 3.08Å; V674-L678 VanDerWaalsContact O-CG 3.26Å; V674-L678 WeakPolarHBondContact O-CG 3.39Å; V674-L678 PolarHBondContact O-N 2.62Å; V674-I698 HydrophobicContact CB-CD1 4.28Å; V674-I698 HydrophobicContact CG1-CD1 3.82Å; V674-L714 HydrophobicContact CG1-CD1 4.12Å; V674-L714 HydrophobicContact CG2-CD1 3.91Å; V674-T718 HydrophobicContact CG2-CG2 3.73Å
675	L	91.7	Very high	86.3	Confident	53 Å²	53	56.1 Å²	56.1	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-38.4	174.6	-74.5	170.7	0	0	0	112.1	S671 H672 A679 V685 F688 I698	S671-L675 WeakPolarHBondContact O-CB 3.39Å; S671-L675 VanDerWaalsContact O-CG 3.29Å; S671-L675 WeakPolarHBondContact O-CG 3.46Å; S671-L675 PolarHBondContact O-N 3.28Å; H672-L675 PolarHBondContact O-N 2.95Å; L675-A679 WeakPolarHBondContact O-CB 3.42Å; L675-A679 PolarHBondContact O-N 3.22Å; L675-V685 HydrophobicContact CD2-CG2 3.97Å; L675-F688 HydrophobicContact CD1-CD2 4.39Å; L675-F688 HydrophobicContact CD1-CE2 4.03Å; L675-F688 HydrophobicContact CD2-CD2 4.39Å; L675-I698 HydrophobicContact CD2-CD1 3.91Å; L675-I698 HydrophobicContact CD2-CG1 4.49Å; L675-I698 HydrophobicContact CD2-CG2 3.83Å; L675-I698 HydrophobicContact CG-CD1 3.94Å
676	S	91.3	Very high	86.8	Confident	66 Å²	66	60.9 Å²	60.9	46%	0.462	35%	0.345	S	S	.	.	H	α-helix	trans	-66.2	-43.2	175.9	-172.3	0	0	0	0	112.2	H672 G673 V674 A679 C680	H672-S676 PolarHBondContact O-N 2.85Å; G673-S676 PolarHBondContact O-N 3.18Å; V674-S676 VanDerWaalsContact C-N 3.28Å; V674-S676 PolarHBondContact O-N 3.18Å; S676-A679 PolarHBondContact O-N 3.35Å; S676-C680 PolarHBondContact O-N 3.25Å; S676-C680 PolarHBondContact O-SG 3.46Å; S676-C680 VanDerWaalsContact O-SG 3.35Å
677	D	92.5	Very high	87	Confident	35 Å²	35	64.6 Å²	64.6	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-64	-43.5	176.9	-176.4	71.3	0	0	0	111.3	G673 V674 A679 C680 R681 Y710 L717	G673-D677 PolarHBondContact O-N 2.88Å; V674-D677 PolarHBondContact O-N 3.33Å; D677-A679 VanDerWaalsContact C-N 3.34Å; D677-A679 PolarHBondContact O-N 3.19Å; D677-C680 WeakPolarHBondContact O-CB 3.5Å; D677-C680 PolarHBondContact O-N 2.91Å; D677-R681 WeakPolarHBondContact O-CG 3.4Å; D677-R681 PolarHBondContact O-N 3.31Å; D677-R681 IonicContact OD1-NE 2.7Å; D677-R681 IonicContact OD1-NH2 3.01Å; D677-R681 IonicContact OD2-CZ 3.58Å; D677-R681 IonicContact OD2-NE 3.85Å; D677-R681 PolarHBondContact OD2-NE 2.86Å; D677-R681 IonicContact OD2-NH2 3.58Å; D677-Y710 WeakPolarHBondContact OD2-CE2 3.29Å; D677-L717 HydrophobicContact CB-CD1 3.58Å
678	L	91.5	Very high	87.6	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-58.4	-43.1	174.5	-76.7	-177.4	0	0	0	112.3	L662 V664 V674 R681 G682 S683 I698 A700 M707 Y710	L662-L678 HydrophobicContact CD2-CD2 3.44Å; L662-L678 VanDerWaalsContact CD2-CD2 3.44Å; V664-L678 HydrophobicContact CG2-CD1 4.25Å; V674-L678 HydrophobicContact CG1-CD1 4.13Å; V674-L678 HydrophobicContact CG1-CG 4.39Å; V674-L678 WeakPolarHBondContact O-CB 3.08Å; V674-L678 VanDerWaalsContact O-CG 3.26Å; V674-L678 WeakPolarHBondContact O-CG 3.39Å; V674-L678 PolarHBondContact O-N 2.62Å; L678-R681 PolarHBondContact O-N 3.01Å; L678-G682 PolarHBondContact O-N 3.34Å; L678-S683 WeakPolarHBondContact CA-OG 3.36Å; L678-S683 VanDerWaalsContact CB-OG 3.25Å; L678-S683 WeakPolarHBondContact CB-OG 3.42Å; L678-S683 WeakPolarHBondContact O-CB 3.38Å; L678-S683 PolarHBondContact O-N 2.83Å; L678-S683 PolarHBondContact O-OG 3.5Å; L678-I698 HydrophobicContact CD1-CG2 3.85Å; L678-A700 HydrophobicContact CD1-CB 4.34Å; L678-M707 HydrophobicContact CD2-CE 3.82Å; L678-Y710 HydrophobicContact CD2-CE2 4.03Å
679	A	90.6	Very high	87.5	Confident	68 Å²	68	65.2 Å²	65.2	56%	0.562	37%	0.365	S	S	*	.	H	α-helix	trans	-64.9	-42.1	175.4	0	0	0	0	0	111.9	L675 S676 D677 R681 G682	L675-A679 WeakPolarHBondContact O-CB 3.42Å; L675-A679 PolarHBondContact O-N 3.22Å; S676-A679 PolarHBondContact O-N 3.35Å; D677-A679 VanDerWaalsContact C-N 3.34Å; D677-A679 PolarHBondContact O-N 3.19Å; A679-R681 PolarHBondContact O-N 2.87Å; A679-G682 PolarHBondContact O-N 2.88Å
680	C	89.7	Confident	87	Confident	107 Å²	107	63.7 Å²	63.7	72%	0.723	36%	0.361	S	S	*	.	H	α-helix	trans	-61.3	-33.2	175.5	-74.5	0	0	0	0	112.7	S676 D677 G682	S676-C680 PolarHBondContact O-N 3.25Å; S676-C680 PolarHBondContact O-SG 3.46Å; S676-C680 VanDerWaalsContact O-SG 3.35Å; D677-C680 WeakPolarHBondContact O-CB 3.5Å; D677-C680 PolarHBondContact O-N 2.91Å; C680-G682 PolarHBondContact O-N 3.39Å
681	R	87.6	Confident	85.9	Confident	41 Å²	41	64.4 Å²	64.4	16%	0.155	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-1.2	175.4	-68.6	176.5	-172.4	-95.6	0.7	113.5	D677 L678 A679 S683 K706 A708 A713	D677-R681 WeakPolarHBondContact O-CG 3.4Å; D677-R681 PolarHBondContact O-N 3.31Å; D677-R681 IonicContact OD1-NE 2.7Å; D677-R681 IonicContact OD1-NH2 3.01Å; D677-R681 IonicContact OD2-CZ 3.58Å; D677-R681 IonicContact OD2-NE 3.85Å; D677-R681 PolarHBondContact OD2-NE 2.86Å; D677-R681 IonicContact OD2-NH2 3.58Å; L678-R681 PolarHBondContact O-N 3.01Å; A679-R681 PolarHBondContact O-N 2.87Å; R681-S683 VanDerWaalsContact C-N 3.34Å; R681-K706 HydrophobicContact CB-CB 4.08Å; R681-K706 WeakPolarHBondContact CD-O 3.22Å; R681-K706 PolarHBondContact NH1-O 3.11Å; R681-K706 VanDerWaalsContact O-CB 3.23Å; R681-K706 WeakPolarHBondContact O-CB 3.49Å; R681-K706 VanDerWaalsContact O-CG 3.3Å; R681-K706 WeakPolarHBondContact O-CG 3.39Å; R681-A708 PolarHBondContact NH1-O 3.47Å; R681-A713 VanDerWaalsContact NH2-CB 3.29Å
682	G	83.7	Confident	84.3	Confident	41 Å²	41	73.6 Å²	73.6	42%	0.423	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	27.6	-179.7	0	0	0	0	0	113.3	L678 A679 C680	L678-G682 PolarHBondContact O-N 3.34Å; A679-G682 PolarHBondContact O-N 2.88Å; C680-G682 PolarHBondContact O-N 3.39Å
683	S	85.9	Confident	82.6	Confident	13 Å²	13	67.5 Å²	67.5	9%	0.091	39%	0.392	C	S	.	.			trans	-81	151.6	174.5	70.7	0	0	0	0	112	L678 R681 V701	L678-S683 WeakPolarHBondContact CA-OG 3.36Å; L678-S683 VanDerWaalsContact CB-OG 3.25Å; L678-S683 WeakPolarHBondContact CB-OG 3.42Å; L678-S683 WeakPolarHBondContact O-CB 3.38Å; L678-S683 PolarHBondContact O-N 2.83Å; L678-S683 PolarHBondContact O-OG 3.5Å; R681-S683 VanDerWaalsContact C-N 3.34Å; S683-V701 CarbonylContact C-O 3.36Å; S683-V701 VanDerWaalsContact CA-O 3.25Å; S683-V701 WeakPolarHBondContact CA-O 3.41Å; S683-V701 WeakPolarHBondContact CB-O 3.37Å
684	H	89.2	Confident	81.5	Confident	137 Å²	137	73.6 Å²	73.6	63%	0.634	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.7	175	-65.9	-66.1	0	0	0	109.3	L686 A700 V701	H684-L686 PolarHBondContact O-N 3.23Å; H684-A700 CarbonylContact O-C 3.57Å; H684-A700 WeakPolarHBondContact O-CA 3.48Å; H684-V701 PolarHBondContact N-O 2.93Å; H684-V701 PolarHBondContact O-N 2.71Å
685	V	89.4	Confident	80.5	Confident	69 Å²	69	75.7 Å²	75.7	42%	0.418	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	117.5	175.3	-177.7	0	0	0	0	108.7	L675 I698 H699 A700	L675-V685 HydrophobicContact CD2-CG2 3.97Å; V685-I698 HydrophobicContact CG1-CG2 4.04Å; V685-I698 HydrophobicContact CG2-CG2 4.33Å; V685-H699 CarbonylContact C-O 3.59Å; V685-A700 HydrophobicContact CG2-CB 4.39Å
686	L	86.6	Confident	79.8	Confident	114 Å²	114	73.5 Å²	73.5	60%	0.597	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	-48.6	177	-65.7	-177.8	0	0	0	111.4	H684 H699 V701	H684-L686 PolarHBondContact O-N 3.23Å; L686-H699 HydrophobicContact CB-CB 4.42Å; L686-H699 PolarHBondContact N-O 3.23Å; L686-V701 HydrophobicContact CD1-CG2 3.46Å; L686-V701 VanDerWaalsContact CD1-CG2 3.46Å; L686-V701 HydrophobicContact CD2-CG2 4.08Å; L686-V701 HydrophobicContact CG-CG2 3.75Å
687	N	85.8	Confident	79.3	Confident	77 Å²	77	71.3 Å²	71.3	41%	0.412	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	148.5	-177	-163.5	14.1	0	0	0	110.4	E689 H699	N687-E689 WeakPolarHBondContact ND2-CG 2.99Å; N687-E689 PolarHBondContact ND2-OE1 2.87Å; N687-H699 HydrophobicContact CB-CB 4.08Å; N687-H699 PolarHBondContact N-O 3.37Å; N687-H699 PolarHBondContact O-N 2.96Å
688	F	84.9	Confident	79.1	Confident	69 Å²	69	69.6 Å²	69.6	30%	0.303	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	99.9	172.5	-173.5	-95.3	0	0	0	107.6	L675 L690 N696 I698	L675-F688 HydrophobicContact CD1-CD2 4.39Å; L675-F688 HydrophobicContact CD1-CE2 4.03Å; L675-F688 HydrophobicContact CD2-CD2 4.39Å; F688-L690 HydrophobicContact CD1-CD2 4.27Å; F688-L690 HydrophobicContact CD1-CG 4.05Å; F688-L690 HydrophobicContact CE1-CD2 3.57Å; F688-L690 HydrophobicContact CE1-CG 3.86Å; F688-L690 PolarHBondContact O-N 3.3Å; F688-N696 HydrophobicContact CE1-CB 4.24Å; F688-N696 HydrophobicContact CE2-CB 3.99Å; F688-N696 HydrophobicContact CZ-CB 3.6Å; F688-N696 WeakPolarHBondContact CZ-ND2 3.44Å; F688-I698 HydrophobicContact CD2-CB 4.48Å; F688-I698 HydrophobicContact CD2-CD1 4.45Å; F688-I698 HydrophobicContact CD2-CG1 3.76Å; F688-I698 HydrophobicContact CE2-CD1 4.06Å; F688-I698 HydrophobicContact CE2-CG1 3.67Å
689	E	77.3	Confident	78.9	Confident	89 Å²	89	71.4 Å²	71.4	42%	0.416	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	105.1	-178.5	-64.3	-176.2	-178.4	0	0	108.9	N687 S691 C697 H699	N687-E689 WeakPolarHBondContact ND2-CG 2.99Å; N687-E689 PolarHBondContact ND2-OE1 2.87Å; E689-S691 PolarHBondContact O-N 3.48Å; E689-C697 HydrophobicContact CB-CB 4.19Å; E689-C697 PolarHBondContact N-O 3.14Å; E689-C697 PolarHBondContact O-N 3.07Å; E689-H699 IonicContact OE1-NE2 2.82Å; E689-H699 IonicContact OE2-NE2 3.72Å
690	L	70.9	Confident	78.9	Confident	124 Å²	124	68.1 Å²	68.1	65%	0.649	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	100.1	165.2	-70.1	162.9	0	0	0	107.2	F688	F688-L690 HydrophobicContact CD1-CD2 4.27Å; F688-L690 HydrophobicContact CD1-CG 4.05Å; F688-L690 HydrophobicContact CE1-CD2 3.57Å; F688-L690 HydrophobicContact CE1-CG 3.86Å; F688-L690 PolarHBondContact O-N 3.3Å
691	S	60	Low	79	Confident	56 Å²	56	63.8 Å²	63.8	39%	0.392	34%	0.339	S	S	.	.			trans	-79	140.6	169.3	-60	0	0	0	0	108.8	E689 G693 L695	E689-S691 PolarHBondContact O-N 3.48Å; S691-G693 PolarHBondContact O-N 3.28Å; S691-L695 VanDerWaalsContact CB-O 3.29Å; S691-L695 WeakPolarHBondContact CB-O 3.39Å
692	E	53.3	Low	79.1	Confident	200 Å²	200	61.9 Å²	61.9	94%	0.935	33%	0.331	S	S	*	.	S	Bend	trans	-59.5	-16.2	178	-67	-175	160.4	0	0	112.8
693	G	52.8	Low	79.4	Confident	27 Å²	27	60.8 Å²	60.8	28%	0.278	32%	0.317	S	S	.	.	S	Bend	trans	-103.6	74.1	178.3	0	0	0	0	0	114.7	S691 L695	S691-G693 PolarHBondContact O-N 3.28Å; G693-L695 PolarHBondContact O-N 2.98Å
694	Q	66.5	Low	79.4	Confident	160 Å²	160	60.3 Å²	60.3	75%	0.748	31%	0.313	S	S	*	.	S	Bend	trans	46.7	-2	164.6	-66.6	-173.3	-12.2	0	0	119.6	P667 E668	P667-Q694 WeakPolarHBondContact CA-O 3.43Å; E668-Q694 PolarHBondContact N-O 3.27Å
695	L	68.5	Low	79.2	Confident	44 Å²	44	55.5 Å²	55.5	23%	0.23	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.4	-178.5	-65.6	173.6	0	0	0	107.6	T665 V666 P667 S691 G693	T665-L695 HydrophobicContact CG2-CB 4.13Å; T665-L695 HydrophobicContact CG2-CD1 4.34Å; V666-L695 CarbonylContact O-C 3.57Å; V666-L695 WeakPolarHBondContact O-CA 3.39Å; P667-L695 HydrophobicContact CB-CD2 4.49Å; P667-L695 HydrophobicContact CG-CD2 4.06Å; S691-L695 VanDerWaalsContact CB-O 3.29Å; S691-L695 WeakPolarHBondContact CB-O 3.39Å; G693-L695 PolarHBondContact O-N 2.98Å
696	N	77.7	Confident	79	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.032	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135	173.5	-65.5	-26.4	0	0	0	109.1	T665 V666 S671 F688	T665-N696 WeakPolarHBondContact CA-O 3.2Å; V666-N696 PolarHBondContact N-O 3.29Å; V666-N696 PolarHBondContact O-N 3.45Å; S671-N696 PolarHBondContact OG-ND2 3.07Å; F688-N696 HydrophobicContact CE1-CB 4.24Å; F688-N696 HydrophobicContact CE2-CB 3.99Å; F688-N696 HydrophobicContact CZ-CB 3.6Å; F688-N696 WeakPolarHBondContact CZ-ND2 3.44Å
697	C	80.7	Confident	78.9	Confident	20 Å²	20	52.3 Å²	52.3	14%	0.135	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.9	173	-73.8	0	0	0	0	109.1	V664 T665 E689	V664-C697 CarbonylContact O-C 3.53Å; V664-C697 WeakPolarHBondContact O-CA 3.48Å; T665-C697 PolarHBondContact OG1-SG 3.22Å; T665-C697 VanDerWaalsContact OG1-SG 3.37Å; E689-C697 HydrophobicContact CB-CB 4.19Å; E689-C697 PolarHBondContact N-O 3.14Å; E689-C697 PolarHBondContact O-N 3.07Å
698	I	87.6	Confident	78.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111.3	179.2	-48.3	178.4	0	0	0	107.4	V663 V664 V666 V674 L675 L678 V685 F688	V663-I698 WeakPolarHBondContact CA-O 3.14Å; V664-I698 HydrophobicContact CB-CB 4.28Å; V664-I698 PolarHBondContact N-O 2.82Å; V664-I698 PolarHBondContact O-N 3.45Å; V666-I698 HydrophobicContact CG2-CD1 4.06Å; V674-I698 HydrophobicContact CB-CD1 4.28Å; V674-I698 HydrophobicContact CG1-CD1 3.82Å; L675-I698 HydrophobicContact CD2-CD1 3.91Å; L675-I698 HydrophobicContact CD2-CG1 4.49Å; L675-I698 HydrophobicContact CD2-CG2 3.83Å; L675-I698 HydrophobicContact CG-CD1 3.94Å; L678-I698 HydrophobicContact CD1-CG2 3.85Å; V685-I698 HydrophobicContact CG1-CG2 4.04Å; V685-I698 HydrophobicContact CG2-CG2 4.33Å; F688-I698 HydrophobicContact CD2-CB 4.48Å; F688-I698 HydrophobicContact CD2-CD1 4.45Å; F688-I698 HydrophobicContact CD2-CG1 3.76Å; F688-I698 HydrophobicContact CE2-CD1 4.06Å; F688-I698 HydrophobicContact CE2-CG1 3.67Å
699	H	87.6	Confident	78.1	Confident	37 Å²	37	53.5 Å²	53.5	17%	0.171	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.3	171.3	-66.8	-104.7	0	0	0	107.9	E661 V685 L686 N687 E689	E661-H699 IonicContact OE1-ND1 3.54Å; V685-H699 CarbonylContact C-O 3.59Å; L686-H699 HydrophobicContact CB-CB 4.42Å; L686-H699 PolarHBondContact N-O 3.23Å; N687-H699 HydrophobicContact CB-CB 4.08Å; N687-H699 PolarHBondContact N-O 3.37Å; N687-H699 PolarHBondContact O-N 2.96Å; E689-H699 IonicContact OE1-NE2 2.82Å; E689-H699 IonicContact OE2-NE2 3.72Å
700	A	90.7	Very high	78.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.4	-179.8	0	0	0	0	0	110.8	L662 L678 H684 V685	L662-A700 PolarHBondContact N-O 2.92Å; L662-A700 PolarHBondContact O-N 3.45Å; L678-A700 HydrophobicContact CD1-CB 4.34Å; H684-A700 CarbonylContact O-C 3.57Å; H684-A700 WeakPolarHBondContact O-CA 3.48Å; V685-A700 HydrophobicContact CG2-CB 4.39Å
701	V	91.6	Very high	78.4	Confident	16 Å²	16	45.2 Å²	45.2	10%	0.097	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.9	170.9	174	0	0	0	0	107.7	V659 I660 S683 H684 L686	V659-V701 HydrophobicContact CG1-CG1 3.08Å; I660-V701 CarbonylContact O-C 3.59Å; I660-V701 WeakPolarHBondContact O-CA 3.09Å; S683-V701 CarbonylContact C-O 3.36Å; S683-V701 VanDerWaalsContact CA-O 3.25Å; S683-V701 WeakPolarHBondContact CA-O 3.41Å; S683-V701 WeakPolarHBondContact CB-O 3.37Å; H684-V701 PolarHBondContact N-O 2.93Å; H684-V701 PolarHBondContact O-N 2.71Å; L686-V701 HydrophobicContact CD1-CG2 3.46Å; L686-V701 VanDerWaalsContact CD1-CG2 3.46Å; L686-V701 HydrophobicContact CD2-CG2 4.08Å; L686-V701 HydrophobicContact CG-CG2 3.75Å
702	A	90.2	Very high	79.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.8	-176.2	0	0	0	0	0	112.4	I660 L704 M707	I660-A702 HydrophobicContact CG1-CB 4.48Å; I660-A702 WeakPolarHBondContact CG1-O 3.37Å; I660-A702 PolarHBondContact N-O 3.24Å; I660-A702 PolarHBondContact O-N 3.29Å; A702-L704 PolarHBondContact O-N 2.95Å; A702-M707 HydrophobicContact CB-CE 3.15Å; A702-M707 HydrophobicContact CB-CG 4.11Å; A702-M707 HydrophobicContact CB-SD 4.48Å
703	P	89.7	Confident	80.6	Confident	18 Å²	18	38.2 Å²	38.2	12%	0.117	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	131.4	166.6	-17.6	31	0	0	0	110.8	E657 S705 K706	E657-P703 WeakPolarHBondContact OE2-CB 3.09Å; P703-S705 PolarHBondContact O-N 3.2Å; P703-K706 PolarHBondContact O-N 3.43Å
704	L	86.5	Confident	82	Confident	3 Å²	3	37 Å²	37	2%	0.016	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-59.4	-31	177.7	-174.6	65.1	0	0	0	111.9	V456 I529 P658 I660 A702 K706 M707	V456-L704 HydrophobicContact CB-CD2 3.7Å; V456-L704 HydrophobicContact CG1-CD2 4.43Å; V456-L704 HydrophobicContact CG2-CD2 4.4Å; I529-L704 HydrophobicContact CD1-CG 4.46Å; I529-L704 HydrophobicContact CG1-CD2 4.36Å; I529-L704 HydrophobicContact CG1-CG 4.48Å; I529-L704 HydrophobicContact CG2-CD2 4.23Å; P658-L704 HydrophobicContact CB-CD2 4.47Å; P658-L704 HydrophobicContact CG-CB 3.97Å; P658-L704 HydrophobicContact CG-CD2 3.8Å; P658-L704 WeakPolarHBondContact O-CB 3.46Å; P658-L704 PolarHBondContact O-N 3.42Å; I660-L704 HydrophobicContact CD1-CD1 3.96Å; I660-L704 HydrophobicContact CG2-CB 4.48Å; I660-L704 HydrophobicContact CG2-CD1 4.24Å; A702-L704 PolarHBondContact O-N 2.95Å; L704-K706 PolarHBondContact O-N 3.1Å; L704-M707 PolarHBondContact O-N 2.95Å
705	S	85.2	Confident	82.3	Confident	37 Å²	37	37 Å²	37	26%	0.259	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-55.7	-22.7	176	64.5	0	0	0	0	114.6	E657 P703	E657-S705 PolarHBondContact OE2-OG 3.13Å; P703-S705 PolarHBondContact O-N 3.2Å
706	K	85.3	Confident	83	Confident	109 Å²	109	40.1 Å²	40.1	47%	0.474	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-103.7	0.6	178.9	-62	-66	-174.3	180	0	113.5	R681 P703 L704	R681-K706 HydrophobicContact CB-CB 4.08Å; R681-K706 WeakPolarHBondContact CD-O 3.22Å; R681-K706 PolarHBondContact NH1-O 3.11Å; R681-K706 VanDerWaalsContact O-CB 3.23Å; R681-K706 WeakPolarHBondContact O-CB 3.49Å; R681-K706 VanDerWaalsContact O-CG 3.3Å; R681-K706 WeakPolarHBondContact O-CG 3.39Å; P703-K706 PolarHBondContact O-N 3.43Å; L704-K706 PolarHBondContact O-N 3.1Å
707	M	83.7	Confident	83.4	Confident	6 Å²	6	43 Å²	43	3%	0.03	24%	0.24	C	C	.	.			trans	-107.3	7.9	-175.2	-68.2	-63.4	-171	0	0	114.1	I660 L662 L678 A702 L704 D709 Y710	I660-M707 HydrophobicContact CD1-CB 4.11Å; I660-M707 HydrophobicContact CD1-CG 3.91Å; L662-M707 HydrophobicContact CD2-CE 3.66Å; L678-M707 HydrophobicContact CD2-CE 3.82Å; A702-M707 HydrophobicContact CB-CE 3.15Å; A702-M707 HydrophobicContact CB-CG 4.11Å; A702-M707 HydrophobicContact CB-SD 4.48Å; L704-M707 PolarHBondContact O-N 2.95Å; M707-D709 PolarHBondContact O-N 3.1Å; M707-Y710 WeakPolarHBondContact O-CB 3.37Å; M707-Y710 PolarHBondContact O-N 2.95Å; M707-Y710 HydrophobicContact SD-CD1 4.35Å; M707-Y710 HydrophobicContact SD-CD2 3.73Å; M707-Y710 HydrophobicContact SD-CE2 4.3Å; M707-Y710 HydrophobicContact SD-CG 3.75Å
708	A	77.3	Confident	83.1	Confident	58 Å²	58	42 Å²	42	48%	0.479	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	133.8	163.9	0	0	0	0	0	110.1	R681 Y710	R681-A708 PolarHBondContact NH1-O 3.47Å; A708-Y710 PolarHBondContact O-N 2.7Å; A708-Y710 VanDerWaalsContact O-N 3.12Å
709	D	77.1	Confident	82.5	Confident	114 Å²	114	46.7 Å²	46.7	61%	0.61	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	18.9	-179.1	-53.8	-43.6	0	0	0	116.2	M707 A711 T712 A713	M707-D709 PolarHBondContact O-N 3.1Å; D709-A711 VanDerWaalsContact C-N 3.26Å; D709-A711 PolarHBondContact O-N 3.05Å; D709-T712 PolarHBondContact O-N 2.76Å; D709-T712 VanDerWaalsContact O-N 3.16Å; D709-A713 PolarHBondContact O-N 3.18Å; D709-A713 VanDerWaalsContact O-N 3.1Å
710	Y	83.7	Confident	81.3	Confident	3 Å²	3	47.4 Å²	47.4	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-34.9	-177.7	-174.9	-109.9	0	0	0	112.8	L662 V664 D677 L678 M707 A708 T712 A713 L714 F724	L662-Y710 HydrophobicContact CD1-CD1 4.22Å; L662-Y710 HydrophobicContact CD1-CE1 4Å; L662-Y710 HydrophobicContact CD2-CD1 4.44Å; L662-Y710 HydrophobicContact CD2-CE1 3.75Å; L662-Y710 HydrophobicContact CG-CE1 4.42Å; V664-Y710 HydrophobicContact CG2-CE1 4.31Å; V664-Y710 WeakPolarHBondContact CG2-OH 3.24Å; D677-Y710 WeakPolarHBondContact OD2-CE2 3.29Å; L678-Y710 HydrophobicContact CD2-CE2 4.03Å; M707-Y710 WeakPolarHBondContact O-CB 3.37Å; M707-Y710 PolarHBondContact O-N 2.95Å; M707-Y710 HydrophobicContact SD-CD1 4.35Å; M707-Y710 HydrophobicContact SD-CD2 3.73Å; M707-Y710 HydrophobicContact SD-CE2 4.3Å; M707-Y710 HydrophobicContact SD-CG 3.75Å; A708-Y710 PolarHBondContact O-N 2.7Å; A708-Y710 VanDerWaalsContact O-N 3.12Å; Y710-T712 VanDerWaalsContact C-N 3.32Å; Y710-T712 PolarHBondContact O-N 3.28Å; Y710-A713 PolarHBondContact O-N 3.09Å; Y710-L714 HydrophobicContact CE1-CB 4.31Å; Y710-L714 HydrophobicContact CE1-CD2 4.31Å; Y710-L714 WeakPolarHBondContact O-CB 3.39Å; Y710-L714 PolarHBondContact O-N 3.37Å; Y710-F724 HydrophobicContact CD1-CD1 4.16Å; Y710-F724 AromaticContact CD1-CD2 3.9Å; Y710-F724 HydrophobicContact CD1-CD2 3.9Å; Y710-F724 HydrophobicContact CD1-CE1 4.36Å; Y710-F724 HydrophobicContact CD1-CE2 4.1Å; Y710-F724 AromaticContact CD1-CG 3.93Å; Y710-F724 HydrophobicContact CD1-CG 3.93Å; Y710-F724 HydrophobicContact CD1-CZ 4.32Å; Y710-F724 HydrophobicContact CE1-CB 4.06Å; Y710-F724 HydrophobicContact CE1-CD1 4.26Å; Y710-F724 HydrophobicContact CE1-CD2 4.19Å; Y710-F724 AromaticContact CE1-CG 3.89Å; Y710-F724 HydrophobicContact CE1-CG 3.89Å
711	A	71.4	Confident	80.1	Confident	35 Å²	35	51.1 Å²	51.1	29%	0.289	31%	0.306	S	S	.	.	H	α-helix	trans	-58.2	-44.2	176.6	0	0	0	0	0	112.6	D709 R715 F724	D709-A711 VanDerWaalsContact C-N 3.26Å; D709-A711 PolarHBondContact O-N 3.05Å; A711-R715 WeakPolarHBondContact O-CB 3.48Å; A711-R715 VanDerWaalsContact O-CG 3.29Å; A711-R715 WeakPolarHBondContact O-CG 3.4Å; A711-R715 PolarHBondContact O-N 3.26Å; A711-F724 HydrophobicContact CB-CE1 3.62Å; A711-F724 HydrophobicContact CB-CZ 3.73Å
712	T	74.8	Confident	78.7	Confident	86 Å²	86	51 Å²	51	53%	0.528	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-46.6	178.5	-55.2	0	0	0	0	110.3	D709 Y710 L714 R715 T716	D709-T712 PolarHBondContact O-N 2.76Å; D709-T712 VanDerWaalsContact O-N 3.16Å; Y710-T712 VanDerWaalsContact C-N 3.32Å; Y710-T712 PolarHBondContact O-N 3.28Å; T712-L714 PolarHBondContact O-N 3.39Å; T712-R715 PolarHBondContact O-N 3.17Å; T712-T716 PolarHBondContact O-N 2.9Å; T712-T716 PolarHBondContact O-OG1 2.76Å; T712-T716 VanDerWaalsContact O-OG1 3.1Å
713	A	84.7	Confident	77.4	Confident	23 Å²	23	52.6 Å²	52.6	19%	0.19	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-45.8	177.9	0	0	0	0	0	112.4	R681 D709 Y710 T716 L717	R681-A713 VanDerWaalsContact NH2-CB 3.29Å; D709-A713 PolarHBondContact O-N 3.18Å; D709-A713 VanDerWaalsContact O-N 3.1Å; Y710-A713 PolarHBondContact O-N 3.09Å; A713-T716 PolarHBondContact O-N 3.43Å; A713-L717 WeakPolarHBondContact O-CG 3.37Å; A713-L717 PolarHBondContact O-N 3.33Å
714	L	81.2	Confident	76.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-48.4	177.8	-176.3	68.7	0	0	0	110.7	V664 V666 V674 Y710 T712 T716 L717 T718 F724	V664-L714 HydrophobicContact CG1-CD1 3.71Å; V664-L714 HydrophobicContact CG1-CD2 3.9Å; V664-L714 HydrophobicContact CG1-CG 4.49Å; V666-L714 HydrophobicContact CG1-CD1 4.11Å; V674-L714 HydrophobicContact CG1-CD1 4.12Å; V674-L714 HydrophobicContact CG2-CD1 3.91Å; Y710-L714 HydrophobicContact CE1-CB 4.31Å; Y710-L714 HydrophobicContact CE1-CD2 4.31Å; Y710-L714 WeakPolarHBondContact O-CB 3.39Å; Y710-L714 PolarHBondContact O-N 3.37Å; T712-L714 PolarHBondContact O-N 3.39Å; L714-T716 VanDerWaalsContact C-N 3.27Å; L714-T716 PolarHBondContact O-N 3.01Å; L714-L717 PolarHBondContact O-N 3.04Å; L714-L717 VanDerWaalsContact O-N 3.12Å; L714-T718 HydrophobicContact CD1-CG2 3.79Å; L714-T718 HydrophobicContact CG-CG2 4.28Å; L714-T718 WeakPolarHBondContact O-CG2 3.41Å; L714-T718 PolarHBondContact O-N 3.2Å; L714-T718 PolarHBondContact O-OG1 2.81Å; L714-F724 HydrophobicContact CD2-CB 3.98Å; L714-F724 HydrophobicContact CD2-CD1 3.54Å; L714-F724 HydrophobicContact CD2-CE1 4.5Å; L714-F724 HydrophobicContact CD2-CG 4.15Å
715	R	72.6	Confident	75.7	Confident	160 Å²	160	57.5 Å²	57.5	60%	0.604	34%	0.337	S	S	*	.	H	α-helix	trans	-57	-40.9	177.3	-76.8	175.4	-179.7	162.7	1.3	111.8	A711 T712 S719 G720	A711-R715 WeakPolarHBondContact O-CB 3.48Å; A711-R715 VanDerWaalsContact O-CG 3.29Å; A711-R715 WeakPolarHBondContact O-CG 3.4Å; A711-R715 PolarHBondContact O-N 3.26Å; T712-R715 PolarHBondContact O-N 3.17Å; R715-S719 CarbonylContact O-C 3.57Å; R715-S719 WeakPolarHBondContact O-CA 2.97Å; R715-S719 PolarHBondContact O-N 3.42Å; R715-G720 PolarHBondContact O-N 2.84Å
716	T	83.7	Confident	75.2	Confident	110 Å²	110	58.4 Å²	58.4	68%	0.675	34%	0.338	S	S	*	.	H	α-helix	trans	-65.3	-45.6	175.7	-56.3	0	0	0	0	111.9	T712 A713 L714 T718	T712-T716 PolarHBondContact O-N 2.9Å; T712-T716 PolarHBondContact O-OG1 2.76Å; T712-T716 VanDerWaalsContact O-OG1 3.1Å; A713-T716 PolarHBondContact O-N 3.43Å; L714-T716 VanDerWaalsContact C-N 3.27Å; L714-T716 PolarHBondContact O-N 3.01Å; T716-T718 PolarHBondContact O-N 2.89Å
717	L	86.7	Confident	74.4	Confident	65 Å²	65	55 Å²	55	34%	0.34	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-35.5	-178.3	-71.7	169.2	0	0	0	113.2	H670 D677 A713 L714	H670-L717 PolarHBondContact ND1-O 3.13Å; D677-L717 HydrophobicContact CB-CD1 3.58Å; A713-L717 WeakPolarHBondContact O-CG 3.37Å; A713-L717 PolarHBondContact O-N 3.33Å; L714-L717 PolarHBondContact O-N 3.04Å; L714-L717 VanDerWaalsContact O-N 3.12Å
718	T	74.3	Confident	74.1	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	9.7	-175.7	67.6	0	0	0	0	112.9	V666 H670 V674 L714 T716 G720 T721 G722	V666-T718 HydrophobicContact CB-CG2 4.36Å; V666-T718 HydrophobicContact CG1-CG2 3.93Å; H670-T718 HydrophobicContact CB-CG2 4.05Å; V674-T718 HydrophobicContact CG2-CG2 3.73Å; L714-T718 HydrophobicContact CD1-CG2 3.79Å; L714-T718 HydrophobicContact CG-CG2 4.28Å; L714-T718 WeakPolarHBondContact O-CG2 3.41Å; L714-T718 PolarHBondContact O-N 3.2Å; L714-T718 PolarHBondContact O-OG1 2.81Å; T716-T718 PolarHBondContact O-N 2.89Å; T718-G720 PolarHBondContact O-N 2.6Å; T718-G720 VanDerWaalsContact O-N 3.08Å; T718-T721 WeakPolarHBondContact O-CB 3.29Å; T718-T721 PolarHBondContact O-N 3.31Å; T718-T721 PolarHBondContact O-OG1 2.99Å; T718-T721 PolarHBondContact OG1-N 2.75Å; T718-G722 WeakPolarHBondContact OG1-CA 3.3Å; T718-G722 PolarHBondContact OG1-N 2.87Å
719	S	74.5	Confident	74.3	Confident	99 Å²	99	57.7 Å²	57.7	69%	0.692	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	36.9	-173.5	-61.4	0	0	0	0	113.3	R715 T721	R715-S719 CarbonylContact O-C 3.57Å; R715-S719 WeakPolarHBondContact O-CA 2.97Å; R715-S719 PolarHBondContact O-N 3.42Å; S719-T721 PolarHBondContact O-N 3.46Å
720	G	62.2	Low	74.6	Confident	52 Å²	52	58.4 Å²	58.4	54%	0.536	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-1.3	179.7	0	0	0	0	0	116.3	R715 T718	R715-G720 PolarHBondContact O-N 2.84Å; T718-G720 PolarHBondContact O-N 2.6Å; T718-G720 VanDerWaalsContact O-N 3.08Å
721	T	64.7	Low	74.8	Confident	78 Å²	78	59.1 Å²	59.1	48%	0.479	33%	0.331	S	S	.	.			trans	-85.9	-17.6	-176.7	62.2	0	0	0	0	115	P667 T718 S719	P667-T721 WeakPolarHBondContact CD-OG1 3.48Å; P667-T721 WeakPolarHBondContact CG-OG1 3.49Å; T718-T721 WeakPolarHBondContact O-CB 3.29Å; T718-T721 PolarHBondContact O-N 3.31Å; T718-T721 PolarHBondContact O-OG1 2.99Å; T718-T721 PolarHBondContact OG1-N 2.75Å; S719-T721 PolarHBondContact O-N 3.46Å
722	G	62.7	Low	75.6	Confident	12 Å²	12	60.3 Å²	60.3	12%	0.124	33%	0.331	C	S	.	.			trans	-83.5	145.6	179.5	0	0	0	0	0	112.4	T665 T718	T665-G722 WeakPolarHBondContact O-CA 3.48Å; T718-G722 WeakPolarHBondContact OG1-CA 3.3Å; T718-G722 PolarHBondContact OG1-N 2.87Å
723	S	62.6	Low	76.4	Confident	35 Å²	35	60.3 Å²	60.3	25%	0.245	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	158.1	173.3	61.4	0	0	0	0	109.9	V152 V664 T665	V152-S723 VanDerWaalsContact CB-OG 3.29Å; V152-S723 WeakPolarHBondContact CB-OG 3.1Å; V152-S723 WeakPolarHBondContact CG1-OG 3.41Å; V152-S723 WeakPolarHBondContact CG2-OG 3.33Å; V664-S723 CarbonylContact C-O 3.49Å; V664-S723 WeakPolarHBondContact CA-O 3.17Å; V664-S723 WeakPolarHBondContact CG1-O 3.17Å; T665-S723 PolarHBondContact N-O 2.85Å; T665-S723 PolarHBondContact O-N 3.33Å
724	F	73.6	Confident	76.6	Confident	56 Å²	56	59.6 Å²	59.6	25%	0.246	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154.8	178	70.8	-76	0	0	0	110.7	L662 V663 V664 Y710 A711 L714 I726	L662-F724 HydrophobicContact CD1-CB 3.97Å; L662-F724 HydrophobicContact CD1-CD2 3.56Å; L662-F724 HydrophobicContact CD1-CG 4.15Å; V663-F724 CarbonylContact O-C 3.54Å; V663-F724 WeakPolarHBondContact O-CA 3.48Å; V664-F724 HydrophobicContact CB-CB 4.5Å; V664-F724 HydrophobicContact CG1-CB 4.2Å; V664-F724 HydrophobicContact CG2-CB 4.29Å; Y710-F724 HydrophobicContact CD1-CD1 4.16Å; Y710-F724 AromaticContact CD1-CD2 3.9Å; Y710-F724 HydrophobicContact CD1-CD2 3.9Å; Y710-F724 HydrophobicContact CD1-CE1 4.36Å; Y710-F724 HydrophobicContact CD1-CE2 4.1Å; Y710-F724 AromaticContact CD1-CG 3.93Å; Y710-F724 HydrophobicContact CD1-CG 3.93Å; Y710-F724 HydrophobicContact CD1-CZ 4.32Å; Y710-F724 HydrophobicContact CE1-CB 4.06Å; Y710-F724 HydrophobicContact CE1-CD1 4.26Å; Y710-F724 HydrophobicContact CE1-CD2 4.19Å; Y710-F724 AromaticContact CE1-CG 3.89Å; Y710-F724 HydrophobicContact CE1-CG 3.89Å; A711-F724 HydrophobicContact CB-CE1 3.62Å; A711-F724 HydrophobicContact CB-CZ 3.73Å; L714-F724 HydrophobicContact CD2-CB 3.98Å; L714-F724 HydrophobicContact CD2-CD1 3.54Å; L714-F724 HydrophobicContact CD2-CE1 4.5Å; L714-F724 HydrophobicContact CD2-CG 4.15Å; F724-I726 HydrophobicContact CD2-CD1 4.08Å; F724-I726 HydrophobicContact CD2-CG1 3.76Å; F724-I726 HydrophobicContact CE2-CD1 3.57Å; F724-I726 HydrophobicContact CE2-CG1 3.72Å
725	R	67.2	Low	76.8	Confident	67 Å²	67	62.2 Å²	62.2	25%	0.253	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	135	170.8	-179.8	-179.8	179	165.4	3.5	108.5	L662 V663	L662-R725 WeakPolarHBondContact CA-O 3.46Å; V663-R725 HydrophobicContact CB-CB 4.45Å; V663-R725 PolarHBondContact N-O 3.05Å; V663-R725 PolarHBondContact O-N 3.43Å
726	I	75	Confident	77.4	Confident	57 Å²	57	58.1 Å²	58.1	29%	0.292	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	133.5	172.7	-66.3	-179.9	0	0	0	108.3	I660 E661 L662 F724	I660-I726 HydrophobicContact CB-CG2 3.82Å; I660-I726 HydrophobicContact CD1-CB 4.38Å; I660-I726 HydrophobicContact CD1-CD1 3.8Å; I660-I726 HydrophobicContact CD1-CG1 3.94Å; I660-I726 HydrophobicContact CD1-CG2 3.59Å; I660-I726 HydrophobicContact CG1-CG2 4.31Å; I660-I726 HydrophobicContact CG2-CG2 3.73Å; E661-I726 WeakPolarHBondContact O-CA 3.11Å; L662-I726 HydrophobicContact CD1-CD1 4.48Å; L662-I726 HydrophobicContact CD1-CG1 3.75Å; F724-I726 HydrophobicContact CD2-CD1 4.08Å; F724-I726 HydrophobicContact CD2-CG1 3.76Å; F724-I726 HydrophobicContact CE2-CD1 3.57Å; F724-I726 HydrophobicContact CE2-CG1 3.72Å
727	S	67.9	Low	77.6	Confident	38 Å²	38	60.9 Å²	60.9	27%	0.266	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.8	166.5	37.1	0	0	0	0	109.9	I660 E661 V729	I660-S727 CarbonylContact C-O 3.59Å; I660-S727 WeakPolarHBondContact CA-O 3.38Å; E661-S727 PolarHBondContact N-O 3.3Å; E661-S727 PolarHBondContact O-N 3.16Å; S727-V729 PolarHBondContact O-N 3.3Å
728	F	77.5	Confident	77.5	Confident	60 Å²	60	62.2 Å²	62.2	26%	0.263	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	134.3	171.7	173.9	-96.8	0	0	0	110.2	V456 P658 Y731	V456-F728 HydrophobicContact CG1-CB 4.38Å; V456-F728 HydrophobicContact CG1-CD2 4.36Å; P658-F728 HydrophobicContact CB-CD2 4.19Å; P658-F728 HydrophobicContact CB-CE2 3.99Å; F728-Y731 AromaticContact CE2-CD2 3.83Å; F728-Y731 HydrophobicContact CE2-CD2 3.83Å; F728-Y731 AromaticContact CE2-CE2 3.53Å; F728-Y731 HydrophobicContact CE2-CE2 3.53Å; F728-Y731 HydrophobicContact CE2-CG 4.42Å; F728-Y731 AromaticContact CE2-CZ 3.94Å; F728-Y731 AromaticContact CZ-CD2 3.47Å; F728-Y731 HydrophobicContact CZ-CD2 3.47Å; F728-Y731 VanDerWaalsContact CZ-CD2 3.47Å; F728-Y731 AromaticContact CZ-CE2 3.39Å; F728-Y731 HydrophobicContact CZ-CE2 3.39Å; F728-Y731 HydrophobicContact CZ-CG 4.37Å
729	V	81.3	Confident	78.1	Confident	59 Å²	59	62.6 Å²	62.6	36%	0.358	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-59.5	178.6	179	0	0	0	0	110.5	V659 E661 S727	V659-V729 PolarHBondContact O-N 3.36Å; E661-V729 HydrophobicContact CB-CG2 3.39Å; E661-V729 VanDerWaalsContact N-CG2 3.27Å; S727-V729 PolarHBondContact O-N 3.3Å
730	R	84.2	Confident	78.8	Confident	129 Å²	129	59.9 Å²	59.9	49%	0.487	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	171.2	-174.8	63.5	179.7	173.8	-116.9	0.7	110.6	V659 E732	V659-R730 WeakPolarHBondContact CA-O 3.38Å; V659-R730 HydrophobicContact CB-CG 4.47Å; V659-R730 WeakPolarHBondContact CB-O 3.49Å; V659-R730 PolarHBondContact N-O 2.87Å; V659-R730 PolarHBondContact O-N 3.42Å; R730-E732 HydrophobicContact CG-CG 4.19Å; R730-E732 IonicContact CZ-OE1 3.57Å; R730-E732 IonicContact NE-OE1 3.64Å; R730-E732 PolarHBondContact NE-OE1 2.77Å; R730-E732 IonicContact NH2-OE1 2.78Å; R730-E732 PolarHBondContact NH2-OE1 3.12Å
731	Y	87.7	Confident	80	Confident	19 Å²	19	62 Å²	62	8%	0.075	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	141.6	163.8	-79.1	-82	0	0	0	110.2	H532 L656 E657 P658 F728	H532-Y731 HydrophobicContact CB-CD1 4.22Å; H532-Y731 HydrophobicContact CB-CE1 4.29Å; H532-Y731 AromaticContact CD2-CD1 3.81Å; H532-Y731 AromaticContact CD2-CD2 3.55Å; H532-Y731 AromaticContact CD2-CE1 3.44Å; H532-Y731 VanDerWaalsContact CD2-CE1 3.44Å; H532-Y731 WeakPolarHBondContact CD2-CE1 3.23Å; H532-Y731 AromaticContact CD2-CE2 3.18Å; H532-Y731 WeakPolarHBondContact CD2-CE2 3.37Å; H532-Y731 AromaticContact CD2-CG 3.88Å; H532-Y731 AromaticContact CD2-CZ 3.13Å; H532-Y731 AromaticContact CG-CE1 3.85Å; H532-Y731 AromaticContact CG-CZ 3.94Å; H532-Y731 AromaticContact NE2-CE1 3.96Å; H532-Y731 AromaticContact NE2-CE2 3.38Å; H532-Y731 WeakPolarHBondContact NE2-CE2 3.26Å; H532-Y731 AromaticContact NE2-CZ 3.24Å; H532-Y731 PolarHBondContact NE2-OH 3.47Å; L656-Y731 HydrophobicContact CB-CD1 4.11Å; L656-Y731 HydrophobicContact CB-CG 4.44Å; E657-Y731 WeakPolarHBondContact O-CA 3.38Å; P658-Y731 HydrophobicContact CB-CD1 4.22Å; P658-Y731 HydrophobicContact CB-CE1 3.71Å; P658-Y731 HydrophobicContact CG-CE1 4.15Å; F728-Y731 AromaticContact CE2-CD2 3.83Å; F728-Y731 HydrophobicContact CE2-CD2 3.83Å; F728-Y731 AromaticContact CE2-CE2 3.53Å; F728-Y731 HydrophobicContact CE2-CE2 3.53Å; F728-Y731 HydrophobicContact CE2-CG 4.42Å; F728-Y731 AromaticContact CE2-CZ 3.94Å; F728-Y731 AromaticContact CZ-CD2 3.47Å; F728-Y731 HydrophobicContact CZ-CD2 3.47Å; F728-Y731 VanDerWaalsContact CZ-CD2 3.47Å; F728-Y731 AromaticContact CZ-CE2 3.39Å; F728-Y731 HydrophobicContact CZ-CE2 3.39Å; F728-Y731 HydrophobicContact CZ-CG 4.37Å
732	E	88.4	Confident	80.9	Confident	60 Å²	60	59 Å²	59	28%	0.28	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.7	174	-71.9	-171.1	172.9	0	0	111.6	L656 E657 V659 R730 L734	L656-E732 CarbonylContact C-O 3.54Å; L656-E732 VanDerWaalsContact CA-O 3.29Å; L656-E732 WeakPolarHBondContact CA-O 3.3Å; E657-E732 PolarHBondContact N-O 3.27Å; E657-E732 PolarHBondContact O-N 2.99Å; V659-E732 HydrophobicContact CB-CG 4.3Å; V659-E732 HydrophobicContact CG2-CB 3.69Å; V659-E732 HydrophobicContact CG2-CG 3.59Å; R730-E732 HydrophobicContact CG-CG 4.19Å; R730-E732 IonicContact CZ-OE1 3.57Å; R730-E732 IonicContact NE-OE1 3.64Å; R730-E732 PolarHBondContact NE-OE1 2.77Å; R730-E732 IonicContact NH2-OE1 2.78Å; R730-E732 PolarHBondContact NH2-OE1 3.12Å; E732-L734 PolarHBondContact O-N 3.4Å
733	P	90.6	Very high	82.1	Confident	85 Å²	85	59.9 Å²	59.9	55%	0.552	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	127.7	178.6	26.9	-33.4	0	0	0	112.4	I654 L656	I654-P733 HydrophobicContact CD1-CB 3.43Å; I654-P733 VanDerWaalsContact CD1-CB 3.43Å; L656-P733 HydrophobicContact CD2-CB 4.1Å
734	L	89.2	Confident	83.2	Confident	9 Å²	9	66.2 Å²	66.2	5%	0.047	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-71.1	149.3	168.4	-77.1	166.7	0	0	0	110.6	Y531 L655 E657 E732 K738 T739 V742	Y531-L734 HydrophobicContact CD1-CD1 4.04Å; Y531-L734 HydrophobicContact CE1-CD1 3.89Å; L655-L734 HydrophobicContact CB-CD1 3.7Å; L655-L734 WeakPolarHBondContact O-CB 3.45Å; L655-L734 PolarHBondContact O-N 2.96Å; E657-L734 HydrophobicContact CB-CD1 4.09Å; E657-L734 HydrophobicContact CB-CD2 4.23Å; E657-L734 HydrophobicContact CB-CG 3.99Å; E657-L734 HydrophobicContact CG-CD2 3.93Å; E657-L734 HydrophobicContact CG-CG 4.01Å; E657-L734 WeakPolarHBondContact OE1-CD2 3.47Å; E732-L734 PolarHBondContact O-N 3.4Å; L734-K738 HydrophobicContact CB-CB 4.46Å; L734-K738 HydrophobicContact CD2-CB 3.91Å; L734-K738 HydrophobicContact CD2-CD 3.8Å; L734-T739 WeakPolarHBondContact CB-OG1 3.34Å; L734-V742 HydrophobicContact CD1-CG2 4.35Å
735	S	87.1	Confident	83.5	Confident	57 Å²	57	69 Å²	69	40%	0.399	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-65.4	149.4	167.9	67.3	0	0	0	0	110.1	E737 K738 T739	S735-E737 PolarHBondContact O-N 3.21Å; S735-E737 VanDerWaalsContact O-N 3.1Å; S735-K738 PolarHBondContact O-N 3.46Å; S735-K738 WeakPolarHBondContact OG-CG 3.21Å; S735-K738 PolarHBondContact OG-N 3.06Å; S735-T739 PolarHBondContact O-N 2.83Å; S735-T739 PolarHBondContact O-OG1 2.88Å
736	A	84	Confident	83.9	Confident	74 Å²	74	67 Å²	67	61%	0.612	34%	0.34	S	S	*	.	H	α-helix	trans	-54.8	-34.1	179.7	0	0	0	0	0	113	A740	A736-A740 PolarHBondContact O-N 2.78Å
737	E	87.6	Confident	83.8	Confident	167 Å²	167	69.9 Å²	69.9	78%	0.78	35%	0.352	S	S	*	.	H	α-helix	trans	-65.3	-47.9	175.2	-65.2	178.3	177.6	0	0	112.2	S735 A740 E741	S735-E737 PolarHBondContact O-N 3.21Å; S735-E737 VanDerWaalsContact O-N 3.1Å; E737-A740 PolarHBondContact O-N 3.22Å; E737-E741 PolarHBondContact O-N 3.48Å
738	K	86.3	Confident	83.7	Confident	93 Å²	93	73.3 Å²	73.3	40%	0.404	37%	0.368	S	S	.	.	H	α-helix	trans	-67.4	-37.9	177	-72.8	-178.9	177.4	-177.8	0	111.6	L734 S735 A740 E741 V742	L734-K738 HydrophobicContact CB-CB 4.46Å; L734-K738 HydrophobicContact CD2-CB 3.91Å; L734-K738 HydrophobicContact CD2-CD 3.8Å; S735-K738 PolarHBondContact O-N 3.46Å; S735-K738 WeakPolarHBondContact OG-CG 3.21Å; S735-K738 PolarHBondContact OG-N 3.06Å; K738-A740 VanDerWaalsContact C-N 3.31Å; K738-A740 PolarHBondContact O-N 2.82Å; K738-E741 WeakPolarHBondContact O-CB 3.47Å; K738-E741 PolarHBondContact O-N 3.03Å; K738-E741 VanDerWaalsContact O-N 3.15Å; K738-V742 WeakPolarHBondContact O-CG2 3.28Å; K738-V742 PolarHBondContact O-N 2.98Å
739	T	86.3	Confident	82.8	Confident	9 Å²	9	73.8 Å²	73.8	6%	0.055	38%	0.379	C	S	.	.	H	α-helix	trans	-55.9	-47.8	173.2	-65	0	0	0	0	110.6	L610 L655 L734 S735 E741 V742 I743	L610-T739 HydrophobicContact CD1-CG2 4.25Å; L655-T739 HydrophobicContact CB-CG2 4.17Å; L655-T739 HydrophobicContact CD1-CG2 3.9Å; L655-T739 HydrophobicContact CG-CG2 3.77Å; L655-T739 PolarHBondContact N-OG1 3.4Å; L734-T739 WeakPolarHBondContact CB-OG1 3.34Å; S735-T739 PolarHBondContact O-N 2.83Å; S735-T739 PolarHBondContact O-OG1 2.88Å; T739-E741 VanDerWaalsContact C-N 3.33Å; T739-E741 PolarHBondContact O-N 3.37Å; T739-V742 PolarHBondContact O-N 3.48Å; T739-I743 HydrophobicContact CG2-CD1 3.78Å; T739-I743 VanDerWaalsContact O-CG1 3.26Å; T739-I743 WeakPolarHBondContact O-CG1 3.18Å; T739-I743 PolarHBondContact O-N 3.31Å
740	A	88	Confident	81.2	Confident	41 Å²	41	77.1 Å²	77.1	34%	0.339	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-35.5	176.4	0	0	0	0	0	113	A736 E737 K738 R744	A736-A740 PolarHBondContact O-N 2.78Å; E737-A740 PolarHBondContact O-N 3.22Å; K738-A740 VanDerWaalsContact C-N 3.31Å; K738-A740 PolarHBondContact O-N 2.82Å; A740-R744 VanDerWaalsContact O-CG 3.32Å; A740-R744 WeakPolarHBondContact O-CG 3.25Å; A740-R744 PolarHBondContact O-N 3.37Å; A740-R744 VanDerWaalsContact O-N 3.12Å
741	E	87.4	Confident	78.8	Confident	96 Å²	96	80.2 Å²	80.2	45%	0.449	42%	0.415	S	S	.	.	H	α-helix	trans	-64.7	-45.2	174.2	-169.2	-167	154.5	0	0	112	E737 K738 T739 R744 K745	E737-E741 PolarHBondContact O-N 3.48Å; K738-E741 WeakPolarHBondContact O-CB 3.47Å; K738-E741 PolarHBondContact O-N 3.03Å; K738-E741 VanDerWaalsContact O-N 3.15Å; T739-E741 VanDerWaalsContact C-N 3.33Å; T739-E741 PolarHBondContact O-N 3.37Å; E741-R744 PolarHBondContact O-N 3.18Å; E741-K745 WeakPolarHBondContact O-CG 3.14Å; E741-K745 PolarHBondContact O-N 2.83Å; E741-K745 VanDerWaalsContact OE1-CE 3.24Å; E741-K745 WeakPolarHBondContact OE1-CE 3.38Å; E741-K745 IonicContact OE1-NZ 3.82Å; E741-K745 PolarHBondContact OE1-NZ 3.41Å
742	V	85.4	Confident	78.4	Confident	16 Å²	16	83.3 Å²	83.3	10%	0.097	43%	0.432	C	S	.	.	H	α-helix	trans	-63.1	-46.7	177.9	174.3	0	0	0	0	110.1	Y531 L611 L655 L734 K738 T739 R744 K745 Y746	Y531-V742 HydrophobicContact CD2-CG1 4.13Å; Y531-V742 HydrophobicContact CE1-CG1 4.37Å; Y531-V742 HydrophobicContact CE1-CG2 4.48Å; Y531-V742 HydrophobicContact CE2-CG1 3.73Å; L611-V742 HydrophobicContact CD1-CG1 4.13Å; L655-V742 HydrophobicContact CD1-CB 4.07Å; L655-V742 HydrophobicContact CD1-CG1 3.87Å; L734-V742 HydrophobicContact CD1-CG2 4.35Å; K738-V742 WeakPolarHBondContact O-CG2 3.28Å; K738-V742 PolarHBondContact O-N 2.98Å; T739-V742 PolarHBondContact O-N 3.48Å; V742-R744 VanDerWaalsContact C-N 3.33Å; V742-R744 PolarHBondContact O-N 3.26Å; V742-K745 WeakPolarHBondContact O-CB 3.39Å; V742-K745 PolarHBondContact O-N 3.28Å; V742-Y746 HydrophobicContact CG1-CD2 3.8Å; V742-Y746 HydrophobicContact CG1-CE2 3.77Å; V742-Y746 WeakPolarHBondContact O-CD2 3.33Å; V742-Y746 PolarHBondContact O-N 3.26Å
743	I	86.2	Confident	77.9	Confident	30 Å²	30	84.5 Å²	84.5	15%	0.154	44%	0.44	C	S	.	.	H	α-helix	trans	-56.3	-47.8	177.8	-67.9	165.4	0	0	0	110.9	L610 L611 L655 T739 K745 Y746 E747	L610-I743 HydrophobicContact CB-CD1 4.45Å; L610-I743 HydrophobicContact CD2-CD1 4.27Å; L611-I743 HydrophobicContact CD1-CG1 4.47Å; L611-I743 HydrophobicContact CD2-CG1 4.16Å; L611-I743 HydrophobicContact CG-CG1 4.17Å; L655-I743 HydrophobicContact CD1-CG1 4.19Å; T739-I743 HydrophobicContact CG2-CD1 3.78Å; T739-I743 VanDerWaalsContact O-CG1 3.26Å; T739-I743 WeakPolarHBondContact O-CG1 3.18Å; T739-I743 PolarHBondContact O-N 3.31Å; I743-K745 VanDerWaalsContact C-N 3.3Å; I743-K745 PolarHBondContact O-N 3.02Å; I743-Y746 PolarHBondContact O-N 3.09Å; I743-Y746 VanDerWaalsContact O-N 3.15Å; I743-E747 HydrophobicContact CG2-CG 4.34Å; I743-E747 WeakPolarHBondContact O-CG 3.49Å; I743-E747 PolarHBondContact O-N 3.44Å
744	R	85.6	Confident	77.2	Confident	168 Å²	168	84.5 Å²	84.5	63%	0.634	43%	0.433	S	S	*	.	H	α-helix	trans	-60.2	-37.2	176.6	-73.5	175	-175.8	172.5	3.3	113.3	A740 E741 V742 N748	A740-R744 VanDerWaalsContact O-CG 3.32Å; A740-R744 WeakPolarHBondContact O-CG 3.25Å; A740-R744 PolarHBondContact O-N 3.37Å; A740-R744 VanDerWaalsContact O-N 3.12Å; E741-R744 PolarHBondContact O-N 3.18Å; V742-R744 VanDerWaalsContact C-N 3.33Å; V742-R744 PolarHBondContact O-N 3.26Å; R744-N748 WeakPolarHBondContact O-CB 3.46Å; R744-N748 PolarHBondContact O-N 2.92Å; R744-N748 PolarHBondContact O-ND2 3.47Å
745	K	81.3	Confident	76.5	Confident	115 Å²	115	88.9 Å²	88.9	50%	0.5	46%	0.456	S	S	.	.	H	α-helix	trans	-67.1	-39.8	176.8	-75.8	179.3	-174.7	168.1	0	111.7	E741 V742 I743 S749	E741-K745 WeakPolarHBondContact O-CG 3.14Å; E741-K745 PolarHBondContact O-N 2.83Å; E741-K745 VanDerWaalsContact OE1-CE 3.24Å; E741-K745 WeakPolarHBondContact OE1-CE 3.38Å; E741-K745 IonicContact OE1-NZ 3.82Å; E741-K745 PolarHBondContact OE1-NZ 3.41Å; V742-K745 WeakPolarHBondContact O-CB 3.39Å; V742-K745 PolarHBondContact O-N 3.28Å; I743-K745 VanDerWaalsContact C-N 3.3Å; I743-K745 PolarHBondContact O-N 3.02Å; K745-S749 PolarHBondContact O-N 3.03Å; K745-S749 PolarHBondContact O-OG 3.48Å
746	Y	75.1	Confident	75.8	Confident	25 Å²	25	90.9 Å²	90.9	10%	0.098	46%	0.46	C	S	.	.	H	α-helix	trans	-65.8	-48.7	175.9	-88.4	-104.6	0	0	0	110.7	Q528 I529 Y531 L611 V742 I743 N748 S749 F750	Q528-Y746 HydrophobicContact CB-CE1 4.42Å; Q528-Y746 HydrophobicContact CG-CE1 4.29Å; I529-Y746 PolarHBondContact O-OH 2.9Å; Y531-Y746 HydrophobicContact CD2-CE2 4.03Å; Y531-Y746 WeakPolarHBondContact CD2-OH 3.37Å; Y531-Y746 AromaticContact CE2-CE2 3.75Å; Y531-Y746 HydrophobicContact CE2-CE2 3.75Å; Y531-Y746 WeakPolarHBondContact CE2-OH 3.28Å; L611-Y746 HydrophobicContact CD1-CD2 4.24Å; L611-Y746 HydrophobicContact CD1-CE2 4.5Å; L611-Y746 HydrophobicContact CD1-CG 4.3Å; L611-Y746 HydrophobicContact CD2-CD1 4.46Å; L611-Y746 HydrophobicContact CD2-CG 4.13Å; V742-Y746 HydrophobicContact CG1-CD2 3.8Å; V742-Y746 HydrophobicContact CG1-CE2 3.77Å; V742-Y746 WeakPolarHBondContact O-CD2 3.33Å; V742-Y746 PolarHBondContact O-N 3.26Å; I743-Y746 PolarHBondContact O-N 3.09Å; I743-Y746 VanDerWaalsContact O-N 3.15Å; Y746-N748 VanDerWaalsContact C-N 3.31Å; Y746-N748 PolarHBondContact O-N 3.18Å; Y746-S749 WeakPolarHBondContact O-CB 3.32Å; Y746-S749 PolarHBondContact O-N 3.2Å; Y746-F750 WeakPolarHBondContact O-CD2 3.41Å
747	E	73.2	Confident	75.2	Confident	117 Å²	117	92.1 Å²	92.1	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-54.6	-45.9	176.5	-71.3	172.5	165.8	0	0	111.8	I743 S749 F750	I743-E747 HydrophobicContact CG2-CG 4.34Å; I743-E747 WeakPolarHBondContact O-CG 3.49Å; I743-E747 PolarHBondContact O-N 3.44Å; E747-S749 PolarHBondContact O-N 3.46Å; E747-F750 PolarHBondContact O-N 3.46Å
748	N	66.2	Low	74.4	Confident	111 Å²	111	86.7 Å²	86.7	59%	0.594	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.9	178.2	-68.4	-18	0	0	0	114.7	R744 Y746	R744-N748 WeakPolarHBondContact O-CB 3.46Å; R744-N748 PolarHBondContact O-N 2.92Å; R744-N748 PolarHBondContact O-ND2 3.47Å; Y746-N748 VanDerWaalsContact C-N 3.31Å; Y746-N748 PolarHBondContact O-N 3.18Å
749	S	57.8	Low	73.5	Confident	70 Å²	70	86.2 Å²	86.2	49%	0.49	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-14.6	178.9	-57	0	0	0	0	112.4	K745 Y746 E747	K745-S749 PolarHBondContact O-N 3.03Å; K745-S749 PolarHBondContact O-OG 3.48Å; Y746-S749 WeakPolarHBondContact O-CB 3.32Å; Y746-S749 PolarHBondContact O-N 3.2Å; E747-S749 PolarHBondContact O-N 3.46Å
750	F	48.2	Very low	72.4	Confident	128 Å²	128	92.7 Å²	92.7	56%	0.561	46%	0.459	S	S	*	.			trans	-98.2	-8.9	177.2	-68.3	-77.2	0	0	0	113.2	Y746 E747	Y746-F750 WeakPolarHBondContact O-CD2 3.41Å; E747-F750 PolarHBondContact O-N 3.46Å
751	D	34.3	Very low	71	Confident	195 Å²	195	97.4 Å²	97.4	100%	1.043	47%	0.47	S	S	*	.			trans	-91.1	0	167.6	-79.6	-20.5	0	0	0	110.8

Retrieved 751 of 751 residues in 980.5 ms (Link to these results)

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