A0A087XNE2_POEFO Loading...

Phosphoglycerate mutase

AlphaFold DB , UniProt , Accession A0A087XNE2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 305 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	30.1	Very low	230 Å²	230	156.1 Å²	156.1	100%	1.133	85%	0.85	S	S	*	*				0	101.5	0	-71.4	-164.8	-92.3	0	0	106.9
2	L	30.9	Very low	30.2	Very low	170 Å²	170	162.7 Å²	162.7	89%	0.89	85%	0.853	S	S	*	*				65.4	101.7	103.7	-70.3	165.6	0	0	0	110.9
3	G	28.6	Very low	30	Very low	87 Å²	87	167 Å²	167	90%	0.897	85%	0.853	S	S	*	*				104.9	149.4	94.7	0	0	0	0	0	107.2
4	G	28.2	Very low	30.2	Very low	75 Å²	75	162.9 Å²	162.9	77%	0.773	84%	0.84	S	S	*	*			cis	168.3	168.1	16.5	0	0	0	0	0	106.3
5	W	27.2	Very low	30.3	Very low	251 Å²	251	160.2 Å²	160.2	95%	0.951	83%	0.833	S	S	*	*			trans	-77.9	170.7	-163.1	-76.2	14.6	0	0	0	119
6	S	30.1	Very low	30.3	Very low	113 Å²	113	165.9 Å²	165.9	79%	0.79	84%	0.841	S	S	*	*			trans	87.7	143.8	140.9	-134.4	0	0	0	0	117.6
7	A	31.3	Very low	30.4	Very low	76 Å²	76	163.2 Å²	163.2	63%	0.628	83%	0.829	S	S	*	*			cis	-160.6	138.1	5.2	0	0	0	0	0	109.3
8	I	29.2	Very low	30.6	Very low	153 Å²	153	163.5 Å²	163.5	79%	0.785	83%	0.826	S	S	*	*				46.6	116.2	105.5	-43.6	177.5	0	0	0	117.2
9	K	29.1	Very low	31	Very low	190 Å²	190	161.2 Å²	161.2	83%	0.826	83%	0.826	S	S	*	*				173.8	104.6	110	-89.2	-176.2	-174.8	177.6	0	112.1
10	R	31.1	Very low	31.3	Very low	253 Å²	253	162.6 Å²	162.6	96%	0.955	82%	0.82	S	S	*	*			trans	-94.7	126.5	150.2	-86.8	-176.3	-168.3	171.7	4.4	107.3
11	V	30	Very low	31.5	Very low	119 Å²	119	157.9 Å²	157.9	72%	0.721	81%	0.806	S	S	*	*			trans	-95.4	113.9	167.9	177.7	0	0	0	0	107.3	Y13	V11-Y13 HydrophobicContact CG1-CD2 4.41Å; V11-Y13 HydrophobicContact CG1-CE2 4.49Å
12	R	31.4	Very low	31.8	Very low	235 Å²	235	149.7 Å²	149.7	89%	0.887	78%	0.775	S	S	*	*			trans	-117.9	126	157.4	-95.8	-174.5	173.4	176.8	-2.8	106.3	V14	R12-V14 PolarHBondContact O-N 3.1Å
13	Y	28.1	Very low	32.4	Very low	219 Å²	219	144.5 Å²	144.5	86%	0.859	75%	0.753	S	S	*	*			trans	-62.8	125.9	174.1	-92.1	-98.6	0	0	0	109.9	V11	V11-Y13 HydrophobicContact CG1-CD2 4.41Å; V11-Y13 HydrophobicContact CG1-CE2 4.49Å
14	V	32.2	Very low	32.8	Very low	110 Å²	110	145.9 Å²	145.9	67%	0.667	73%	0.734	S	S	*	*			trans	-103.2	110.9	173.2	172.9	0	0	0	0	106.9	R12	R12-V14 PolarHBondContact O-N 3.1Å
15	V	32.1	Very low	33.3	Very low	122 Å²	122	145.7 Å²	145.7	74%	0.739	72%	0.72	S	S	*	*			trans	-149.3	65.2	159.4	-168.2	0	0	0	0	108.8
16	W	31	Very low	34.1	Very low	251 Å²	251	137.7 Å²	137.7	95%	0.951	70%	0.699	S	S	*	*	S	Bend	trans	-149	22.9	172.5	-99.3	94.4	0	0	0	115
17	D	31.9	Very low	34.6	Very low	121 Å²	121	139.6 Å²	139.6	65%	0.647	69%	0.693	S	S	*	*	S	Bend	trans	-126.2	-1.7	-178.1	-80.5	-39.5	0	0	0	116.3
18	H	34.1	Very low	34.9	Very low	168 Å²	168	143.2 Å²	143.2	78%	0.778	70%	0.697	S	S	*	*	H	α-helix	trans	-91.4	-12.9	-173.1	-75	51.2	0	0	0	115.2
19	C	38.7	Very low	35.3	Very low	120 Å²	120	142.6 Å²	142.6	81%	0.811	69%	0.691	S	S	*	*	H	α-helix	trans	-92.7	-26.6	-176.6	-137.7	0	0	0	0	113.5
20	W	35.7	Very low	35.9	Very low	188 Å²	188	138.6 Å²	138.6	71%	0.712	68%	0.678	S	S	*	*	H	α-helix	trans	-84.4	-31.6	-177.5	-139.7	72.2	0	0	0	113	S23 K24	W20-S23 PolarHBondContact O-N 2.95Å; W20-K24 HydrophobicContact CZ3-CD 4.15Å; W20-K24 PolarHBondContact O-N 3.35Å
21	A	35.4	Very low	36.3	Very low	64 Å²	64	137.7 Å²	137.7	53%	0.529	68%	0.675	S	S	.	*	H	α-helix	trans	-67.7	-35.5	177.3	0	0	0	0	0	112.8	S23 K24 C25	A21-S23 PolarHBondContact O-N 3Å; A21-K24 PolarHBondContact O-N 3.06Å; A21-C25 WeakPolarHBondContact O-CB 3.42Å; A21-C25 PolarHBondContact O-N 3.08Å
22	A	40.9	Very low	36.8	Very low	58 Å²	58	138 Å²	138	48%	0.479	68%	0.677	S	S	.	*	H	α-helix	trans	-65.5	-36.9	177.3	0	0	0	0	0	112.4	V26	A22-V26 VanDerWaalsContact O-CG2 3.25Å; A22-V26 WeakPolarHBondContact O-CG2 3.32Å; A22-V26 PolarHBondContact O-N 3.18Å
23	S	43.3	Very low	37.2	Very low	62 Å²	62	130.2 Å²	130.2	43%	0.434	66%	0.663	S	S	.	*	H	α-helix	trans	-71.9	-35.5	179.5	-170.3	0	0	0	0	113.2	W20 A21 K27	W20-S23 PolarHBondContact O-N 2.95Å; A21-S23 PolarHBondContact O-N 3Å; S23-K27 WeakPolarHBondContact O-CG 3.46Å; S23-K27 PolarHBondContact O-N 3.03Å
24	K	39	Very low	37.9	Very low	115 Å²	115	129.7 Å²	129.7	50%	0.5	67%	0.668	S	S	.	*	H	α-helix	trans	-74.2	-41.9	174.9	-89.5	-166.3	174.8	-171.3	0	112.6	W20 A21 V26 K27 E28	W20-K24 HydrophobicContact CZ3-CD 4.15Å; W20-K24 PolarHBondContact O-N 3.35Å; A21-K24 PolarHBondContact O-N 3.06Å; K24-V26 VanDerWaalsContact C-N 3.26Å; K24-V26 PolarHBondContact O-N 2.83Å; K24-K27 PolarHBondContact O-N 3.38Å; K24-K27 VanDerWaalsContact O-N 3.11Å; K24-E28 WeakPolarHBondContact O-CB 3.5Å; K24-E28 PolarHBondContact O-N 3.47Å
25	C	38.6	Very low	38.5	Very low	71 Å²	71	127.1 Å²	127.1	48%	0.48	66%	0.664	S	S	.	*	H	α-helix	trans	-60	-38.7	178.9	-166.1	0	0	0	0	111.8	A21 Q29	A21-C25 WeakPolarHBondContact O-CB 3.42Å; A21-C25 PolarHBondContact O-N 3.08Å; C25-Q29 PolarHBondContact O-N 3.07Å
26	V	43.7	Very low	39.4	Very low	84 Å²	84	127.2 Å²	127.2	51%	0.509	67%	0.67	S	S	.	*	H	α-helix	trans	-67.8	-43.6	173.7	173.7	0	0	0	0	111.7	A22 K24 E28 L30	A22-V26 VanDerWaalsContact O-CG2 3.25Å; A22-V26 WeakPolarHBondContact O-CG2 3.32Å; A22-V26 PolarHBondContact O-N 3.18Å; K24-V26 VanDerWaalsContact C-N 3.26Å; K24-V26 PolarHBondContact O-N 2.83Å; V26-E28 VanDerWaalsContact C-N 3.31Å; V26-E28 PolarHBondContact O-N 3.27Å; V26-L30 HydrophobicContact CG1-CD1 3.75Å; V26-L30 WeakPolarHBondContact O-CB 3.49Å; V26-L30 WeakPolarHBondContact O-CD1 3.5Å; V26-L30 WeakPolarHBondContact O-CG 3.21Å; V26-L30 PolarHBondContact O-N 2.79Å
27	K	39.9	Very low	40.6	Very low	152 Å²	152	119.1 Å²	119.1	66%	0.661	65%	0.648	S	S	*	*	H	α-helix	trans	-66.8	-29.6	179.1	-78.4	179.3	178.7	178.4	0	113.7	S23 K24	S23-K27 WeakPolarHBondContact O-CG 3.46Å; S23-K27 PolarHBondContact O-N 3.03Å; K24-K27 PolarHBondContact O-N 3.38Å; K24-K27 VanDerWaalsContact O-N 3.11Å
28	E	37.1	Very low	42.1	Very low	152 Å²	152	115.8 Å²	115.8	71%	0.71	63%	0.634	S	S	*	*	H	α-helix	trans	-85.2	-29	-176.8	-146.6	146.7	-154.2	0	0	112	K24 V26 L30	K24-E28 WeakPolarHBondContact O-CB 3.5Å; K24-E28 PolarHBondContact O-N 3.47Å; V26-E28 VanDerWaalsContact C-N 3.31Å; V26-E28 PolarHBondContact O-N 3.27Å; E28-L30 VanDerWaalsContact C-N 3.3Å
29	Q	37.5	Very low	43.2	Very low	141 Å²	141	111.4 Å²	111.4	66%	0.659	62%	0.623	S	S	*	*	H	α-helix	trans	-73.7	-17.1	167.9	-75.8	-177.1	-28.7	0	0	114	C25 T32	C25-Q29 PolarHBondContact O-N 3.07Å; Q29-T32 PolarHBondContact O-OG1 3.3Å
30	L	43	Very low	43.9	Very low	105 Å²	105	111.4 Å²	111.4	55%	0.55	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-89.2	-6.9	-177.5	-76.6	167.4	0	0	0	114.4	V26 E28 T32	V26-L30 HydrophobicContact CG1-CD1 3.75Å; V26-L30 WeakPolarHBondContact O-CB 3.49Å; V26-L30 WeakPolarHBondContact O-CD1 3.5Å; V26-L30 WeakPolarHBondContact O-CG 3.21Å; V26-L30 PolarHBondContact O-N 2.79Å; E28-L30 VanDerWaalsContact C-N 3.3Å; L30-T32 VanDerWaalsContact C-N 3.27Å; L30-T32 PolarHBondContact O-N 2.93Å
31	R	39.1	Very low	44.9	Very low	235 Å²	235	107.3 Å²	107.3	89%	0.887	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-82.7	-4.3	-179.6	-137.2	176.4	-175.2	-173.9	-0.1	113.6
32	T	40.3	Very low	45.9	Very low	125 Å²	125	109.2 Å²	109.2	77%	0.767	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-115.5	4.2	-175.5	49.6	0	0	0	0	114.4	Q29 L30	Q29-T32 PolarHBondContact O-OG1 3.3Å; L30-T32 VanDerWaalsContact C-N 3.27Å; L30-T32 PolarHBondContact O-N 2.93Å
33	A	39.4	Very low	46.6	Very low	71 Å²	71	113.2 Å²	113.2	59%	0.587	61%	0.61	S	S	*	*			trans	-115	81.4	179.1	0	0	0	0	0	111.1	G35	A33-G35 PolarHBondContact O-N 3.48Å
34	E	43.2	Very low	47.4	Very low	209 Å²	209	114.9 Å²	114.9	98%	0.977	61%	0.613	S	S	*	*			trans	-70.1	87	156.7	-74.2	-178.3	160.9	0	0	108
35	G	45	Very low	48.2	Very low	56 Å²	56	114 Å²	114	58%	0.577	61%	0.611	S	S	*	*	S	Bend	trans	-159.3	131.6	178.7	0	0	0	0	0	110.3	A33 V37	A33-G35 PolarHBondContact O-N 3.48Å; G35-V37 PolarHBondContact O-N 2.85Å; G35-V37 VanDerWaalsContact O-N 3.08Å
36	S	51.4	Low	49.1	Very low	123 Å²	123	112.6 Å²	112.6	86%	0.86	61%	0.608	S	S	*	*			trans	-50.8	113	-177.6	57.2	0	0	0	0	111.8	S38	S36-S38 PolarHBondContact O-N 2.76Å
37	V	55.6	Low	49.6	Very low	82 Å²	82	115.8 Å²	115.8	50%	0.497	62%	0.615	S	S	.	*			trans	-62.1	126.7	174.4	-172.8	0	0	0	0	108.9	G35 E41 L42	G35-V37 PolarHBondContact O-N 2.85Å; G35-V37 VanDerWaalsContact O-N 3.08Å; V37-E41 HydrophobicContact CG1-CB 3.79Å; V37-L42 HydrophobicContact CG1-CG 4Å
38	S	63.9	Low	50.1	Low	51 Å²	51	114 Å²	114	36%	0.357	61%	0.612	S	S	.	*			trans	-70	151.8	-176.4	70.7	0	0	0	0	111.8	S36 L40 E41 L42	S36-S38 PolarHBondContact O-N 2.76Å; S38-L40 PolarHBondContact O-N 3.18Å; S38-L40 VanDerWaalsContact O-N 3.1Å; S38-E41 WeakPolarHBondContact CB-OE2 3.24Å; S38-E41 PolarHBondContact N-OE2 2.81Å; S38-E41 PolarHBondContact O-N 3.24Å; S38-E41 WeakPolarHBondContact OG-CB 3.42Å; S38-E41 VanDerWaalsContact OG-CG 3.32Å; S38-E41 WeakPolarHBondContact OG-CG 3.25Å; S38-E41 PolarHBondContact OG-N 3.32Å; S38-E41 PolarHBondContact OG-OE2 3.31Å; S38-L42 PolarHBondContact O-N 3.11Å
39	S	55.6	Low	50.9	Low	76 Å²	76	112.6 Å²	112.6	53%	0.531	61%	0.608	S	S	.	*	H	α-helix	trans	-54	-30.3	173.5	169.5	0	0	0	0	112.7	K43	S39-K43 WeakPolarHBondContact O-CB 3.28Å; S39-K43 VanDerWaalsContact O-CG 3.24Å; S39-K43 WeakPolarHBondContact O-CG 3.33Å; S39-K43 PolarHBondContact O-N 3.39Å; S39-K43 VanDerWaalsContact O-N 3.07Å
40	L	53.3	Low	51.7	Low	120 Å²	120	110.3 Å²	110.3	63%	0.628	60%	0.601	S	S	*	*	H	α-helix	trans	-73.1	-41.9	178.5	-145.5	86.1	0	0	0	111.4	S38 K43 I44	S38-L40 PolarHBondContact O-N 3.18Å; S38-L40 VanDerWaalsContact O-N 3.1Å; L40-K43 WeakPolarHBondContact O-CB 3.28Å; L40-K43 PolarHBondContact O-N 2.93Å; L40-I44 HydrophobicContact CD2-CD1 4.38Å; L40-I44 HydrophobicContact CG-CD1 4.42Å; L40-I44 WeakPolarHBondContact O-CB 3.43Å; L40-I44 WeakPolarHBondContact O-CD1 3.21Å; L40-I44 WeakPolarHBondContact O-CG1 3.4Å; L40-I44 PolarHBondContact O-N 3.25Å
41	E	58.8	Low	52.1	Low	102 Å²	102	112.6 Å²	112.6	48%	0.477	61%	0.61	S	S	.	*	H	α-helix	trans	-67.1	-38.7	175.4	-75.2	162.9	142	0	0	112.1	V37 S38 K43 I44 Q45	V37-E41 HydrophobicContact CG1-CB 3.79Å; S38-E41 WeakPolarHBondContact CB-OE2 3.24Å; S38-E41 PolarHBondContact N-OE2 2.81Å; S38-E41 PolarHBondContact O-N 3.24Å; S38-E41 WeakPolarHBondContact OG-CB 3.42Å; S38-E41 VanDerWaalsContact OG-CG 3.32Å; S38-E41 WeakPolarHBondContact OG-CG 3.25Å; S38-E41 PolarHBondContact OG-N 3.32Å; S38-E41 PolarHBondContact OG-OE2 3.31Å; E41-K43 VanDerWaalsContact C-N 3.32Å; E41-K43 PolarHBondContact O-N 3.48Å; E41-I44 PolarHBondContact O-N 3.24Å; E41-Q45 VanDerWaalsContact O-CB 3.28Å; E41-Q45 WeakPolarHBondContact O-CB 3.12Å; E41-Q45 WeakPolarHBondContact O-CG 3.48Å; E41-Q45 PolarHBondContact O-N 3.02Å
42	L	55.2	Low	53	Low	103 Å²	103	106.3 Å²	106.3	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-63.3	-38.4	171.8	-79.9	163.7	0	0	0	111.9	V37 S38 G46	V37-L42 HydrophobicContact CG1-CG 4Å; S38-L42 PolarHBondContact O-N 3.11Å; L42-G46 PolarHBondContact O-N 3.48Å
43	K	55.1	Low	54.1	Low	142 Å²	142	102 Å²	102	62%	0.617	58%	0.575	S	S	*	*	H	α-helix	trans	-67.8	-40.6	174.1	-78.7	171	179.8	174	0	112	S39 L40 E41 K47	S39-K43 WeakPolarHBondContact O-CB 3.28Å; S39-K43 VanDerWaalsContact O-CG 3.24Å; S39-K43 WeakPolarHBondContact O-CG 3.33Å; S39-K43 PolarHBondContact O-N 3.39Å; S39-K43 VanDerWaalsContact O-N 3.07Å; L40-K43 WeakPolarHBondContact O-CB 3.28Å; L40-K43 PolarHBondContact O-N 2.93Å; E41-K43 VanDerWaalsContact C-N 3.32Å; E41-K43 PolarHBondContact O-N 3.48Å; K43-K47 VanDerWaalsContact O-CB 3.28Å; K43-K47 WeakPolarHBondContact O-CB 3.39Å; K43-K47 PolarHBondContact O-N 3.42Å
44	I	61	Low	56.3	Low	97 Å²	97	102.4 Å²	102.4	50%	0.497	57%	0.57	S	S	.	*	H	α-helix	trans	-68.7	-45.2	177.3	-68.7	163.5	0	0	0	110.2	L40 E41 K47 L48	L40-I44 HydrophobicContact CD2-CD1 4.38Å; L40-I44 HydrophobicContact CG-CD1 4.42Å; L40-I44 WeakPolarHBondContact O-CB 3.43Å; L40-I44 WeakPolarHBondContact O-CD1 3.21Å; L40-I44 WeakPolarHBondContact O-CG1 3.4Å; L40-I44 PolarHBondContact O-N 3.25Å; E41-I44 PolarHBondContact O-N 3.24Å; I44-K47 PolarHBondContact O-N 3.35Å; I44-L48 WeakPolarHBondContact O-CB 3.28Å; I44-L48 PolarHBondContact O-N 3.32Å
45	Q	56.3	Low	58.7	Low	98 Å²	98	93.4 Å²	93.4	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-59.8	-46.4	173.5	-83.7	178.4	-32.6	0	0	111.7	E41 K47 L48 L49	E41-Q45 VanDerWaalsContact O-CB 3.28Å; E41-Q45 WeakPolarHBondContact O-CB 3.12Å; E41-Q45 WeakPolarHBondContact O-CG 3.48Å; E41-Q45 PolarHBondContact O-N 3.02Å; Q45-K47 VanDerWaalsContact C-N 3.31Å; Q45-K47 PolarHBondContact O-N 3.01Å; Q45-L48 PolarHBondContact O-N 3.41Å; Q45-L49 WeakPolarHBondContact O-CB 3.33Å; Q45-L49 PolarHBondContact O-N 3.3Å
46	G	57	Low	61	Low	40 Å²	40	96.7 Å²	96.7	41%	0.412	52%	0.523	S	S	.	.	H	α-helix	trans	-59	-42.3	175.1	0	0	0	0	0	111.9	L42 N50	L42-G46 PolarHBondContact O-N 3.48Å; G46-N50 WeakPolarHBondContact O-CB 3.33Å; G46-N50 PolarHBondContact O-N 2.95Å
47	K	53.2	Low	63.2	Low	152 Å²	152	90.8 Å²	90.8	66%	0.661	48%	0.482	S	S	*	.	H	α-helix	trans	-69.9	-38.8	177.9	-152.9	175	-172.8	-174.9	0	112.5	K43 I44 Q45 N50 M51	K43-K47 VanDerWaalsContact O-CB 3.28Å; K43-K47 WeakPolarHBondContact O-CB 3.39Å; K43-K47 PolarHBondContact O-N 3.42Å; I44-K47 PolarHBondContact O-N 3.35Å; Q45-K47 VanDerWaalsContact C-N 3.31Å; Q45-K47 PolarHBondContact O-N 3.01Å; K47-N50 PolarHBondContact O-N 2.87Å; K47-M51 VanDerWaalsContact O-CG 3.28Å; K47-M51 WeakPolarHBondContact O-CG 3.41Å; K47-M51 PolarHBondContact O-N 3.45Å
48	L	51.8	Low	65.3	Low	114 Å²	114	87 Å²	87	60%	0.597	46%	0.459	S	S	*	.	H	α-helix	trans	-69.1	-41.4	177.4	-134	87.9	0	0	0	111.9	I44 Q45 N50 M51 T52	I44-L48 WeakPolarHBondContact O-CB 3.28Å; I44-L48 PolarHBondContact O-N 3.32Å; Q45-L48 PolarHBondContact O-N 3.41Å; L48-N50 VanDerWaalsContact C-N 3.32Å; L48-M51 PolarHBondContact O-N 3.17Å; L48-T52 PolarHBondContact O-N 3.4Å; L48-T52 PolarHBondContact O-OG1 3.45Å
49	L	53.8	Low	66.9	Low	122 Å²	122	84.6 Å²	84.6	64%	0.639	44%	0.442	S	S	*	.	H	α-helix	trans	-60.5	-43.1	171.6	-84.4	156.5	0	0	0	110.6	Q45 M51 T52 A53	Q45-L49 WeakPolarHBondContact O-CB 3.33Å; Q45-L49 PolarHBondContact O-N 3.3Å; L49-M51 VanDerWaalsContact C-N 3.34Å; L49-M51 PolarHBondContact O-N 3.06Å; L49-T52 PolarHBondContact O-N 3.44Å; L49-T52 VanDerWaalsContact O-N 3.17Å; L49-T52 PolarHBondContact O-OG1 3.25Å; L49-A53 PolarHBondContact O-N 3.03Å
50	N	52.8	Low	69	Low	94 Å²	94	81 Å²	81	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-65.8	-33.9	177.6	-139.2	23.2	0	0	0	112.8	G46 K47 L48 T52 A273	G46-N50 WeakPolarHBondContact O-CB 3.33Å; G46-N50 PolarHBondContact O-N 2.95Å; K47-N50 PolarHBondContact O-N 2.87Å; L48-N50 VanDerWaalsContact C-N 3.32Å; N50-T52 PolarHBondContact O-N 3.18Å; N50-A273 HydrophobicContact CB-CB 4.47Å; N50-A273 VanDerWaalsContact O-CB 3.31Å; N50-A273 WeakPolarHBondContact O-CB 3.38Å; N50-A273 WeakPolarHBondContact OD1-CB 3.44Å
51	M	52.7	Low	71.1	Confident	152 Å²	152	76.4 Å²	76.4	75%	0.749	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.9	175.8	-74	177.8	68.3	0	0	114.2	K47 L48 L49	K47-M51 VanDerWaalsContact O-CG 3.28Å; K47-M51 WeakPolarHBondContact O-CG 3.41Å; K47-M51 PolarHBondContact O-N 3.45Å; L48-M51 PolarHBondContact O-N 3.17Å; L49-M51 VanDerWaalsContact C-N 3.34Å; L49-M51 PolarHBondContact O-N 3.06Å
52	T	58.1	Low	73	Confident	103 Å²	103	71.8 Å²	71.8	63%	0.632	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-5.3	-179.7	60	0	0	0	0	113.7	L48 L49 N50 V54	L48-T52 PolarHBondContact O-N 3.4Å; L48-T52 PolarHBondContact O-OG1 3.45Å; L49-T52 PolarHBondContact O-N 3.44Å; L49-T52 VanDerWaalsContact O-N 3.17Å; L49-T52 PolarHBondContact O-OG1 3.25Å; N50-T52 PolarHBondContact O-N 3.18Å; T52-V54 PolarHBondContact O-N 3.42Å
53	A	64.1	Low	75	Confident	34 Å²	34	66.9 Å²	66.9	28%	0.281	34%	0.344	S	S	.	.			trans	-72.4	103.2	178.8	0	0	0	0	0	109.6	L49	L49-A53 PolarHBondContact O-N 3.03Å
54	V	85	Confident	76.9	Confident	80 Å²	80	61.7 Å²	61.7	49%	0.485	32%	0.322	S	S	.	.			trans	-93.9	112.4	171.9	179.8	0	0	0	0	108.1	T52 E270 L271	T52-V54 PolarHBondContact O-N 3.42Å; V54-E270 HydrophobicContact CG1-CB 3.65Å; V54-E270 HydrophobicContact CG1-CG 3.85Å; V54-L271 CarbonylContact C-O 3.56Å; V54-L271 WeakPolarHBondContact CA-O 3.42Å
55	H	93.6	Very high	78.5	Confident	21 Å²	21	57 Å²	57	10%	0.097	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	148	174.1	-55.4	-70.1	0	0	0	110.8	I226 E270 L271 D272	H55-I226 HydrophobicContact CB-CG2 3.4Å; H55-I226 VanDerWaalsContact CB-CG2 3.4Å; H55-I226 PolarHBondContact CE1-O 3.48Å; H55-I226 VanDerWaalsContact CE1-O 3.26Å; H55-I226 PolarHBondContact ND1-O 3.3Å; H55-E270 CarbonylContact O-C 3.59Å; H55-E270 WeakPolarHBondContact O-CA 3.4Å; H55-L271 HydrophobicContact CB-CB 4.37Å; H55-L271 PolarHBondContact N-O 3.43Å; H55-L271 PolarHBondContact O-N 2.93Å; H55-D272 PolarHBondContact CD2-O 3.49Å
56	R	93.3	Very high	80.4	Confident	124 Å²	124	53.8 Å²	53.8	47%	0.468	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129	176.3	-77	-179.4	168	172.8	-2.8	111.6	V232 Y269 E270	R56-V232 PolarHBondContact O-N 3.01Å; R56-Y269 WeakPolarHBondContact CA-O 3.31Å; R56-E270 HydrophobicContact CG-CG 4.21Å; R56-E270 IonicContact CZ-OE1 2.85Å; R56-E270 IonicContact NE-OE1 2.76Å; R56-E270 IonicContact NH2-OE1 2.8Å; R56-E270 PolarHBondContact NH2-OE1 3.13Å
57	L	98.1	Very high	82.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132	172	167.5	69.1	0	0	0	108.8	I59 W218 I226 V232 I234 L248 V268 Y269 L271	L57-I59 HydrophobicContact CD1-CG2 4.03Å; L57-I59 HydrophobicContact CD2-CG2 3.94Å; L57-I59 HydrophobicContact CG-CG2 3.89Å; L57-W218 HydrophobicContact CD2-CH2 3.7Å; L57-W218 HydrophobicContact CD2-CZ3 3.76Å; L57-I226 HydrophobicContact CB-CD1 4.47Å; L57-I226 HydrophobicContact CD1-CD1 4.34Å; L57-V232 HydrophobicContact CD1-CB 4.04Å; L57-V232 HydrophobicContact CD1-CG1 3.94Å; L57-I234 HydrophobicContact CD1-CD1 3.79Å; L57-I234 HydrophobicContact CD1-CG1 3.96Å; L57-L248 HydrophobicContact CD2-CD1 3.96Å; L57-V268 WeakPolarHBondContact O-CA 3.31Å; L57-Y269 PolarHBondContact N-O 2.9Å; L57-Y269 PolarHBondContact O-N 2.9Å; L57-L271 HydrophobicContact CB-CD1 4.2Å; L57-L271 HydrophobicContact CD2-CD1 4.42Å
58	V	98.7	Very high	83.8	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.1	168.3	179.6	0	0	0	0	109.3	V60 I96 M101 F103 V232 I233 I234 P266 I267 V268	V58-V60 HydrophobicContact CG1-CG2 4.05Å; V58-I96 HydrophobicContact CG1-CD1 4.47Å; V58-M101 HydrophobicContact CG2-SD 3.72Å; V58-F103 HydrophobicContact CB-CE1 3.82Å; V58-F103 HydrophobicContact CB-CZ 4.09Å; V58-F103 HydrophobicContact CG1-CZ 4.42Å; V58-F103 HydrophobicContact CG2-CE1 3.59Å; V58-F103 HydrophobicContact CG2-CZ 3.93Å; V58-V232 PolarHBondContact N-O 3.27Å; V58-I233 HydrophobicContact CB-CB 4.45Å; V58-I233 HydrophobicContact CB-CG1 4.2Å; V58-I233 HydrophobicContact CG1-CD1 4.2Å; V58-I233 HydrophobicContact CG1-CG1 4.16Å; V58-I233 CarbonylContact O-C 3.53Å; V58-I233 VanDerWaalsContact O-CA 3.25Å; V58-I233 WeakPolarHBondContact O-CA 3.45Å; V58-I234 PolarHBondContact O-N 3.45Å; V58-P266 HydrophobicContact CG1-CB 3.97Å; V58-I267 CarbonylContact C-O 3.59Å; V58-I267 WeakPolarHBondContact CA-O 3.48Å; V58-V268 HydrophobicContact CG2-CG2 4.29Å
59	I	98.6	Very high	85.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.5	170.8	69.2	177.1	0	0	0	109.9	L57 I234 L241 V245 I267 Y269	L57-I59 HydrophobicContact CD1-CG2 4.03Å; L57-I59 HydrophobicContact CD2-CG2 3.94Å; L57-I59 HydrophobicContact CG-CG2 3.89Å; I59-I234 CarbonylContact C-O 3.55Å; I59-I234 WeakPolarHBondContact CA-O 3.46Å; I59-I234 HydrophobicContact CG2-CB 4.1Å; I59-I234 HydrophobicContact CG2-CD1 4.04Å; I59-I234 HydrophobicContact CG2-CG1 4.33Å; I59-L241 HydrophobicContact CB-CD1 4.44Å; I59-L241 HydrophobicContact CB-CD2 3.95Å; I59-L241 HydrophobicContact CD1-CD2 4.39Å; I59-L241 HydrophobicContact CG2-CD2 4.3Å; I59-V245 HydrophobicContact CD1-CG2 3.74Å; I59-I267 HydrophobicContact CD1-CB 4.43Å; I59-I267 HydrophobicContact CD1-CD1 4.45Å; I59-I267 HydrophobicContact CD1-CG2 4.5Å; I59-I267 HydrophobicContact CG1-CB 3.72Å; I59-I267 HydrophobicContact CG1-CD1 4.3Å; I59-I267 HydrophobicContact CG1-CG1 4.47Å; I59-I267 HydrophobicContact CG1-CG2 4.2Å; I59-I267 PolarHBondContact N-O 3.08Å; I59-I267 PolarHBondContact O-N 3.18Å; I59-Y269 HydrophobicContact CD1-CE2 3.95Å; I59-Y269 HydrophobicContact CG1-CE2 4.5Å
60	V	98.5	Very high	87.3	Confident	1 Å²	1	47 Å²	47	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	120.1	-179.1	-164.1	0	0	0	0	108.9	V58 T117 I121 I233 I234 A235 A236 P266	V58-V60 HydrophobicContact CG1-CG2 4.05Å; V60-T117 HydrophobicContact CG1-CG2 4.33Å; V60-I121 HydrophobicContact CB-CD1 4.36Å; V60-I121 HydrophobicContact CG1-CD1 4.27Å; V60-I121 HydrophobicContact CG2-CD1 3.99Å; V60-I233 HydrophobicContact CG2-CD1 4.17Å; V60-I233 HydrophobicContact CG2-CG1 4.42Å; V60-I234 PolarHBondContact N-O 3.45Å; V60-A235 CarbonylContact O-C 3.57Å; V60-A235 WeakPolarHBondContact O-CA 3.39Å; V60-A236 PolarHBondContact O-N 3.39Å; V60-P266 HydrophobicContact CG2-CB 4.06Å; V60-P266 HydrophobicContact CG2-CG 4.49Å
61	R	98.2	Very high	89	Confident	24 Å²	24	45.6 Å²	45.6	9%	0.091	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	132.1	164.5	178.6	-174.6	172.4	-171.8	-6	107.4	L241 L261 P262 T263 G264	R61-L241 HydrophobicContact CB-CD1 4.08Å; R61-L261 VanDerWaalsContact CD-O 3.3Å; R61-L261 WeakPolarHBondContact CD-O 3.45Å; R61-L261 PolarHBondContact NH1-O 3.43Å; R61-P262 WeakPolarHBondContact CB-O 3.4Å; R61-T263 HydrophobicContact CG-CG2 4.4Å; R61-T263 VanDerWaalsContact CZ-CG2 3.42Å; R61-G264 WeakPolarHBondContact O-CA 3.36Å; R61-G264 PolarHBondContact O-N 2.96Å
62	H	98.3	Very high	91	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.019	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-51	154.9	175.9	68.9	79.5	0	0	0	112.8	L81 R113 T117 A236 H237 T263	H62-L81 HydrophobicContact CB-CD2 4.46Å; H62-R113 VanDerWaalsContact CE1-CD 3.41Å; H62-R113 WeakPolarHBondContact CE1-CD 3.49Å; H62-R113 PolarHBondContact NE2-NE 3.4Å; H62-T117 WeakPolarHBondContact CA-OG1 3.37Å; H62-T117 VanDerWaalsContact CB-OG1 3.32Å; H62-T117 WeakPolarHBondContact CB-OG1 3.3Å; H62-A236 PolarHBondContact CD2-O 2.98Å; H62-A236 VanDerWaalsContact CD2-O 3.3Å; H62-A236 PolarHBondContact N-O 3.28Å; H62-H237 AromaticContact CD2-CE1 3.63Å; H62-H237 AromaticContact CD2-CG 3.83Å; H62-H237 AromaticContact CD2-ND1 3.01Å; H62-H237 PolarHBondContact CD2-ND1 3.16Å; H62-H237 AromaticContact NE2-CE1 3.82Å; H62-H237 AromaticContact NE2-CG 3.98Å; H62-H237 AromaticContact NE2-ND1 3Å; H62-H237 PolarHBondContact NE2-ND1 2.94Å; H62-T263 WeakPolarHBondContact O-CB 3.28Å; H62-T263 WeakPolarHBondContact O-CG2 3.36Å
63	G	96.2	Very high	92.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-60.8	167.3	172.7	0	0	0	0	0	112.5	S65 L81 E88	G63-S65 PolarHBondContact O-N 2.91Å; G63-L81 VanDerWaalsContact O-CD2 3.28Å; G63-L81 WeakPolarHBondContact O-CD2 3.44Å; G63-E88 VanDerWaalsContact CA-OE2 3.23Å; G63-E88 WeakPolarHBondContact CA-OE2 3.11Å
64	E	95.6	Very high	94.1	Very high	33 Å²	33	34.4 Å²	34.4	15%	0.154	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-48.3	130.8	176.6	-168.1	-175.7	-93.8	0	0	112.5	N68 S82 K84 G85 E88	E64-N68 HydrophobicContact CG-CB 3.78Å; E64-S82 PolarHBondContact O-N 3.44Å; E64-S82 PolarHBondContact O-OG 3.26Å; E64-S82 PolarHBondContact OE2-OG 3.05Å; E64-S82 VanDerWaalsContact OE2-OG 3.09Å; E64-K84 IonicContact OE1-NZ 3.34Å; E64-K84 PolarHBondContact OE1-NZ 3.02Å; E64-G85 VanDerWaalsContact O-CA 3.32Å; E64-G85 WeakPolarHBondContact O-CA 3.4Å; E64-E88 PolarHBondContact N-OE2 3.06Å
65	S	95.8	Very high	94.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-91.1	160.3	173.4	63.8	0	0	0	0	111.7	G63 W67 N68 Q69 D80	G63-S65 PolarHBondContact O-N 2.91Å; S65-W67 PolarHBondContact O-N 2.89Å; S65-N68 PolarHBondContact N-OD1 2.94Å; S65-N68 VanDerWaalsContact N-OD1 3.12Å; S65-N68 WeakPolarHBondContact O-CA 3.47Å; S65-N68 WeakPolarHBondContact O-CB 3.33Å; S65-N68 PolarHBondContact O-N 2.95Å; S65-N68 PolarHBondContact OG-N 2.84Å; S65-N68 PolarHBondContact OG-ND2 3.35Å; S65-N68 PolarHBondContact OG-OD1 3.23Å; S65-Q69 PolarHBondContact O-N 3.38Å; S65-Q69 VanDerWaalsContact O-N 3.11Å; S65-D80 VanDerWaalsContact CA-O 3.31Å; S65-D80 WeakPolarHBondContact CA-O 3.31Å; S65-D80 WeakPolarHBondContact CB-O 3.48Å
66	A	94.8	Very high	94.9	Very high	30 Å²	30	29.8 Å²	29.8	25%	0.248	14%	0.14	C	C	.	.	H	α-helix	trans	-50.4	-42.3	174.6	0	0	0	0	0	112.3	N68 Q69 E70 D80	A66-N68 VanDerWaalsContact C-N 3.34Å; A66-N68 PolarHBondContact O-N 3.36Å; A66-Q69 WeakPolarHBondContact O-CB 3.32Å; A66-Q69 PolarHBondContact O-N 3.19Å; A66-E70 WeakPolarHBondContact O-CG 3.3Å; A66-E70 PolarHBondContact O-N 2.99Å; A66-D80 PolarHBondContact N-O 2.86Å
67	W	94.2	Very high	95.1	Very high	14 Å²	14	25.6 Å²	25.6	5%	0.053	13%	0.125	C	C	.	.	H	α-helix	trans	-75.8	-18.8	177.6	-77.7	22.3	0	0	0	114.3	S65 N71 R72 F73 C74 F77 A79 T147 Y183	S65-W67 PolarHBondContact O-N 2.89Å; W67-N71 PolarHBondContact O-N 3.27Å; W67-R72 HydrophobicContact CB-CB 4.22Å; W67-R72 HydrophobicContact CD2-CB 4.32Å; W67-R72 HydrophobicContact CE3-CB 4.12Å; W67-R72 HydrophobicContact CG-CB 4.37Å; W67-R72 VanDerWaalsContact NE1-NH1 3.14Å; W67-R72 PolarHBondContact O-N 2.8Å; W67-F73 WeakPolarHBondContact CZ3-O 3.46Å; W67-C74 HydrophobicContact CB-CB 4.03Å; W67-C74 HydrophobicContact CE3-CB 4.14Å; W67-F77 AromaticContact CD2-CD1 3.68Å; W67-F77 HydrophobicContact CD2-CD1 3.68Å; W67-F77 AromaticContact CD2-CE1 3.96Å; W67-F77 HydrophobicContact CD2-CE1 3.96Å; W67-F77 HydrophobicContact CD2-CG 4.41Å; W67-F77 AromaticContact CE2-CD1 3.41Å; W67-F77 VanDerWaalsContact CE2-CD1 3.41Å; W67-F77 AromaticContact CE2-CE1 3.27Å; W67-F77 AromaticContact CE2-CZ 3.88Å; W67-F77 HydrophobicContact CE3-CB 4.31Å; W67-F77 AromaticContact CE3-CD1 3.89Å; W67-F77 HydrophobicContact CE3-CD1 3.89Å; W67-F77 HydrophobicContact CE3-CG 4.23Å; W67-F77 HydrophobicContact CG-CD1 4.42Å; W67-F77 HydrophobicContact CH2-CB 3.81Å; W67-F77 AromaticContact CH2-CD1 3.51Å; W67-F77 HydrophobicContact CH2-CD1 3.51Å; W67-F77 AromaticContact CH2-CD2 3.56Å; W67-F77 HydrophobicContact CH2-CD2 3.56Å; W67-F77 AromaticContact CH2-CE1 3.94Å; W67-F77 HydrophobicContact CH2-CE1 3.94Å; W67-F77 AromaticContact CH2-CE2 3.96Å; W67-F77 HydrophobicContact CH2-CE2 3.96Å; W67-F77 AromaticContact CH2-CG 3.31Å; W67-F77 HydrophobicContact CH2-CG 3.31Å; W67-F77 HydrophobicContact CH2-CZ 4.15Å; W67-F77 AromaticContact CZ2-CD1 3.35Å; W67-F77 HydrophobicContact CZ2-CD1 3.35Å; W67-F77 AromaticContact CZ2-CD2 3.76Å; W67-F77 HydrophobicContact CZ2-CD2 3.76Å; W67-F77 AromaticContact CZ2-CE1 3.28Å; W67-F77 HydrophobicContact CZ2-CE1 3.28Å; W67-F77 AromaticContact CZ2-CE2 3.69Å; W67-F77 HydrophobicContact CZ2-CE2 3.69Å; W67-F77 AromaticContact CZ2-CG 3.61Å; W67-F77 HydrophobicContact CZ2-CG 3.61Å; W67-F77 AromaticContact CZ2-CZ 3.46Å; W67-F77 HydrophobicContact CZ2-CZ 3.46Å; W67-F77 VanDerWaalsContact CZ2-CZ 3.46Å; W67-F77 HydrophobicContact CZ3-CB 3.68Å; W67-F77 AromaticContact CZ3-CD1 3.77Å; W67-F77 HydrophobicContact CZ3-CD1 3.77Å; W67-F77 HydrophobicContact CZ3-CD2 4.32Å; W67-F77 AromaticContact CZ3-CG 3.66Å; W67-F77 HydrophobicContact CZ3-CG 3.66Å; W67-F77 AromaticContact NE1-CE1 3.55Å; W67-A79 HydrophobicContact CB-CB 4.43Å; W67-A79 HydrophobicContact CG-CB 4.29Å; W67-T147 HydrophobicContact CZ3-CG2 4.15Å; W67-Y183 HydrophobicContact CH2-CD1 4.33Å; W67-Y183 HydrophobicContact CH2-CD2 4.22Å; W67-Y183 AromaticContact CH2-CE1 3.85Å; W67-Y183 HydrophobicContact CH2-CE1 3.85Å; W67-Y183 AromaticContact CH2-CE2 3.74Å; W67-Y183 HydrophobicContact CH2-CE2 3.74Å; W67-Y183 HydrophobicContact CH2-CG 4.48Å; W67-Y183 AromaticContact CH2-CZ 3.53Å; W67-Y183 AromaticContact CZ2-CE1 3.98Å; W67-Y183 HydrophobicContact CZ2-CE1 3.98Å; W67-Y183 HydrophobicContact CZ2-CE2 4.4Å; W67-Y183 AromaticContact CZ2-CZ 3.75Å
68	N	87.8	Confident	95.1	Very high	43 Å²	43	27.3 Å²	27.3	23%	0.23	13%	0.134	C	C	.	.	H	α-helix	trans	-71.2	-40.5	168.7	-61.2	143.5	0	0	0	110.8	E64 S65 A66 E70 N71	E64-N68 HydrophobicContact CG-CB 3.78Å; S65-N68 PolarHBondContact N-OD1 2.94Å; S65-N68 VanDerWaalsContact N-OD1 3.12Å; S65-N68 WeakPolarHBondContact O-CA 3.47Å; S65-N68 WeakPolarHBondContact O-CB 3.33Å; S65-N68 PolarHBondContact O-N 2.95Å; S65-N68 PolarHBondContact OG-N 2.84Å; S65-N68 PolarHBondContact OG-ND2 3.35Å; S65-N68 PolarHBondContact OG-OD1 3.23Å; A66-N68 VanDerWaalsContact C-N 3.34Å; A66-N68 PolarHBondContact O-N 3.36Å; N68-E70 VanDerWaalsContact C-N 3.34Å; N68-N71 PolarHBondContact O-N 3.39Å; N68-N71 VanDerWaalsContact O-N 3.08Å
69	Q	88.6	Confident	95.1	Very high	134 Å²	134	27.4 Å²	27.4	63%	0.626	14%	0.135	S	C	*	.	H	α-helix	trans	-61.2	-42.2	173.9	-174.6	-179.3	-3.5	0	0	111.4	S65 A66 N71	S65-Q69 PolarHBondContact O-N 3.38Å; S65-Q69 VanDerWaalsContact O-N 3.11Å; A66-Q69 WeakPolarHBondContact O-CB 3.32Å; A66-Q69 PolarHBondContact O-N 3.19Å; Q69-N71 PolarHBondContact O-N 3.25Å
70	E	90.4	Very high	95	Very high	94 Å²	94	30.7 Å²	30.7	44%	0.439	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	1.5	174.7	-65.3	167.9	-152.1	0	0	114.1	A66 N68 R72 N150	A66-E70 WeakPolarHBondContact O-CG 3.3Å; A66-E70 PolarHBondContact O-N 2.99Å; N68-E70 VanDerWaalsContact C-N 3.34Å; E70-R72 VanDerWaalsContact C-N 3.28Å; E70-R72 HydrophobicContact CB-CG 4Å; E70-R72 PolarHBondContact O-N 3.15Å; E70-R72 WeakPolarHBondContact OE2-CD 3.33Å; E70-R72 IonicContact OE2-NH1 2.6Å; E70-R72 PolarHBondContact OE2-NH1 3.14Å; E70-N150 PolarHBondContact O-ND2 3.17Å
71	N	89.1	Confident	95	Very high	65 Å²	65	31.5 Å²	31.5	35%	0.348	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	33.7	-176.5	-164.5	41.3	0	0	0	114.8	W67 N68 Q69 N150 K151	W67-N71 PolarHBondContact O-N 3.27Å; N68-N71 PolarHBondContact O-N 3.39Å; N68-N71 VanDerWaalsContact O-N 3.08Å; Q69-N71 PolarHBondContact O-N 3.25Å; N71-N150 PolarHBondContact ND2-OD1 3.15Å; N71-K151 WeakPolarHBondContact O-CG 3.47Å; N71-K151 PolarHBondContact O-N 3.03Å
72	R	93.5	Very high	95	Very high	45 Å²	45	30.7 Å²	30.7	17%	0.17	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-99.7	154.3	-179.5	-62.9	173.4	71.9	-152.7	-0.8	112.7	W67 E70 C74 G148 L149 Y183	W67-R72 HydrophobicContact CB-CB 4.22Å; W67-R72 HydrophobicContact CD2-CB 4.32Å; W67-R72 HydrophobicContact CE3-CB 4.12Å; W67-R72 HydrophobicContact CG-CB 4.37Å; W67-R72 VanDerWaalsContact NE1-NH1 3.14Å; W67-R72 PolarHBondContact O-N 2.8Å; E70-R72 VanDerWaalsContact C-N 3.28Å; E70-R72 HydrophobicContact CB-CG 4Å; E70-R72 PolarHBondContact O-N 3.15Å; E70-R72 WeakPolarHBondContact OE2-CD 3.33Å; E70-R72 IonicContact OE2-NH1 2.6Å; E70-R72 PolarHBondContact OE2-NH1 3.14Å; R72-C74 PolarHBondContact O-N 3.27Å; R72-G148 PolarHBondContact NE-O 3.44Å; R72-G148 PolarHBondContact NH2-O 2.99Å; R72-L149 CarbonylContact C-O 3.59Å; R72-L149 VanDerWaalsContact CA-O 3.25Å; R72-L149 WeakPolarHBondContact CA-O 3.35Å; R72-Y183 PolarHBondContact NH2-OH 2.89Å
73	F	93.4	Very high	94.9	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	19%	0.193	C	C	.	.			trans	-73.1	107.1	169.4	-71.8	-83.2	0	0	0	110.1	W67 Y143 L146 G148 L149 K151 T154 V163 R167	W67-F73 WeakPolarHBondContact CZ3-O 3.46Å; F73-Y143 HydrophobicContact CB-CD2 4.27Å; F73-Y143 HydrophobicContact CB-CG 4.27Å; F73-Y143 AromaticContact CD1-CD1 3.73Å; F73-Y143 HydrophobicContact CD1-CD1 3.73Å; F73-Y143 HydrophobicContact CD1-CD2 4.16Å; F73-Y143 AromaticContact CD1-CE1 3.98Å; F73-Y143 HydrophobicContact CD1-CE1 3.98Å; F73-Y143 HydrophobicContact CD1-CE2 4.41Å; F73-Y143 AromaticContact CD1-CG 3.84Å; F73-Y143 HydrophobicContact CD1-CG 3.84Å; F73-Y143 HydrophobicContact CE1-CD1 4.19Å; F73-Y143 HydrophobicContact CE1-CE1 4.25Å; F73-Y143 HydrophobicContact CG-CG 4.48Å; F73-L146 HydrophobicContact CB-CB 4.41Å; F73-L146 VanDerWaalsContact CB-O 3.29Å; F73-L146 WeakPolarHBondContact CB-O 3.22Å; F73-L146 HydrophobicContact CD2-CB 4.04Å; F73-L146 HydrophobicContact CE1-CD1 4.37Å; F73-L146 HydrophobicContact CE2-CB 4.39Å; F73-L146 HydrophobicContact CE2-CD1 4.44Å; F73-L146 HydrophobicContact CG-CB 4.11Å; F73-L146 HydrophobicContact CZ-CD1 4.21Å; F73-G148 PolarHBondContact O-N 2.87Å; F73-L149 HydrophobicContact CD2-CB 4.45Å; F73-L149 WeakPolarHBondContact CD2-O 3.44Å; F73-L149 PolarHBondContact N-O 2.87Å; F73-K151 HydrophobicContact CD1-CG 4.39Å; F73-K151 HydrophobicContact CD2-CG 3.8Å; F73-K151 HydrophobicContact CE1-CG 4.17Å; F73-K151 HydrophobicContact CE2-CB 4.21Å; F73-K151 HydrophobicContact CE2-CG 3.54Å; F73-K151 HydrophobicContact CG-CG 4.23Å; F73-K151 HydrophobicContact CZ-CB 4.5Å; F73-K151 HydrophobicContact CZ-CG 3.74Å; F73-T154 HydrophobicContact CE2-CG2 4.41Å; F73-V163 HydrophobicContact CZ-CG1 4.25Å; F73-R167 HydrophobicContact CE1-CG 3.7Å; F73-R167 HydrophobicContact CZ-CG 3.98Å
74	C	95.1	Very high	94.9	Very high	7 Å²	7	44.2 Å²	44.2	5%	0.047	22%	0.217	C	C	.	.			trans	-82.5	-58.8	-178	-175.6	0	0	0	0	113	W67 R72 W76 F77	W67-C74 HydrophobicContact CB-CB 4.03Å; W67-C74 HydrophobicContact CE3-CB 4.14Å; R72-C74 PolarHBondContact O-N 3.27Å; C74-W76 PolarHBondContact O-N 2.97Å; C74-F77 VanDerWaalsContact O-CB 3.3Å; C74-F77 WeakPolarHBondContact O-CB 3.39Å; C74-F77 PolarHBondContact O-N 3.11Å; C74-F77 PolarHBondContact SG-O 2.91Å; C74-F77 VanDerWaalsContact SG-O 3.35Å
75	G	96.4	Very high	95	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	-123.1	179	0	0	0	0	0	111.8	R113 R141 Y143	G75-R113 PolarHBondContact O-NH2 3.3Å; G75-R141 VanDerWaalsContact CA-O 3.27Å; G75-R141 WeakPolarHBondContact CA-O 3.4Å; G75-Y143 VanDerWaalsContact CA-CD2 3.47Å
76	W	98.4	Very high	95.1	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.011	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.4	-178.7	-76	36.4	0	0	0	114.2	C74 D78 W136 N139 E140 H142 I187 Y193 L201 P202	C74-W76 PolarHBondContact O-N 2.97Å; W76-D78 PolarHBondContact O-N 2.79Å; W76-W136 HydrophobicContact CH2-CD2 4.42Å; W76-W136 AromaticContact CH2-CE3 3.58Å; W76-W136 HydrophobicContact CH2-CE3 3.58Å; W76-W136 HydrophobicContact CH2-CZ3 4.09Å; W76-W136 AromaticContact CZ2-CE3 3.82Å; W76-W136 HydrophobicContact CZ2-CE3 3.82Å; W76-W136 HydrophobicContact CZ2-CZ3 4.2Å; W76-N139 HydrophobicContact CZ2-CB 4.23Å; W76-E140 PolarHBondContact NE1-O 2.89Å; W76-H142 AromaticContact CD1-CD2 3.83Å; W76-H142 HydrophobicContact CD2-CB 4.46Å; W76-H142 AromaticContact CD2-CD2 3.39Å; W76-H142 AromaticContact CE2-CD2 3.83Å; W76-H142 AromaticContact CE3-CD2 3.77Å; W76-H142 HydrophobicContact CG-CB 4.28Å; W76-H142 AromaticContact CG-CD2 3.4Å; W76-I187 HydrophobicContact CB-CG2 3.74Å; W76-I187 HydrophobicContact CE3-CG2 4.36Å; W76-Y193 AromaticContact CE3-CE1 3.9Å; W76-Y193 HydrophobicContact CE3-CE1 3.9Å; W76-Y193 AromaticContact CE3-CE2 3.8Å; W76-Y193 HydrophobicContact CE3-CE2 3.8Å; W76-Y193 AromaticContact CE3-CZ 3.42Å; W76-Y193 VanDerWaalsContact CE3-CZ 3.42Å; W76-Y193 HydrophobicContact CH2-CE1 4.3Å; W76-Y193 AromaticContact CZ3-CD1 3.93Å; W76-Y193 HydrophobicContact CZ3-CD1 3.93Å; W76-Y193 HydrophobicContact CZ3-CD2 4.36Å; W76-Y193 AromaticContact CZ3-CE1 3.52Å; W76-Y193 HydrophobicContact CZ3-CE1 3.52Å; W76-Y193 AromaticContact CZ3-CE2 3.98Å; W76-Y193 HydrophobicContact CZ3-CE2 3.98Å; W76-Y193 HydrophobicContact CZ3-CG 4.34Å; W76-Y193 AromaticContact CZ3-CZ 3.54Å; W76-L201 HydrophobicContact CE3-CD1 4.24Å; W76-L201 HydrophobicContact CH2-CD1 4.03Å; W76-L201 HydrophobicContact CZ3-CD1 3.38Å; W76-P202 HydrophobicContact CH2-CG 3.79Å; W76-P202 HydrophobicContact CZ2-CG 3.66Å
77	F	98.2	Very high	95.2	Very high	37 Å²	37	48.3 Å²	48.3	16%	0.162	23%	0.234	C	C	.	.	S	Bend	trans	-60.2	134.8	167	179.8	-97.5	0	0	0	109.6	W67 C74 A79 R113 T147 Y183 I186 I187	W67-F77 AromaticContact CD2-CD1 3.68Å; W67-F77 HydrophobicContact CD2-CD1 3.68Å; W67-F77 AromaticContact CD2-CE1 3.96Å; W67-F77 HydrophobicContact CD2-CE1 3.96Å; W67-F77 HydrophobicContact CD2-CG 4.41Å; W67-F77 AromaticContact CE2-CD1 3.41Å; W67-F77 VanDerWaalsContact CE2-CD1 3.41Å; W67-F77 AromaticContact CE2-CE1 3.27Å; W67-F77 AromaticContact CE2-CZ 3.88Å; W67-F77 HydrophobicContact CE3-CB 4.31Å; W67-F77 AromaticContact CE3-CD1 3.89Å; W67-F77 HydrophobicContact CE3-CD1 3.89Å; W67-F77 HydrophobicContact CE3-CG 4.23Å; W67-F77 HydrophobicContact CG-CD1 4.42Å; W67-F77 HydrophobicContact CH2-CB 3.81Å; W67-F77 AromaticContact CH2-CD1 3.51Å; W67-F77 HydrophobicContact CH2-CD1 3.51Å; W67-F77 AromaticContact CH2-CD2 3.56Å; W67-F77 HydrophobicContact CH2-CD2 3.56Å; W67-F77 AromaticContact CH2-CE1 3.94Å; W67-F77 HydrophobicContact CH2-CE1 3.94Å; W67-F77 AromaticContact CH2-CE2 3.96Å; W67-F77 HydrophobicContact CH2-CE2 3.96Å; W67-F77 AromaticContact CH2-CG 3.31Å; W67-F77 HydrophobicContact CH2-CG 3.31Å; W67-F77 HydrophobicContact CH2-CZ 4.15Å; W67-F77 AromaticContact CZ2-CD1 3.35Å; W67-F77 HydrophobicContact CZ2-CD1 3.35Å; W67-F77 AromaticContact CZ2-CD2 3.76Å; W67-F77 HydrophobicContact CZ2-CD2 3.76Å; W67-F77 AromaticContact CZ2-CE1 3.28Å; W67-F77 HydrophobicContact CZ2-CE1 3.28Å; W67-F77 AromaticContact CZ2-CE2 3.69Å; W67-F77 HydrophobicContact CZ2-CE2 3.69Å; W67-F77 AromaticContact CZ2-CG 3.61Å; W67-F77 HydrophobicContact CZ2-CG 3.61Å; W67-F77 AromaticContact CZ2-CZ 3.46Å; W67-F77 HydrophobicContact CZ2-CZ 3.46Å; W67-F77 VanDerWaalsContact CZ2-CZ 3.46Å; W67-F77 HydrophobicContact CZ3-CB 3.68Å; W67-F77 AromaticContact CZ3-CD1 3.77Å; W67-F77 HydrophobicContact CZ3-CD1 3.77Å; W67-F77 HydrophobicContact CZ3-CD2 4.32Å; W67-F77 AromaticContact CZ3-CG 3.66Å; W67-F77 HydrophobicContact CZ3-CG 3.66Å; W67-F77 AromaticContact NE1-CE1 3.55Å; C74-F77 VanDerWaalsContact O-CB 3.3Å; C74-F77 WeakPolarHBondContact O-CB 3.39Å; C74-F77 PolarHBondContact O-N 3.11Å; C74-F77 PolarHBondContact SG-O 2.91Å; C74-F77 VanDerWaalsContact SG-O 3.35Å; F77-A79 HydrophobicContact CD1-CB 3.75Å; F77-A79 HydrophobicContact CE1-CB 3.84Å; F77-A79 PolarHBondContact O-N 3.22Å; F77-R113 PolarHBondContact O-NH1 2.86Å; F77-T147 HydrophobicContact CB-CG2 4.11Å; F77-Y183 AromaticContact CD2-CD1 3.85Å; F77-Y183 HydrophobicContact CD2-CD1 3.85Å; F77-Y183 HydrophobicContact CD2-CE1 4.09Å; F77-Y183 HydrophobicContact CD2-CG 4.48Å; F77-Y183 AromaticContact CE2-CD1 3.94Å; F77-Y183 HydrophobicContact CE2-CD1 3.94Å; F77-Y183 AromaticContact CE2-CE1 3.85Å; F77-Y183 HydrophobicContact CE2-CE1 3.85Å; F77-I186 HydrophobicContact CD2-CD1 3.78Å; F77-I186 HydrophobicContact CE2-CD1 3.57Å; F77-I187 HydrophobicContact CB-CD1 4.16Å
78	D	98.1	Very high	95.4	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	23%	0.234	C	C	.	.			trans	-87.3	55.5	-172.1	-158.6	26.2	0	0	0	111.8	W76 L111 K112 R192	W76-D78 PolarHBondContact O-N 2.79Å; D78-L111 WeakPolarHBondContact OD1-CA 3.26Å; D78-K112 WeakPolarHBondContact O-CD 3.26Å; D78-K112 WeakPolarHBondContact O-CE 3.46Å; D78-K112 WeakPolarHBondContact OD1-CG 3.14Å; D78-K112 PolarHBondContact OD1-N 3.01Å; D78-K112 WeakPolarHBondContact OD2-CE 3.36Å; D78-R192 IonicContact OD1-NH1 3.43Å; D78-R192 PolarHBondContact OD1-NH1 2.89Å; D78-R192 IonicContact OD2-CZ 3.14Å; D78-R192 VanDerWaalsContact OD2-CZ 3.28Å; D78-R192 IonicContact OD2-NH1 3.06Å; D78-R192 PolarHBondContact OD2-NH1 3.49Å; D78-R192 IonicContact OD2-NH2 3Å; D78-R192 PolarHBondContact OD2-NH2 2.92Å
79	A	97.1	Very high	95.8	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.033	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-63.8	142.7	177.2	0	0	0	0	0	111.8	W67 F77 K112	W67-A79 HydrophobicContact CB-CB 4.43Å; W67-A79 HydrophobicContact CG-CB 4.29Å; F77-A79 HydrophobicContact CD1-CB 3.75Å; F77-A79 HydrophobicContact CE1-CB 3.84Å; F77-A79 PolarHBondContact O-N 3.22Å; A79-K112 WeakPolarHBondContact O-CG 3.28Å
80	D	97.9	Very high	96.3	Very high	68 Å²	68	44.2 Å²	44.2	36%	0.364	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-71.7	163.3	168.4	-78.7	-73.1	0	0	0	111.7	S65 A66 K112 Q116	S65-D80 VanDerWaalsContact CA-O 3.31Å; S65-D80 WeakPolarHBondContact CA-O 3.31Å; S65-D80 WeakPolarHBondContact CB-O 3.48Å; A66-D80 PolarHBondContact N-O 2.86Å; D80-K112 HydrophobicContact CB-CD 4.24Å; D80-K112 WeakPolarHBondContact OD1-CD 3.34Å; D80-K112 IonicContact OD1-NZ 3.93Å; D80-K112 WeakPolarHBondContact OD2-CD 3.37Å; D80-K112 IonicContact OD2-NZ 2.82Å; D80-K112 PolarHBondContact OD2-NZ 3.47Å; D80-Q116 PolarHBondContact OD1-NE2 3.25Å
81	L	98.1	Very high	96.6	Very high	18 Å²	18	44.2 Å²	44.2	9%	0.094	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-63.2	144.7	164.8	-67.4	172.9	0	0	0	110.1	H62 G63 V86 R113 Q116	H62-L81 HydrophobicContact CB-CD2 4.46Å; G63-L81 VanDerWaalsContact O-CD2 3.28Å; G63-L81 WeakPolarHBondContact O-CD2 3.44Å; L81-V86 HydrophobicContact CB-CG2 3.89Å; L81-V86 HydrophobicContact CD1-CG2 4.26Å; L81-R113 HydrophobicContact CD2-CB 3.89Å; L81-R113 HydrophobicContact CG-CB 4.12Å; L81-Q116 HydrophobicContact CD1-CB 3.83Å
82	S	97.6	Very high	97.1	Very high	7 Å²	7	41.3 Å²	41.3	5%	0.049	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-73	167.7	163.8	67.4	0	0	0	0	109.8	E64 K84 G85 V86	E64-S82 PolarHBondContact O-N 3.44Å; E64-S82 PolarHBondContact O-OG 3.26Å; E64-S82 PolarHBondContact OE2-OG 3.05Å; E64-S82 VanDerWaalsContact OE2-OG 3.09Å; S82-K84 PolarHBondContact O-N 3.16Å; S82-G85 CarbonylContact O-C 3.6Å; S82-G85 WeakPolarHBondContact O-CA 3.37Å; S82-G85 PolarHBondContact O-N 3.23Å; S82-G85 PolarHBondContact OG-N 2.71Å; S82-G85 VanDerWaalsContact OG-N 3.08Å; S82-V86 PolarHBondContact O-N 3.47Å
83	E	97.2	Very high	97.3	Very high	176 Å²	176	39.1 Å²	39.1	82%	0.822	19%	0.186	S	C	*	.	H	α-helix	trans	-53.7	-44.1	172.3	-66.4	179.2	175.8	0	0	111	G85 V86 E87	E83-G85 VanDerWaalsContact C-N 3.34Å; E83-G85 PolarHBondContact O-N 2.8Å; E83-V86 PolarHBondContact O-N 2.88Å; E83-E87 PolarHBondContact O-N 3.16Å; E83-E87 VanDerWaalsContact O-N 3.13Å
84	K	95.9	Very high	97.5	Very high	113 Å²	113	42.7 Å²	42.7	49%	0.491	20%	0.202	S	C	.	.	H	α-helix	trans	-59.6	-43.2	173	178.6	179.8	163.5	-154.6	0	112	E64 S82 V86 E87 E88	E64-K84 IonicContact OE1-NZ 3.34Å; E64-K84 PolarHBondContact OE1-NZ 3.02Å; S82-K84 PolarHBondContact O-N 3.16Å; K84-V86 VanDerWaalsContact C-N 3.31Å; K84-V86 PolarHBondContact O-N 3.24Å; K84-E87 PolarHBondContact O-N 3.35Å; K84-E88 VanDerWaalsContact CE-OE1 3.27Å; K84-E88 WeakPolarHBondContact CE-OE1 3.23Å; K84-E88 HydrophobicContact CG-CG 4.44Å; K84-E88 WeakPolarHBondContact O-CG 3.42Å; K84-E88 PolarHBondContact O-N 3.34Å
85	G	97.2	Very high	97.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-34.4	177.3	0	0	0	0	0	114.1	E64 S82 E83 E88 A89	E64-G85 VanDerWaalsContact O-CA 3.32Å; E64-G85 WeakPolarHBondContact O-CA 3.4Å; S82-G85 CarbonylContact O-C 3.6Å; S82-G85 WeakPolarHBondContact O-CA 3.37Å; S82-G85 PolarHBondContact O-N 3.23Å; S82-G85 PolarHBondContact OG-N 2.71Å; S82-G85 VanDerWaalsContact OG-N 3.08Å; E83-G85 VanDerWaalsContact C-N 3.34Å; E83-G85 PolarHBondContact O-N 2.8Å; G85-E88 PolarHBondContact O-N 3.32Å; G85-A89 PolarHBondContact O-N 2.89Å
86	V	98.3	Very high	97.8	Very high	51 Å²	51	42.9 Å²	42.9	31%	0.309	20%	0.204	S	C	.	.	H	α-helix	trans	-65	-45.1	172.7	173.3	0	0	0	0	110.5	L81 S82 E83 K84 E88 A89 K90	L81-V86 HydrophobicContact CB-CG2 3.89Å; L81-V86 HydrophobicContact CD1-CG2 4.26Å; S82-V86 PolarHBondContact O-N 3.47Å; E83-V86 PolarHBondContact O-N 2.88Å; K84-V86 VanDerWaalsContact C-N 3.31Å; K84-V86 PolarHBondContact O-N 3.24Å; V86-E88 PolarHBondContact O-N 3.05Å; V86-A89 PolarHBondContact O-N 2.85Å; V86-K90 WeakPolarHBondContact O-CG 3.33Å; V86-K90 PolarHBondContact O-N 3.14Å
87	E	97.4	Very high	97.7	Very high	98 Å²	98	48 Å²	48	46%	0.458	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-36.2	176.8	-65.1	-51.7	124.5	0	0	112.7	E83 K84 K90 R91	E83-E87 PolarHBondContact O-N 3.16Å; E83-E87 VanDerWaalsContact O-N 3.13Å; K84-E87 PolarHBondContact O-N 3.35Å; E87-K90 PolarHBondContact O-N 2.79Å; E87-K90 IonicContact OE1-NZ 3.58Å; E87-K90 PolarHBondContact OE1-NZ 3.09Å; E87-R91 WeakPolarHBondContact O-CB 3.27Å; E87-R91 PolarHBondContact O-N 3.18Å
88	E	96.9	Very high	97.7	Very high	13 Å²	13	52.9 Å²	52.9	6%	0.061	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-44.5	171	-73.4	179.6	167.2	0	0	111.7	G63 E64 K84 G85 V86 R91 G92 T263	G63-E88 VanDerWaalsContact CA-OE2 3.23Å; G63-E88 WeakPolarHBondContact CA-OE2 3.11Å; E64-E88 PolarHBondContact N-OE2 3.06Å; K84-E88 VanDerWaalsContact CE-OE1 3.27Å; K84-E88 WeakPolarHBondContact CE-OE1 3.23Å; K84-E88 HydrophobicContact CG-CG 4.44Å; K84-E88 WeakPolarHBondContact O-CG 3.42Å; K84-E88 PolarHBondContact O-N 3.34Å; G85-E88 PolarHBondContact O-N 3.32Å; V86-E88 PolarHBondContact O-N 3.05Å; E88-R91 PolarHBondContact O-N 3.47Å; E88-G92 PolarHBondContact O-N 3.24Å; E88-T263 PolarHBondContact OE1-OG1 3.09Å; E88-T263 VanDerWaalsContact OE2-CB 3.25Å; E88-T263 WeakPolarHBondContact OE2-CB 3.33Å; E88-T263 PolarHBondContact OE2-OG1 3.45Å
89	A	98.1	Very high	97.7	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-43.1	176.9	0	0	0	0	0	112.2	G85 V86 G92 A93 T117 T120	G85-A89 PolarHBondContact O-N 2.89Å; V86-A89 PolarHBondContact O-N 2.85Å; A89-G92 PolarHBondContact O-N 3.25Å; A89-A93 VanDerWaalsContact O-CB 3.29Å; A89-A93 WeakPolarHBondContact O-CB 3.24Å; A89-A93 PolarHBondContact O-N 2.94Å; A89-T117 HydrophobicContact CB-CG2 4.05Å; A89-T120 HydrophobicContact CB-CG2 4.11Å
90	K	98.2	Very high	97.7	Very high	91 Å²	91	56 Å²	56	40%	0.396	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-43.8	175.6	-71.7	175.8	-174.5	166.2	0	112.2	V86 E87 A93 Q94 T120	V86-K90 WeakPolarHBondContact O-CG 3.33Å; V86-K90 PolarHBondContact O-N 3.14Å; E87-K90 PolarHBondContact O-N 2.79Å; E87-K90 IonicContact OE1-NZ 3.58Å; E87-K90 PolarHBondContact OE1-NZ 3.09Å; K90-A93 WeakPolarHBondContact O-CB 3.32Å; K90-A93 PolarHBondContact O-N 3.36Å; K90-Q94 WeakPolarHBondContact O-CB 3Å; K90-Q94 PolarHBondContact O-N 3.18Å; K90-T120 HydrophobicContact CB-CG2 4.35Å; K90-T120 HydrophobicContact CG-CG2 3.71Å
91	R	97.6	Very high	97.6	Very high	94 Å²	94	54.1 Å²	54.1	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-63.7	-44.9	178.2	-173.7	176.3	60.5	-110.6	-0.1	111.7	E87 E88 A93 Q94 A95 T289	E87-R91 WeakPolarHBondContact O-CB 3.27Å; E87-R91 PolarHBondContact O-N 3.18Å; E88-R91 PolarHBondContact O-N 3.47Å; R91-A93 VanDerWaalsContact C-N 3.31Å; R91-A93 PolarHBondContact O-N 3.07Å; R91-Q94 PolarHBondContact O-N 3.5Å; R91-A95 PolarHBondContact O-N 3.48Å; R91-T289 VanDerWaalsContact NE-CG2 3.27Å
92	G	97.9	Very high	97.6	Very high	3 Å²	3	59.5 Å²	59.5	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-40.7	174	0	0	0	0	0	112.5	E88 A89 A95 I96 G264 P266	E88-G92 PolarHBondContact O-N 3.24Å; A89-G92 PolarHBondContact O-N 3.25Å; G92-A95 PolarHBondContact O-N 3.23Å; G92-I96 WeakPolarHBondContact O-CG1 3.45Å; G92-I96 PolarHBondContact O-N 3.47Å; G92-G264 WeakPolarHBondContact CA-O 3.43Å; G92-P266 WeakPolarHBondContact O-CG 3.48Å
93	A	98.4	Very high	97.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-41.7	175.5	0	0	0	0	0	112.9	A89 K90 R91 I96 K97 T120 I121 V124	A89-A93 VanDerWaalsContact O-CB 3.29Å; A89-A93 WeakPolarHBondContact O-CB 3.24Å; A89-A93 PolarHBondContact O-N 2.94Å; K90-A93 WeakPolarHBondContact O-CB 3.32Å; K90-A93 PolarHBondContact O-N 3.36Å; R91-A93 VanDerWaalsContact C-N 3.31Å; R91-A93 PolarHBondContact O-N 3.07Å; A93-I96 PolarHBondContact O-N 2.87Å; A93-K97 PolarHBondContact O-N 3.41Å; A93-T120 HydrophobicContact CB-CG2 4.48Å; A93-I121 HydrophobicContact CB-CB 4.26Å; A93-I121 HydrophobicContact CB-CG1 3.88Å; A93-V124 HydrophobicContact CB-CB 3.71Å; A93-V124 HydrophobicContact CB-CG1 3.89Å; A93-V124 HydrophobicContact CB-CG2 3.94Å
94	Q	98.2	Very high	97.7	Very high	76 Å²	76	54.4 Å²	54.4	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-42.5	176.2	-175.1	58.7	34.1	0	0	111.3	K90 R91 I96 K97 E98	K90-Q94 WeakPolarHBondContact O-CB 3Å; K90-Q94 PolarHBondContact O-N 3.18Å; R91-Q94 PolarHBondContact O-N 3.5Å; Q94-I96 VanDerWaalsContact C-N 3.34Å; Q94-I96 PolarHBondContact O-N 3.3Å; Q94-K97 WeakPolarHBondContact O-CB 3.48Å; Q94-K97 PolarHBondContact O-N 3.19Å; Q94-K97 VanDerWaalsContact O-N 3.14Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.42Å; Q94-E98 PolarHBondContact NE2-OE1 2.82Å; Q94-E98 WeakPolarHBondContact O-CG 3.43Å; Q94-E98 PolarHBondContact O-N 3.1Å
95	A	97.9	Very high	97.8	Very high	11 Å²	11	49.2 Å²	49.2	9%	0.091	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-39.2	175.6	0	0	0	0	0	112.6	R91 G92 A99 L284	R91-A95 PolarHBondContact O-N 3.48Å; G92-A95 PolarHBondContact O-N 3.23Å; A95-A99 WeakPolarHBondContact O-CB 3.14Å; A95-A99 PolarHBondContact O-N 3.37Å; A95-L284 HydrophobicContact CB-CB 3.98Å
96	I	98.3	Very high	97.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-43.3	173.5	-70.8	169	0	0	0	110.9	V58 G92 A93 Q94 A99 G100 M101 F103 I121 T125 I233 P266 L284	V58-I96 HydrophobicContact CG1-CD1 4.47Å; G92-I96 WeakPolarHBondContact O-CG1 3.45Å; G92-I96 PolarHBondContact O-N 3.47Å; A93-I96 PolarHBondContact O-N 2.87Å; Q94-I96 VanDerWaalsContact C-N 3.34Å; Q94-I96 PolarHBondContact O-N 3.3Å; I96-A99 PolarHBondContact O-N 2.76Å; I96-G100 PolarHBondContact O-N 2.83Å; I96-M101 HydrophobicContact CG2-CB 3.95Å; I96-M101 PolarHBondContact O-N 3.24Å; I96-F103 HydrophobicContact CG2-CE2 3.63Å; I96-F103 HydrophobicContact CG2-CZ 3.85Å; I96-I121 HydrophobicContact CD1-CD1 4.18Å; I96-I121 HydrophobicContact CD1-CG1 4.28Å; I96-I121 HydrophobicContact CD1-CG2 3.66Å; I96-T125 HydrophobicContact CB-CG2 4.17Å; I96-T125 HydrophobicContact CG2-CG2 3.65Å; I96-I233 HydrophobicContact CD1-CD1 4.03Å; I96-P266 HydrophobicContact CD1-CB 3.97Å; I96-P266 HydrophobicContact CD1-CG 3.71Å; I96-P266 HydrophobicContact CG1-CB 3.92Å; I96-P266 HydrophobicContact CG1-CG 3.64Å; I96-L284 HydrophobicContact CG1-CD1 4.07Å
97	K	98.2	Very high	97.9	Very high	110 Å²	110	47 Å²	47	48%	0.478	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-47.2	178.7	-174.4	-177.9	-169	154.6	0	111.6	A93 Q94 A99 G100 V124 T125	A93-K97 PolarHBondContact O-N 3.41Å; Q94-K97 WeakPolarHBondContact O-CB 3.48Å; Q94-K97 PolarHBondContact O-N 3.19Å; Q94-K97 VanDerWaalsContact O-N 3.14Å; K97-A99 VanDerWaalsContact C-N 3.31Å; K97-A99 PolarHBondContact O-N 3.35Å; K97-G100 WeakPolarHBondContact O-CA 3.21Å; K97-G100 PolarHBondContact O-N 3.4Å; K97-V124 HydrophobicContact CB-CG1 4.48Å; K97-V124 HydrophobicContact CD-CG1 4.09Å; K97-V124 WeakPolarHBondContact CD-O 3.37Å; K97-V124 WeakPolarHBondContact CE-O 3.49Å; K97-V124 PolarHBondContact NZ-O 3.48Å; K97-T125 HydrophobicContact CB-CG2 4.13Å
98	E	97.5	Very high	98	Very high	141 Å²	141	42.3 Å²	42.3	66%	0.659	22%	0.217	S	C	*	.	H	α-helix	trans	-64.3	-36.2	178.9	-73.6	167.9	-174.2	0	0	112.3	Q94 G100	Q94-E98 WeakPolarHBondContact CG-OE1 3.42Å; Q94-E98 PolarHBondContact NE2-OE1 2.82Å; Q94-E98 WeakPolarHBondContact O-CG 3.43Å; Q94-E98 PolarHBondContact O-N 3.1Å; E98-G100 PolarHBondContact O-N 3.49Å
99	A	96.9	Very high	98.1	Very high	52 Å²	52	41.7 Å²	41.7	43%	0.43	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-2.7	172.3	0	0	0	0	0	113.6	A95 I96 K97 M101 L284	A95-A99 WeakPolarHBondContact O-CB 3.14Å; A95-A99 PolarHBondContact O-N 3.37Å; I96-A99 PolarHBondContact O-N 2.76Å; K97-A99 VanDerWaalsContact C-N 3.31Å; K97-A99 PolarHBondContact O-N 3.35Å; A99-M101 HydrophobicContact CB-CE 4.01Å; A99-M101 HydrophobicContact CB-CG 3.93Å; A99-M101 PolarHBondContact O-N 2.89Å; A99-L284 HydrophobicContact CB-CD1 4.29Å; A99-L284 HydrophobicContact CB-CD2 4.38Å
100	G	97.1	Very high	98.1	Very high	53 Å²	53	42.9 Å²	42.9	55%	0.546	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	23.6	178.6	0	0	0	0	0	113.8	I96 K97 E98	I96-G100 PolarHBondContact O-N 2.83Å; K97-G100 WeakPolarHBondContact O-CA 3.21Å; K97-G100 PolarHBondContact O-N 3.4Å; E98-G100 PolarHBondContact O-N 3.49Å
101	M	96.8	Very high	98.1	Very high	29 Å²	29	38.6 Å²	38.6	14%	0.143	20%	0.203	C	C	.	.			trans	-74.5	134.3	-174	-66.1	-166.4	177.8	0	0	111.9	V58 I96 A99 F103 Q127 V268 L284	V58-M101 HydrophobicContact CG2-SD 3.72Å; I96-M101 HydrophobicContact CG2-CB 3.95Å; I96-M101 PolarHBondContact O-N 3.24Å; A99-M101 HydrophobicContact CB-CE 4.01Å; A99-M101 HydrophobicContact CB-CG 3.93Å; A99-M101 PolarHBondContact O-N 2.89Å; M101-F103 HydrophobicContact CB-CZ 4.08Å; M101-Q127 PolarHBondContact O-NE2 3.26Å; M101-V268 HydrophobicContact CE-CG1 4.15Å; M101-V268 HydrophobicContact CE-CG2 3.7Å; M101-V268 HydrophobicContact SD-CG2 4.31Å; M101-L284 HydrophobicContact CE-CD1 3.58Å; M101-L284 HydrophobicContact CE-CD2 3.97Å; M101-L284 HydrophobicContact CE-CG 4.32Å; M101-L284 HydrophobicContact SD-CD1 3.63Å
102	K	97.4	Very high	98.2	Very high	131 Å²	131	37.3 Å²	37.3	57%	0.57	20%	0.2	S	C	*	.			trans	-117.4	144.4	175.9	-60.6	-61.3	-178.3	-178.5	0	109.6	Q127 N231	K102-Q127 VanDerWaalsContact CA-OE1 3.3Å; K102-N231 WeakPolarHBondContact O-CB 3.5Å
103	F	98.5	Very high	98.2	Very high	9 Å²	9	37.3 Å²	37.3	4%	0.039	20%	0.199	C	C	.	.			trans	-123.4	155.4	-179.9	-53.7	-66.8	0	0	0	110.3	V58 I96 M101 L130 N231 I233	V58-F103 HydrophobicContact CB-CE1 3.82Å; V58-F103 HydrophobicContact CB-CZ 4.09Å; V58-F103 HydrophobicContact CG1-CZ 4.42Å; V58-F103 HydrophobicContact CG2-CE1 3.59Å; V58-F103 HydrophobicContact CG2-CZ 3.93Å; I96-F103 HydrophobicContact CG2-CE2 3.63Å; I96-F103 HydrophobicContact CG2-CZ 3.85Å; M101-F103 HydrophobicContact CB-CZ 4.08Å; F103-L130 HydrophobicContact CB-CD1 3.68Å; F103-L130 WeakPolarHBondContact O-CD1 3.31Å; F103-L130 WeakPolarHBondContact O-CD2 3.4Å; F103-N231 HydrophobicContact CD1-CB 4.45Å; F103-I233 HydrophobicContact CB-CG2 4.22Å; F103-I233 HydrophobicContact CD1-CB 3.77Å; F103-I233 HydrophobicContact CD1-CG2 4.14Å; F103-I233 HydrophobicContact CD2-CB 4.23Å; F103-I233 HydrophobicContact CD2-CD1 4.42Å; F103-I233 HydrophobicContact CD2-CG2 4.01Å; F103-I233 HydrophobicContact CE1-CB 3.82Å; F103-I233 HydrophobicContact CE1-CD1 4.45Å; F103-I233 HydrophobicContact CE2-CB 4.25Å; F103-I233 HydrophobicContact CE2-CD1 3.82Å; F103-I233 HydrophobicContact CE2-CG2 4.43Å; F103-I233 HydrophobicContact CG-CB 3.99Å; F103-I233 HydrophobicContact CG-CG2 3.84Å; F103-I233 HydrophobicContact CZ-CB 4.06Å; F103-I233 HydrophobicContact CZ-CD1 3.84Å; F103-I233 HydrophobicContact CZ-CG1 4.37Å
104	D	98.6	Very high	98.3	Very high	67 Å²	67	37.3 Å²	37.3	36%	0.358	20%	0.199	S	C	.	.	S	Bend	trans	-112.8	-22.8	178.3	-58.4	-70.6	0	0	0	111.5	P131 K230 N231	D104-P131 WeakPolarHBondContact O-CD 3.36Å; D104-P131 WeakPolarHBondContact O-CG 3.21Å; D104-K230 HydrophobicContact CB-CB 3.92Å; D104-K230 HydrophobicContact CB-CD 4.15Å; D104-K230 HydrophobicContact CB-CG 4.05Å; D104-N231 PolarHBondContact N-O 3.23Å; D104-N231 WeakPolarHBondContact OD2-CB 3.25Å; D104-N231 PolarHBondContact OD2-N 3.02Å; D104-N231 PolarHBondContact OD2-ND2 3.41Å
105	V	98.7	Very high	98.3	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	140.1	179.6	61.7	0	0	0	0	111.5	Y107 P131 I133 Q225 K230 V232 I233	V105-Y107 HydrophobicContact CG1-CE2 3.87Å; V105-Y107 HydrophobicContact CG2-CE2 3.94Å; V105-P131 HydrophobicContact CB-CG 4.31Å; V105-P131 HydrophobicContact CG2-CG 4.28Å; V105-I133 HydrophobicContact CG2-CD1 3.28Å; V105-Q225 HydrophobicContact CG1-CB 4.29Å; V105-Q225 HydrophobicContact CG1-CG 4.38Å; V105-K230 HydrophobicContact CG1-CB 4.48Å; V105-K230 HydrophobicContact CG1-CD 4.24Å; V105-V232 HydrophobicContact CG1-CG2 3.76Å; V105-I233 PolarHBondContact O-N 2.92Å
106	C	98.9	Very high	98.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.9	-177.7	-55.5	0	0	0	0	111	L118 P131 V132 I133 I233	C106-L118 HydrophobicContact CB-CD1 3.95Å; C106-L118 HydrophobicContact CB-CD2 3.77Å; C106-L118 HydrophobicContact CB-CG 4.38Å; C106-P131 PolarHBondContact N-O 3.39Å; C106-V132 HydrophobicContact CB-CG2 4.16Å; C106-V132 WeakPolarHBondContact O-CA 3.39Å; C106-I133 PolarHBondContact O-N 3.47Å; C106-I233 WeakPolarHBondContact CA-O 3.43Å; C106-I233 HydrophobicContact CB-CG2 3.9Å; C106-I233 WeakPolarHBondContact SG-CG2 3.23Å
107	Y	98.9	Very high	98.4	Very high	3 Å²	3	36.9 Å²	36.9	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.8	174.1	-62	-82.9	0	0	0	111.1	V105 I133 F217 V221 I222 Q225 V232 I233 I234 A235	V105-Y107 HydrophobicContact CG1-CE2 3.87Å; V105-Y107 HydrophobicContact CG2-CE2 3.94Å; Y107-I133 WeakPolarHBondContact CA-O 3.44Å; Y107-I133 HydrophobicContact CD1-CB 3.69Å; Y107-I133 HydrophobicContact CD1-CD1 4.43Å; Y107-I133 HydrophobicContact CD1-CG1 4.45Å; Y107-I133 HydrophobicContact CD1-CG2 4.11Å; Y107-I133 HydrophobicContact CE1-CB 3.78Å; Y107-I133 HydrophobicContact CE1-CD1 3.96Å; Y107-I133 HydrophobicContact CE1-CG1 4.07Å; Y107-I133 HydrophobicContact CE1-CG2 4.15Å; Y107-F217 AromaticContact CD1-CE1 3.7Å; Y107-F217 HydrophobicContact CD1-CE1 3.7Å; Y107-F217 AromaticContact CD1-CZ 3.71Å; Y107-F217 HydrophobicContact CD1-CZ 3.71Å; Y107-F217 HydrophobicContact CE1-CE1 4.2Å; Y107-F217 AromaticContact CE1-CZ 3.96Å; Y107-F217 HydrophobicContact CE1-CZ 3.96Å; Y107-F217 HydrophobicContact CG-CE1 4.43Å; Y107-V221 HydrophobicContact CE1-CG1 3.77Å; Y107-I222 HydrophobicContact CD1-CG1 4.1Å; Y107-I222 HydrophobicContact CD2-CD1 4.38Å; Y107-I222 HydrophobicContact CD2-CG1 4.02Å; Y107-I222 HydrophobicContact CE1-CG1 4.06Å; Y107-I222 HydrophobicContact CE2-CB 4.45Å; Y107-I222 HydrophobicContact CE2-CG1 3.95Å; Y107-I222 HydrophobicContact CE2-CG2 4.31Å; Y107-I222 HydrophobicContact CG-CD1 4.24Å; Y107-I222 HydrophobicContact CG-CG1 4.08Å; Y107-Q225 WeakPolarHBondContact OH-CG 3.4Å; Y107-V232 HydrophobicContact CD2-CG1 3.53Å; Y107-V232 HydrophobicContact CE2-CG1 3.6Å; Y107-V232 HydrophobicContact CE2-CG2 4.5Å; Y107-I233 PolarHBondContact N-O 3.06Å; Y107-I234 HydrophobicContact CD2-CG1 4.42Å; Y107-I234 WeakPolarHBondContact O-CA 3.48Å; Y107-A235 PolarHBondContact O-N 2.87Å
108	T	98.9	Very high	98.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	171.9	171.7	-168.2	0	0	0	0	111.7	A114 I115 L118 V132 I133 R134 T135 A235	T108-A114 WeakPolarHBondContact OG1-CB 3.31Å; T108-A114 PolarHBondContact OG1-O 3.05Å; T108-I115 HydrophobicContact CG2-CG1 3.78Å; T108-L118 HydrophobicContact CG2-CD2 3.89Å; T108-V132 HydrophobicContact CG2-CG1 4.13Å; T108-I133 PolarHBondContact N-O 3Å; T108-R134 HydrophobicContact CG2-CG 3.74Å; T108-R134 WeakPolarHBondContact O-CA 3.25Å; T108-T135 PolarHBondContact O-N 3.43Å; T108-T135 VanDerWaalsContact O-N 3.08Å; T108-A235 VanDerWaalsContact CA-O 3.24Å; T108-A235 WeakPolarHBondContact CA-O 3.42Å; T108-A235 VanDerWaalsContact CB-O 3.28Å; T108-A235 WeakPolarHBondContact CB-O 3.29Å; T108-A235 PolarHBondContact OG1-O 2.99Å
109	S	98.8	Very high	98.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.			trans	-76.1	-173.6	175	78	0	0	0	0	111.6	L111 A114 T135 N139 H237	S109-L111 VanDerWaalsContact C-N 3.35Å; S109-L111 PolarHBondContact OG-N 3.26Å; S109-L111 VanDerWaalsContact OG-N 3.09Å; S109-A114 WeakPolarHBondContact OG-CB 3.13Å; S109-T135 VanDerWaalsContact CA-O 3.31Å; S109-T135 WeakPolarHBondContact CA-O 3.1Å; S109-N139 WeakPolarHBondContact CB-OD1 2.98Å; S109-H237 WeakPolarHBondContact CB-NE2 3.49Å; S109-H237 PolarHBondContact OG-NE2 2.8Å
110	V	98.8	Very high	98.5	Very high	27 Å²	27	29.4 Å²	29.4	16%	0.164	15%	0.15	C	C	.	.	S	Bend	trans	-97.3	15.7	169.4	-60.8	0	0	0	0	112.6	R134 W136 N139 R192 Y193	V110-R134 HydrophobicContact CG1-CB 4.29Å; V110-W136 HydrophobicContact CG2-CB 4.19Å; V110-N139 VanDerWaalsContact CG2-OD1 3.27Å; V110-N139 WeakPolarHBondContact CG2-OD1 2.94Å; V110-N139 PolarHBondContact N-OD1 3.08Å; V110-N139 VanDerWaalsContact N-OD1 3.14Å; V110-R192 HydrophobicContact CG2-CG 4.45Å; V110-R192 PolarHBondContact O-NH1 3.43Å; V110-Y193 HydrophobicContact CG2-CE1 3.66Å
111	L	98.8	Very high	98.6	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-103.6	129.7	179.8	-57.1	178.7	0	0	0	110.4	D78 S109 R113 A114 I115 N139	D78-L111 WeakPolarHBondContact OD1-CA 3.26Å; S109-L111 VanDerWaalsContact C-N 3.35Å; S109-L111 PolarHBondContact OG-N 3.26Å; S109-L111 VanDerWaalsContact OG-N 3.09Å; L111-R113 VanDerWaalsContact C-N 3.27Å; L111-R113 PolarHBondContact O-N 3.14Å; L111-R113 VanDerWaalsContact O-N 3.12Å; L111-A114 PolarHBondContact O-N 2.63Å; L111-I115 PolarHBondContact O-N 3.01Å; L111-N139 HydrophobicContact CD1-CB 4.22Å
112	K	98.6	Very high	98.7	Very high	68 Å²	68	26 Å²	26	30%	0.296	12%	0.12	S	C	.	.	H	α-helix	trans	-56.3	-36.8	-166.5	68.4	173.4	73.4	173.5	0	113.6	D78 A79 D80 A114 I115 Q116	D78-K112 WeakPolarHBondContact O-CD 3.26Å; D78-K112 WeakPolarHBondContact O-CE 3.46Å; D78-K112 WeakPolarHBondContact OD1-CG 3.14Å; D78-K112 PolarHBondContact OD1-N 3.01Å; D78-K112 WeakPolarHBondContact OD2-CE 3.36Å; A79-K112 WeakPolarHBondContact O-CG 3.28Å; D80-K112 HydrophobicContact CB-CD 4.24Å; D80-K112 WeakPolarHBondContact OD1-CD 3.34Å; D80-K112 IonicContact OD1-NZ 3.93Å; D80-K112 WeakPolarHBondContact OD2-CD 3.37Å; D80-K112 IonicContact OD2-NZ 2.82Å; D80-K112 PolarHBondContact OD2-NZ 3.47Å; K112-A114 VanDerWaalsContact C-N 3.32Å; K112-A114 PolarHBondContact O-N 3.4Å; K112-I115 CarbonylContact O-C 3.58Å; K112-I115 PolarHBondContact O-N 2.95Å; K112-I115 VanDerWaalsContact O-N 3.16Å; K112-Q116 WeakPolarHBondContact O-CB 3.39Å; K112-Q116 VanDerWaalsContact O-CG 3.28Å; K112-Q116 WeakPolarHBondContact O-CG 3.36Å; K112-Q116 PolarHBondContact O-N 3.12Å
113	R	98.7	Very high	98.8	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-61.3	-36.1	179.6	59.1	-170	-178	-90.8	2.7	113.8	H62 G75 F77 L81 L111 T117 H237	H62-R113 VanDerWaalsContact CE1-CD 3.41Å; H62-R113 WeakPolarHBondContact CE1-CD 3.49Å; H62-R113 PolarHBondContact NE2-NE 3.4Å; G75-R113 PolarHBondContact O-NH2 3.3Å; F77-R113 PolarHBondContact O-NH1 2.86Å; L81-R113 HydrophobicContact CD2-CB 3.89Å; L81-R113 HydrophobicContact CG-CB 4.12Å; L111-R113 VanDerWaalsContact C-N 3.27Å; L111-R113 PolarHBondContact O-N 3.14Å; L111-R113 VanDerWaalsContact O-N 3.12Å; R113-T117 WeakPolarHBondContact O-CB 3.44Å; R113-T117 PolarHBondContact O-N 3.13Å; R113-T117 VanDerWaalsContact O-N 3.15Å; R113-T117 PolarHBondContact O-OG1 2.71Å; R113-H237 PolarHBondContact NE-CE1 3.37Å; R113-H237 PolarHBondContact NE-ND1 3.06Å
114	A	98.8	Very high	98.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-76.2	-39.3	175.7	0	0	0	0	0	111	T108 S109 L111 K112 T117 L118	T108-A114 WeakPolarHBondContact OG1-CB 3.31Å; T108-A114 PolarHBondContact OG1-O 3.05Å; S109-A114 WeakPolarHBondContact OG-CB 3.13Å; L111-A114 PolarHBondContact O-N 2.63Å; K112-A114 VanDerWaalsContact C-N 3.32Å; K112-A114 PolarHBondContact O-N 3.4Å; A114-T117 PolarHBondContact O-N 3.11Å; A114-L118 PolarHBondContact O-N 3.3Å
115	I	98.9	Very high	98.8	Very high	22 Å²	22	24.2 Å²	24.2	11%	0.113	11%	0.114	C	C	.	.	H	α-helix	trans	-62.6	-47.9	175.5	-62	166.7	0	0	0	111.1	T108 L111 K112 T117 L118 W119	T108-I115 HydrophobicContact CG2-CG1 3.78Å; L111-I115 PolarHBondContact O-N 3.01Å; K112-I115 CarbonylContact O-C 3.58Å; K112-I115 PolarHBondContact O-N 2.95Å; K112-I115 VanDerWaalsContact O-N 3.16Å; I115-T117 PolarHBondContact O-N 3.4Å; I115-L118 WeakPolarHBondContact O-CB 3.45Å; I115-L118 PolarHBondContact O-N 2.98Å; I115-W119 HydrophobicContact CG2-CD2 3.81Å; I115-W119 VanDerWaalsContact CG2-CE2 3.47Å; I115-W119 HydrophobicContact CG2-CE3 4.23Å; I115-W119 HydrophobicContact CG2-CG 4.38Å; I115-W119 HydrophobicContact CG2-CH2 4.07Å; I115-W119 HydrophobicContact CG2-CZ2 3.63Å; I115-W119 HydrophobicContact CG2-CZ3 4.35Å; I115-W119 VanDerWaalsContact O-CG 3.31Å; I115-W119 PolarHBondContact O-N 3.21Å
116	Q	98.8	Very high	98.8	Very high	56 Å²	56	30.3 Å²	30.3	26%	0.262	15%	0.146	S	C	.	.	H	α-helix	trans	-60.3	-44.5	176.9	-75.5	165.8	-27.2	0	0	110.7	D80 L81 K112 L118 W119 T120	D80-Q116 PolarHBondContact OD1-NE2 3.25Å; L81-Q116 HydrophobicContact CD1-CB 3.83Å; K112-Q116 WeakPolarHBondContact O-CB 3.39Å; K112-Q116 VanDerWaalsContact O-CG 3.28Å; K112-Q116 WeakPolarHBondContact O-CG 3.36Å; K112-Q116 PolarHBondContact O-N 3.12Å; Q116-L118 VanDerWaalsContact C-N 3.33Å; Q116-L118 PolarHBondContact O-N 3.2Å; Q116-W119 PolarHBondContact O-N 3.11Å; Q116-T120 PolarHBondContact O-N 3.24Å; Q116-T120 PolarHBondContact O-OG1 3.45Å; Q116-T120 VanDerWaalsContact O-OG1 3.07Å
117	T	98.9	Very high	98.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.6	-47.3	174.5	-60.3	0	0	0	0	111	V60 H62 A89 R113 A114 I115 T120 I121	V60-T117 HydrophobicContact CG1-CG2 4.33Å; H62-T117 WeakPolarHBondContact CA-OG1 3.37Å; H62-T117 VanDerWaalsContact CB-OG1 3.32Å; H62-T117 WeakPolarHBondContact CB-OG1 3.3Å; A89-T117 HydrophobicContact CB-CG2 4.05Å; R113-T117 WeakPolarHBondContact O-CB 3.44Å; R113-T117 PolarHBondContact O-N 3.13Å; R113-T117 VanDerWaalsContact O-N 3.15Å; R113-T117 PolarHBondContact O-OG1 2.71Å; A114-T117 PolarHBondContact O-N 3.11Å; I115-T117 PolarHBondContact O-N 3.4Å; T117-T120 PolarHBondContact O-N 3.04Å; T117-I121 HydrophobicContact CG2-CD1 4.07Å; T117-I121 WeakPolarHBondContact O-CG1 3.36Å; T117-I121 PolarHBondContact O-N 2.83Å; T117-I121 VanDerWaalsContact O-N 3.09Å
118	L	98.9	Very high	98.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-44.4	177.7	-178.7	58.8	0	0	0	112	C106 T108 A114 I115 Q116 T120 I121 M122 V132 I233 A235	C106-L118 HydrophobicContact CB-CD1 3.95Å; C106-L118 HydrophobicContact CB-CD2 3.77Å; C106-L118 HydrophobicContact CB-CG 4.38Å; T108-L118 HydrophobicContact CG2-CD2 3.89Å; A114-L118 PolarHBondContact O-N 3.3Å; I115-L118 WeakPolarHBondContact O-CB 3.45Å; I115-L118 PolarHBondContact O-N 2.98Å; Q116-L118 VanDerWaalsContact C-N 3.33Å; Q116-L118 PolarHBondContact O-N 3.2Å; L118-T120 PolarHBondContact O-N 3.37Å; L118-I121 WeakPolarHBondContact O-CB 3.5Å; L118-I121 PolarHBondContact O-N 2.79Å; L118-I121 VanDerWaalsContact O-N 3.17Å; L118-M122 HydrophobicContact CD1-CG 4.16Å; L118-M122 HydrophobicContact CD1-SD 4.08Å; L118-M122 HydrophobicContact CD2-SD 4.22Å; L118-M122 HydrophobicContact CG-CG 4.31Å; L118-M122 HydrophobicContact CG-SD 3.73Å; L118-M122 VanDerWaalsContact O-CG 3.29Å; L118-M122 WeakPolarHBondContact O-CG 3.32Å; L118-M122 PolarHBondContact O-N 3.13Å; L118-V132 HydrophobicContact CD2-CG1 3.66Å; L118-V132 HydrophobicContact CD2-CG2 4.33Å; L118-I233 HydrophobicContact CD1-CG2 4.13Å; L118-A235 HydrophobicContact CB-CB 3.71Å; L118-A235 HydrophobicContact CD1-CB 4.23Å; L118-A235 HydrophobicContact CG-CB 4.41Å
119	W	98.9	Very high	98.7	Very high	124 Å²	124	45.3 Å²	45.3	47%	0.47	21%	0.21	S	C	.	.	H	α-helix	trans	-61.2	-44	178.6	-72.3	-10.9	0	0	0	112.1	I115 Q116 I121 M122 E123	I115-W119 HydrophobicContact CG2-CD2 3.81Å; I115-W119 VanDerWaalsContact CG2-CE2 3.47Å; I115-W119 HydrophobicContact CG2-CE3 4.23Å; I115-W119 HydrophobicContact CG2-CG 4.38Å; I115-W119 HydrophobicContact CG2-CH2 4.07Å; I115-W119 HydrophobicContact CG2-CZ2 3.63Å; I115-W119 HydrophobicContact CG2-CZ3 4.35Å; I115-W119 VanDerWaalsContact O-CG 3.31Å; I115-W119 PolarHBondContact O-N 3.21Å; Q116-W119 PolarHBondContact O-N 3.11Å; W119-I121 VanDerWaalsContact C-N 3.29Å; W119-I121 PolarHBondContact O-N 3.26Å; W119-M122 PolarHBondContact O-N 2.9Å; W119-E123 WeakPolarHBondContact O-CB 3.24Å; W119-E123 PolarHBondContact O-N 3.38Å
120	T	98.9	Very high	98.7	Very high	23 Å²	23	45.7 Å²	45.7	14%	0.141	21%	0.212	C	C	.	.	H	α-helix	trans	-58.5	-41.9	173.5	-59	0	0	0	0	111.6	A89 K90 A93 Q116 T117 L118 E123 V124	A89-T120 HydrophobicContact CB-CG2 4.11Å; K90-T120 HydrophobicContact CB-CG2 4.35Å; K90-T120 HydrophobicContact CG-CG2 3.71Å; A93-T120 HydrophobicContact CB-CG2 4.48Å; Q116-T120 PolarHBondContact O-N 3.24Å; Q116-T120 PolarHBondContact O-OG1 3.45Å; Q116-T120 VanDerWaalsContact O-OG1 3.07Å; T117-T120 PolarHBondContact O-N 3.04Å; L118-T120 PolarHBondContact O-N 3.37Å; T120-E123 PolarHBondContact O-N 3.02Å; T120-V124 WeakPolarHBondContact O-CB 3.49Å; T120-V124 WeakPolarHBondContact O-CG2 3.39Å; T120-V124 PolarHBondContact O-N 2.84Å
121	I	98.8	Very high	98.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-48	175.8	-67.1	163.9	0	0	0	111.3	V60 A93 I96 T117 L118 W119 E123 T125 I233	V60-I121 HydrophobicContact CB-CD1 4.36Å; V60-I121 HydrophobicContact CG1-CD1 4.27Å; V60-I121 HydrophobicContact CG2-CD1 3.99Å; A93-I121 HydrophobicContact CB-CB 4.26Å; A93-I121 HydrophobicContact CB-CG1 3.88Å; I96-I121 HydrophobicContact CD1-CD1 4.18Å; I96-I121 HydrophobicContact CD1-CG1 4.28Å; I96-I121 HydrophobicContact CD1-CG2 3.66Å; T117-I121 HydrophobicContact CG2-CD1 4.07Å; T117-I121 WeakPolarHBondContact O-CG1 3.36Å; T117-I121 PolarHBondContact O-N 2.83Å; T117-I121 VanDerWaalsContact O-N 3.09Å; L118-I121 WeakPolarHBondContact O-CB 3.5Å; L118-I121 PolarHBondContact O-N 2.79Å; L118-I121 VanDerWaalsContact O-N 3.17Å; W119-I121 VanDerWaalsContact C-N 3.29Å; W119-I121 PolarHBondContact O-N 3.26Å; I121-E123 VanDerWaalsContact C-N 3.33Å; I121-E123 PolarHBondContact O-N 2.82Å; I121-T125 HydrophobicContact CG2-CG2 4.37Å; I121-T125 WeakPolarHBondContact O-CB 3.38Å; I121-T125 VanDerWaalsContact O-CG2 3.24Å; I121-T125 WeakPolarHBondContact O-CG2 3.43Å; I121-T125 PolarHBondContact O-N 3.44Å; I121-T125 VanDerWaalsContact O-N 3.08Å; I121-T125 PolarHBondContact O-OG1 3.08Å; I121-I233 HydrophobicContact CD1-CD1 4.19Å; I121-I233 HydrophobicContact CG2-CD1 3.87Å
122	M	98.8	Very high	98.7	Very high	9 Å²	9	49.3 Å²	49.3	4%	0.044	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-38.2	-179.5	-69.5	172.5	68	0	0	112	L118 W119 D126 Q127 M128 L130 V132	L118-M122 HydrophobicContact CD1-CG 4.16Å; L118-M122 HydrophobicContact CD1-SD 4.08Å; L118-M122 HydrophobicContact CD2-SD 4.22Å; L118-M122 HydrophobicContact CG-CG 4.31Å; L118-M122 HydrophobicContact CG-SD 3.73Å; L118-M122 VanDerWaalsContact O-CG 3.29Å; L118-M122 WeakPolarHBondContact O-CG 3.32Å; L118-M122 PolarHBondContact O-N 3.13Å; W119-M122 PolarHBondContact O-N 2.9Å; M122-D126 PolarHBondContact O-N 3.18Å; M122-Q127 VanDerWaalsContact CE-O 3.32Å; M122-Q127 WeakPolarHBondContact CE-O 3.47Å; M122-Q127 PolarHBondContact O-N 3.49Å; M122-M128 HydrophobicContact CB-CG 4.16Å; M122-M128 WeakPolarHBondContact CE-O 3.45Å; M122-M128 PolarHBondContact O-N 3.21Å; M122-L130 HydrophobicContact CE-CB 4.05Å; M122-V132 HydrophobicContact CE-CG2 3.59Å; M122-V132 HydrophobicContact SD-CG2 3.66Å
123	E	98.8	Very high	98.7	Very high	126 Å²	126	48.9 Å²	48.9	59%	0.589	24%	0.235	S	C	*	.	H	α-helix	trans	-65.7	-54.7	177.4	-177.6	177.2	-167.9	0	0	111.6	W119 T120 I121 T125 D126 M128	W119-E123 WeakPolarHBondContact O-CB 3.24Å; W119-E123 PolarHBondContact O-N 3.38Å; T120-E123 PolarHBondContact O-N 3.02Å; I121-E123 VanDerWaalsContact C-N 3.33Å; I121-E123 PolarHBondContact O-N 2.82Å; E123-T125 VanDerWaalsContact C-N 3.28Å; E123-T125 PolarHBondContact O-N 3.3Å; E123-D126 PolarHBondContact O-N 2.99Å; E123-D126 VanDerWaalsContact O-N 3.13Å; E123-M128 HydrophobicContact CB-CG 4.33Å; E123-M128 HydrophobicContact CB-SD 4.01Å; E123-M128 HydrophobicContact CG-SD 4.21Å
124	V	98.6	Very high	98.8	Very high	36 Å²	36	53.7 Å²	53.7	22%	0.218	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-35.2	-176.8	168.3	0	0	0	0	112.2	A93 K97 T120 D126	A93-V124 HydrophobicContact CB-CB 3.71Å; A93-V124 HydrophobicContact CB-CG1 3.89Å; A93-V124 HydrophobicContact CB-CG2 3.94Å; K97-V124 HydrophobicContact CB-CG1 4.48Å; K97-V124 HydrophobicContact CD-CG1 4.09Å; K97-V124 WeakPolarHBondContact CD-O 3.37Å; K97-V124 WeakPolarHBondContact CE-O 3.49Å; K97-V124 PolarHBondContact NZ-O 3.48Å; T120-V124 WeakPolarHBondContact O-CB 3.49Å; T120-V124 WeakPolarHBondContact O-CG2 3.39Å; T120-V124 PolarHBondContact O-N 2.84Å; V124-D126 VanDerWaalsContact C-N 3.32Å
125	T	98.5	Very high	98.7	Very high	7 Å²	7	54.5 Å²	54.5	4%	0.043	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-0.8	-179.7	63.7	0	0	0	0	114.1	I96 K97 I121 E123 Q127	I96-T125 HydrophobicContact CB-CG2 4.17Å; I96-T125 HydrophobicContact CG2-CG2 3.65Å; K97-T125 HydrophobicContact CB-CG2 4.13Å; I121-T125 HydrophobicContact CG2-CG2 4.37Å; I121-T125 WeakPolarHBondContact O-CB 3.38Å; I121-T125 VanDerWaalsContact O-CG2 3.24Å; I121-T125 WeakPolarHBondContact O-CG2 3.43Å; I121-T125 PolarHBondContact O-N 3.44Å; I121-T125 VanDerWaalsContact O-N 3.08Å; I121-T125 PolarHBondContact O-OG1 3.08Å; E123-T125 VanDerWaalsContact C-N 3.28Å; E123-T125 PolarHBondContact O-N 3.3Å; T125-Q127 VanDerWaalsContact CB-NE2 3.34Å; T125-Q127 PolarHBondContact OG1-NE2 2.88Å
126	D	98.6	Very high	98.7	Very high	132 Å²	132	54.7 Å²	54.7	71%	0.706	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	49.6	-177.2	-167.6	31.5	0	0	0	113.4	M122 E123 V124	M122-D126 PolarHBondContact O-N 3.18Å; E123-D126 PolarHBondContact O-N 2.99Å; E123-D126 VanDerWaalsContact O-N 3.13Å; V124-D126 VanDerWaalsContact C-N 3.32Å
127	Q	98.6	Very high	98.7	Very high	5 Å²	5	54.6 Å²	54.6	2%	0.023	26%	0.255	C	S	.	.			trans	-132.1	26.2	-175.4	-68.9	-178.2	106.6	0	0	112.3	M101 K102 M122 T125 W129 L130	M101-Q127 PolarHBondContact O-NE2 3.26Å; K102-Q127 VanDerWaalsContact CA-OE1 3.3Å; M122-Q127 VanDerWaalsContact CE-O 3.32Å; M122-Q127 WeakPolarHBondContact CE-O 3.47Å; M122-Q127 PolarHBondContact O-N 3.49Å; T125-Q127 VanDerWaalsContact CB-NE2 3.34Å; T125-Q127 PolarHBondContact OG1-NE2 2.88Å; Q127-W129 PolarHBondContact O-N 3.33Å; Q127-W129 VanDerWaalsContact O-N 3.15Å; Q127-L130 HydrophobicContact CB-CD1 3.69Å; Q127-L130 HydrophobicContact CB-CG 4.05Å; Q127-L130 HydrophobicContact CG-CD1 4.32Å; Q127-L130 WeakPolarHBondContact O-CB 3.36Å; Q127-L130 VanDerWaalsContact O-CG 3.32Å; Q127-L130 WeakPolarHBondContact O-CG 3.42Å; Q127-L130 PolarHBondContact O-N 3.21Å; Q127-L130 VanDerWaalsContact O-N 3.17Å
128	M	98.7	Very high	98.7	Very high	120 Å²	120	54.7 Å²	54.7	59%	0.591	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-20	-178.7	-68.7	-171	76.3	0	0	114.6	M122 E123 L130	M122-M128 HydrophobicContact CB-CG 4.16Å; M122-M128 WeakPolarHBondContact CE-O 3.45Å; M122-M128 PolarHBondContact O-N 3.21Å; E123-M128 HydrophobicContact CB-CG 4.33Å; E123-M128 HydrophobicContact CB-SD 4.01Å; E123-M128 HydrophobicContact CG-SD 4.21Å; M128-L130 VanDerWaalsContact C-N 3.26Å; M128-L130 PolarHBondContact O-N 2.98Å
129	W	98.6	Very high	98.7	Very high	193 Å²	193	54.7 Å²	54.7	73%	0.731	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.2	178.5	60	-93	0	0	0	113.7	Q127	Q127-W129 PolarHBondContact O-N 3.33Å; Q127-W129 VanDerWaalsContact O-N 3.15Å
130	L	98.7	Very high	98.7	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	24%	0.237	C	C	.	.	S	Bend	trans	-64.6	146.3	-177.8	-68.3	178.1	0	0	0	112.6	F103 M122 Q127 M128 V132	F103-L130 HydrophobicContact CB-CD1 3.68Å; F103-L130 WeakPolarHBondContact O-CD1 3.31Å; F103-L130 WeakPolarHBondContact O-CD2 3.4Å; M122-L130 HydrophobicContact CE-CB 4.05Å; Q127-L130 HydrophobicContact CB-CD1 3.69Å; Q127-L130 HydrophobicContact CB-CG 4.05Å; Q127-L130 HydrophobicContact CG-CD1 4.32Å; Q127-L130 WeakPolarHBondContact O-CB 3.36Å; Q127-L130 VanDerWaalsContact O-CG 3.32Å; Q127-L130 WeakPolarHBondContact O-CG 3.42Å; Q127-L130 PolarHBondContact O-N 3.21Å; Q127-L130 VanDerWaalsContact O-N 3.17Å; M128-L130 VanDerWaalsContact C-N 3.26Å; M128-L130 PolarHBondContact O-N 2.98Å; L130-V132 PolarHBondContact O-N 3.42Å
131	P	98.7	Very high	98.6	Very high	68 Å²	68	48.4 Å²	48.4	44%	0.442	23%	0.23	S	C	.	.			trans	-64.6	131.3	174.2	26.9	-32.8	0	0	0	110.9	D104 V105 C106	D104-P131 WeakPolarHBondContact O-CD 3.36Å; D104-P131 WeakPolarHBondContact O-CG 3.21Å; V105-P131 HydrophobicContact CB-CG 4.31Å; V105-P131 HydrophobicContact CG2-CG 4.28Å; C106-P131 PolarHBondContact N-O 3.39Å
132	V	98.9	Very high	98.6	Very high	35 Å²	35	48.3 Å²	48.3	21%	0.212	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116.1	178.3	-176.7	0	0	0	0	110.7	C106 T108 L118 M122 L130 R134	C106-V132 HydrophobicContact CB-CG2 4.16Å; C106-V132 WeakPolarHBondContact O-CA 3.39Å; T108-V132 HydrophobicContact CG2-CG1 4.13Å; L118-V132 HydrophobicContact CD2-CG1 3.66Å; L118-V132 HydrophobicContact CD2-CG2 4.33Å; M122-V132 HydrophobicContact CE-CG2 3.59Å; M122-V132 HydrophobicContact SD-CG2 3.66Å; L130-V132 PolarHBondContact O-N 3.42Å; V132-R134 HydrophobicContact CG1-CG 4.28Å
133	I	98.8	Very high	98.5	Very high	59 Å²	59	49.2 Å²	49.2	30%	0.303	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.9	175.3	-59.5	84.3	0	0	0	109.1	V105 C106 Y107 T108 F217	V105-I133 HydrophobicContact CG2-CD1 3.28Å; C106-I133 PolarHBondContact O-N 3.47Å; Y107-I133 WeakPolarHBondContact CA-O 3.44Å; Y107-I133 HydrophobicContact CD1-CB 3.69Å; Y107-I133 HydrophobicContact CD1-CD1 4.43Å; Y107-I133 HydrophobicContact CD1-CG1 4.45Å; Y107-I133 HydrophobicContact CD1-CG2 4.11Å; Y107-I133 HydrophobicContact CE1-CB 3.78Å; Y107-I133 HydrophobicContact CE1-CD1 3.96Å; Y107-I133 HydrophobicContact CE1-CG1 4.07Å; Y107-I133 HydrophobicContact CE1-CG2 4.15Å; T108-I133 PolarHBondContact N-O 3Å; I133-F217 HydrophobicContact CG2-CE2 4.46Å; I133-F217 HydrophobicContact CG2-CZ 3.95Å
134	R	98.8	Very high	98.4	Very high	103 Å²	103	43.2 Å²	43.2	39%	0.389	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.8	179.6	-63.3	174.8	-179.8	76.2	-2.3	109.6	T108 V110 V132	T108-R134 HydrophobicContact CG2-CG 3.74Å; T108-R134 WeakPolarHBondContact O-CA 3.25Å; V110-R134 HydrophobicContact CG1-CB 4.29Å; V132-R134 HydrophobicContact CG1-CG 4.28Å
135	T	98.7	Very high	98.3	Very high	18 Å²	18	42.4 Å²	42.4	11%	0.11	20%	0.204	C	C	.	.			trans	-148.5	142.6	177.4	-178	0	0	0	0	112.6	T108 S109 R137 L138 F217	T108-T135 PolarHBondContact O-N 3.43Å; T108-T135 VanDerWaalsContact O-N 3.08Å; S109-T135 VanDerWaalsContact CA-O 3.31Å; S109-T135 WeakPolarHBondContact CA-O 3.1Å; T135-R137 HydrophobicContact CG2-CB 4.17Å; T135-R137 PolarHBondContact O-N 3.04Å; T135-R137 PolarHBondContact OG1-N 3.25Å; T135-L138 HydrophobicContact CG2-CB 4.02Å; T135-L138 HydrophobicContact CG2-CD1 3.9Å; T135-L138 HydrophobicContact CG2-CG 3.67Å; T135-L138 PolarHBondContact O-N 2.84Å; T135-F217 HydrophobicContact CG2-CD1 3.68Å; T135-F217 HydrophobicContact CG2-CD2 4Å; T135-F217 HydrophobicContact CG2-CE1 3.43Å; T135-F217 VanDerWaalsContact CG2-CE1 3.43Å; T135-F217 HydrophobicContact CG2-CE2 3.77Å; T135-F217 HydrophobicContact CG2-CG 3.95Å; T135-F217 HydrophobicContact CG2-CZ 3.48Å; T135-F217 VanDerWaalsContact CG2-CZ 3.48Å
136	W	98.6	Very high	98.2	Very high	26 Å²	26	42.3 Å²	42.3	10%	0.098	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-63.6	-24.5	172.2	76.1	-93.3	0	0	0	111.8	W76 V110 L138 N139 Y193 L196 E200 R213	W76-W136 HydrophobicContact CH2-CD2 4.42Å; W76-W136 AromaticContact CH2-CE3 3.58Å; W76-W136 HydrophobicContact CH2-CE3 3.58Å; W76-W136 HydrophobicContact CH2-CZ3 4.09Å; W76-W136 AromaticContact CZ2-CE3 3.82Å; W76-W136 HydrophobicContact CZ2-CE3 3.82Å; W76-W136 HydrophobicContact CZ2-CZ3 4.2Å; V110-W136 HydrophobicContact CG2-CB 4.19Å; W136-L138 PolarHBondContact O-N 2.99Å; W136-L138 VanDerWaalsContact O-N 3.07Å; W136-N139 WeakPolarHBondContact O-CB 3.4Å; W136-N139 VanDerWaalsContact O-CG 3.26Å; W136-N139 PolarHBondContact O-N 3.2Å; W136-Y193 HydrophobicContact CB-CD1 4.19Å; W136-Y193 HydrophobicContact CB-CE1 3.92Å; W136-L196 HydrophobicContact CD2-CD2 3.94Å; W136-L196 HydrophobicContact CG-CD1 4.24Å; W136-L196 HydrophobicContact CG-CD2 4.1Å; W136-L196 HydrophobicContact CZ2-CD2 4.23Å; W136-E200 WeakPolarHBondContact CH2-O 3.38Å; W136-E200 HydrophobicContact CZ2-CB 4.09Å; W136-R213 HydrophobicContact CH2-CB 3.78Å; W136-R213 HydrophobicContact CH2-CG 4.11Å; W136-R213 HydrophobicContact CZ3-CB 4.02Å; W136-R213 HydrophobicContact CZ3-CG 3.82Å
137	R	98.5	Very high	98.1	Very high	54 Å²	54	36.1 Å²	36.1	20%	0.204	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-64	-14	178.1	-65.8	-178.2	178.5	-82.1	-3.3	113.4	T135 E200 R213 A214 F217	T135-R137 HydrophobicContact CG2-CB 4.17Å; T135-R137 PolarHBondContact O-N 3.04Å; T135-R137 PolarHBondContact OG1-N 3.25Å; R137-E200 IonicContact NH2-OE1 3.48Å; R137-E200 PolarHBondContact NH2-OE1 3.09Å; R137-E200 VanDerWaalsContact NH2-OE1 3.14Å; R137-R213 VanDerWaalsContact C-NH1 3.35Å; R137-R213 WeakPolarHBondContact CB-O 3.5Å; R137-R213 WeakPolarHBondContact CD-O 3.39Å; R137-R213 WeakPolarHBondContact CG-O 3.27Å; R137-R213 PolarHBondContact NH1-O 2.88Å; R137-R213 PolarHBondContact O-NH1 2.98Å; R137-A214 WeakPolarHBondContact O-CA 3.41Å; R137-A214 WeakPolarHBondContact O-CB 3.38Å; R137-F217 HydrophobicContact CB-CB 3.91Å; R137-F217 HydrophobicContact CB-CG 4.35Å; R137-F217 HydrophobicContact CG-CB 4.49Å
138	L	98.8	Very high	98	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-100.8	-0.7	172.2	-71.3	178.7	0	0	0	113.5	T135 W136 F217 I234 A236 H237 S240 I244	T135-L138 HydrophobicContact CG2-CB 4.02Å; T135-L138 HydrophobicContact CG2-CD1 3.9Å; T135-L138 HydrophobicContact CG2-CG 3.67Å; T135-L138 PolarHBondContact O-N 2.84Å; W136-L138 PolarHBondContact O-N 2.99Å; W136-L138 VanDerWaalsContact O-N 3.07Å; L138-F217 HydrophobicContact CD1-CD1 4.27Å; L138-F217 HydrophobicContact CD1-CE1 3.92Å; L138-F217 HydrophobicContact CD2-CD1 4.46Å; L138-F217 HydrophobicContact CG-CD1 4.12Å; L138-F217 HydrophobicContact CG-CE1 4.25Å; L138-I234 HydrophobicContact CD1-CG2 4.02Å; L138-I234 HydrophobicContact CD2-CG2 4.38Å; L138-A236 HydrophobicContact CB-CB 4.48Å; L138-H237 PolarHBondContact O-CD2 3.28Å; L138-H237 VanDerWaalsContact O-CD2 3.29Å; L138-S240 WeakPolarHBondContact O-CB 3.27Å; L138-S240 PolarHBondContact O-OG 2.94Å; L138-I244 HydrophobicContact CD2-CD1 4.13Å
139	N	98.8	Very high	97.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-55	159.1	175.9	-76.2	0.2	0	0	0	111.9	W76 S109 V110 L111 W136 Y193 R213 S240	W76-N139 HydrophobicContact CZ2-CB 4.23Å; S109-N139 WeakPolarHBondContact CB-OD1 2.98Å; V110-N139 VanDerWaalsContact CG2-OD1 3.27Å; V110-N139 WeakPolarHBondContact CG2-OD1 2.94Å; V110-N139 PolarHBondContact N-OD1 3.08Å; V110-N139 VanDerWaalsContact N-OD1 3.14Å; L111-N139 HydrophobicContact CD1-CB 4.22Å; W136-N139 WeakPolarHBondContact O-CB 3.4Å; W136-N139 VanDerWaalsContact O-CG 3.26Å; W136-N139 PolarHBondContact O-N 3.2Å; N139-Y193 PolarHBondContact ND2-OH 2.81Å; N139-Y193 VanDerWaalsContact ND2-OH 3.09Å; N139-R213 VanDerWaalsContact O-CZ 3.31Å; N139-R213 PolarHBondContact O-NH1 3.42Å; N139-R213 PolarHBondContact O-NH2 3.5Å; N139-S240 VanDerWaalsContact O-CB 3.3Å; N139-S240 WeakPolarHBondContact O-CB 3.43Å; N139-S240 PolarHBondContact O-OG 3.23Å
140	E	98.1	Very high	97.6	Very high	15 Å²	15	26.6 Å²	26.6	7%	0.07	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-58.7	163.2	168	-171.8	53.8	-73.9	0	0	111	W76 H142 Y143 R213 H237 G238 N239	W76-E140 PolarHBondContact NE1-O 2.89Å; E140-H142 PolarHBondContact O-N 2.85Å; E140-Y143 HydrophobicContact CG-CE2 4.38Å; E140-R213 PolarHBondContact O-NH2 3.45Å; E140-H237 HydrophobicContact CB-CB 3.69Å; E140-H237 HydrophobicContact CG-CB 4.13Å; E140-H237 PolarHBondContact N-CD2 2.82Å; E140-H237 WeakPolarHBondContact OE2-CB 3.45Å; E140-G238 PolarHBondContact OE2-N 2.6Å; E140-N239 WeakPolarHBondContact OE1-CB 3.45Å; E140-N239 PolarHBondContact OE1-N 3.06Å; E140-N239 PolarHBondContact OE1-ND2 3.43Å
141	R	97.3	Very high	97.1	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-53	131.4	168.6	179.5	177.9	179.1	178.9	0.8	111.1	G75 Y143 W166 I172 E205 N239	G75-R141 VanDerWaalsContact CA-O 3.27Å; G75-R141 WeakPolarHBondContact CA-O 3.4Å; R141-Y143 HydrophobicContact CG-CE1 4.46Å; R141-Y143 PolarHBondContact O-N 2.82Å; R141-W166 VanDerWaalsContact CZ-O 3.25Å; R141-W166 PolarHBondContact NH1-O 3.32Å; R141-W166 PolarHBondContact NH2-O 3.03Å; R141-I172 PolarHBondContact NH2-O 3.35Å; R141-E205 HydrophobicContact CG-CB 4.1Å; R141-E205 WeakPolarHBondContact CG-O 3.3Å; R141-E205 PolarHBondContact NE-O 3.06Å; R141-E205 PolarHBondContact NH2-O 3.22Å; R141-N239 HydrophobicContact CB-CB 3.86Å
142	H	97.9	Very high	96.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.			trans	-73	106.9	173.1	-161.2	-68.1	0	0	0	110.5	W76 E140 G144 P202 T203 C204 E205	W76-H142 AromaticContact CD1-CD2 3.83Å; W76-H142 HydrophobicContact CD2-CB 4.46Å; W76-H142 AromaticContact CD2-CD2 3.39Å; W76-H142 AromaticContact CE2-CD2 3.83Å; W76-H142 AromaticContact CE3-CD2 3.77Å; W76-H142 HydrophobicContact CG-CB 4.28Å; W76-H142 AromaticContact CG-CD2 3.4Å; E140-H142 PolarHBondContact O-N 2.85Å; H142-G144 WeakPolarHBondContact ND1-CA 3.07Å; H142-G144 PolarHBondContact ND1-N 2.89Å; H142-G144 PolarHBondContact O-N 2.82Å; H142-P202 HydrophobicContact CB-CG 4.19Å; H142-T203 PolarHBondContact CE1-O 2.83Å; H142-T203 PolarHBondContact ND1-O 3.28Å; H142-C204 WeakPolarHBondContact O-CA 3.44Å; H142-E205 HydrophobicContact CB-CB 4.18Å; H142-E205 HydrophobicContact CB-CG 3.83Å; H142-E205 PolarHBondContact N-OE2 3.41Å; H142-E205 PolarHBondContact O-N 2.93Å
143	Y	97.1	Very high	96	Very high	27 Å²	27	31.3 Å²	31.3	11%	0.106	16%	0.158	C	C	.	.			trans	-77.1	0.7	-178.6	-71.9	-66.8	0	0	0	114.5	F73 G75 E140 R141 G145 L146 P174 N239	F73-Y143 HydrophobicContact CB-CD2 4.27Å; F73-Y143 HydrophobicContact CB-CG 4.27Å; F73-Y143 AromaticContact CD1-CD1 3.73Å; F73-Y143 HydrophobicContact CD1-CD1 3.73Å; F73-Y143 HydrophobicContact CD1-CD2 4.16Å; F73-Y143 AromaticContact CD1-CE1 3.98Å; F73-Y143 HydrophobicContact CD1-CE1 3.98Å; F73-Y143 HydrophobicContact CD1-CE2 4.41Å; F73-Y143 AromaticContact CD1-CG 3.84Å; F73-Y143 HydrophobicContact CD1-CG 3.84Å; F73-Y143 HydrophobicContact CE1-CD1 4.19Å; F73-Y143 HydrophobicContact CE1-CE1 4.25Å; F73-Y143 HydrophobicContact CG-CG 4.48Å; G75-Y143 VanDerWaalsContact CA-CD2 3.47Å; E140-Y143 HydrophobicContact CG-CE2 4.38Å; R141-Y143 HydrophobicContact CG-CE1 4.46Å; R141-Y143 PolarHBondContact O-N 2.82Å; Y143-G145 PolarHBondContact O-N 3Å; Y143-L146 WeakPolarHBondContact O-CB 3.47Å; Y143-L146 PolarHBondContact O-N 2.87Å; Y143-L146 VanDerWaalsContact O-N 3.09Å; Y143-P174 WeakPolarHBondContact O-CG 3.41Å; Y143-N239 PolarHBondContact OH-ND2 3.25Å; Y143-N239 VanDerWaalsContact OH-ND2 3.15Å
144	G	97.4	Very high	95.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	59.2	-131.8	174	0	0	0	0	0	112.5	H142 L146 T147 P175 M177 T203	H142-G144 WeakPolarHBondContact ND1-CA 3.07Å; H142-G144 PolarHBondContact ND1-N 2.89Å; H142-G144 PolarHBondContact O-N 2.82Å; G144-L146 PolarHBondContact O-N 2.88Å; G144-L146 VanDerWaalsContact O-N 3.16Å; G144-T147 WeakPolarHBondContact O-CB 3.24Å; G144-T147 PolarHBondContact O-N 3.07Å; G144-T147 PolarHBondContact O-OG1 3.25Å; G144-P175 CarbonylContact C-O 3.59Å; G144-P175 WeakPolarHBondContact CA-O 3.45Å; G144-M177 VanDerWaalsContact O-CE 3.23Å; G144-M177 WeakPolarHBondContact O-CE 3.37Å; G144-T203 WeakPolarHBondContact CA-O 3.5Å
145	G	96.6	Very high	95	Very high	20 Å²	20	24.8 Å²	24.8	21%	0.206	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-65.7	-9.7	178.7	0	0	0	0	0	114.5	Y143 T147 P175 P176	Y143-G145 PolarHBondContact O-N 3Å; G145-T147 VanDerWaalsContact C-N 3.32Å; G145-P175 PolarHBondContact N-O 3.41Å; G145-P176 PolarHBondContact N-O 3.09Å
146	L	95.8	Very high	94.4	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-81.1	-14.7	171.8	-55.4	-179.5	0	0	0	112.5	F73 Y143 G144 G148 L149 T154 W166 P174	F73-L146 HydrophobicContact CB-CB 4.41Å; F73-L146 VanDerWaalsContact CB-O 3.29Å; F73-L146 WeakPolarHBondContact CB-O 3.22Å; F73-L146 HydrophobicContact CD2-CB 4.04Å; F73-L146 HydrophobicContact CE1-CD1 4.37Å; F73-L146 HydrophobicContact CE2-CB 4.39Å; F73-L146 HydrophobicContact CE2-CD1 4.44Å; F73-L146 HydrophobicContact CG-CB 4.11Å; F73-L146 HydrophobicContact CZ-CD1 4.21Å; Y143-L146 WeakPolarHBondContact O-CB 3.47Å; Y143-L146 PolarHBondContact O-N 2.87Å; Y143-L146 VanDerWaalsContact O-N 3.09Å; G144-L146 PolarHBondContact O-N 2.88Å; G144-L146 VanDerWaalsContact O-N 3.16Å; L146-G148 PolarHBondContact O-N 2.89Å; L146-G148 VanDerWaalsContact O-N 3.13Å; L146-L149 HydrophobicContact CD2-CD1 4.14Å; L146-L149 WeakPolarHBondContact O-CB 3.23Å; L146-L149 PolarHBondContact O-N 3.4Å; L146-T154 HydrophobicContact CD2-CG2 4.28Å; L146-W166 HydrophobicContact CD1-CB 3.9Å; L146-W166 HydrophobicContact CD1-CD2 3.98Å; L146-W166 HydrophobicContact CD1-CE3 3.78Å; L146-W166 HydrophobicContact CD1-CG 4.08Å; L146-W166 HydrophobicContact CD2-CE3 4.08Å; L146-W166 HydrophobicContact CD2-CZ3 4.06Å; L146-P174 HydrophobicContact CD1-CB 3.61Å; L146-P174 HydrophobicContact CG-CB 3.99Å
147	T	97.4	Very high	93.8	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	118.3	-176.8	-57.6	0	0	0	0	111.2	W67 F77 G144 G145 M177 H181 Y183 I187	W67-T147 HydrophobicContact CZ3-CG2 4.15Å; F77-T147 HydrophobicContact CB-CG2 4.11Å; G144-T147 WeakPolarHBondContact O-CB 3.24Å; G144-T147 PolarHBondContact O-N 3.07Å; G144-T147 PolarHBondContact O-OG1 3.25Å; G145-T147 VanDerWaalsContact C-N 3.32Å; T147-M177 HydrophobicContact CG2-CE 4.02Å; T147-M177 WeakPolarHBondContact OG1-CE 3.32Å; T147-H181 PolarHBondContact O-CE1 3.42Å; T147-H181 PolarHBondContact O-NE2 3.47Å; T147-Y183 HydrophobicContact CG2-CD2 4.48Å; T147-I187 HydrophobicContact CG2-CD1 3.86Å
148	G	96.3	Very high	93.1	Very high	9 Å²	9	39.7 Å²	39.7	9%	0.093	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.8	-4.8	179.8	0	0	0	0	0	115.3	R72 F73 L146	R72-G148 PolarHBondContact NE-O 3.44Å; R72-G148 PolarHBondContact NH2-O 2.99Å; F73-G148 PolarHBondContact O-N 2.87Å; L146-G148 PolarHBondContact O-N 2.89Å; L146-G148 VanDerWaalsContact O-N 3.13Å
149	L	94.7	Very high	92.6	Very high	73 Å²	73	41.3 Å²	41.3	38%	0.382	22%	0.22	S	C	.	.			trans	-77	145.6	170.8	-56.9	-176.9	0	0	0	110.8	R72 F73 L146 T154	R72-L149 CarbonylContact C-O 3.59Å; R72-L149 VanDerWaalsContact CA-O 3.25Å; R72-L149 WeakPolarHBondContact CA-O 3.35Å; F73-L149 HydrophobicContact CD2-CB 4.45Å; F73-L149 WeakPolarHBondContact CD2-O 3.44Å; F73-L149 PolarHBondContact N-O 2.87Å; L146-L149 HydrophobicContact CD2-CD1 4.14Å; L146-L149 WeakPolarHBondContact O-CB 3.23Å; L146-L149 PolarHBondContact O-N 3.4Å; L149-T154 WeakPolarHBondContact CB-OG1 3.44Å
150	N	93.3	Very high	91.8	Very high	35 Å²	35	47.2 Å²	47.2	19%	0.187	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-71.6	134.9	169	-170.4	-61.8	0	0	0	109.5	E70 N71 A152 E153 T154	E70-N150 PolarHBondContact O-ND2 3.17Å; N71-N150 PolarHBondContact ND2-OD1 3.15Å; N150-A152 VanDerWaalsContact C-N 3.35Å; N150-A152 PolarHBondContact O-N 2.85Å; N150-A152 WeakPolarHBondContact OD1-CB 3.45Å; N150-A152 PolarHBondContact OD1-N 3.29Å; N150-E153 HydrophobicContact CB-CB 4.09Å; N150-E153 HydrophobicContact CB-CG 3.88Å; N150-E153 VanDerWaalsContact CB-OE2 3.25Å; N150-E153 WeakPolarHBondContact CB-OE2 3.33Å; N150-T154 WeakPolarHBondContact O-CB 3.48Å; N150-T154 PolarHBondContact O-N 2.73Å; N150-T154 PolarHBondContact O-OG1 3.37Å
151	K	88	Confident	91.3	Very high	39 Å²	39	52.4 Å²	52.4	17%	0.17	27%	0.272	C	S	.	.	H	α-helix	trans	-67.1	-34.4	-176.8	-66.1	170.8	-171.8	163.9	0	113.1	N71 F73 A155	N71-K151 WeakPolarHBondContact O-CG 3.47Å; N71-K151 PolarHBondContact O-N 3.03Å; F73-K151 HydrophobicContact CD1-CG 4.39Å; F73-K151 HydrophobicContact CD2-CG 3.8Å; F73-K151 HydrophobicContact CE1-CG 4.17Å; F73-K151 HydrophobicContact CE2-CB 4.21Å; F73-K151 HydrophobicContact CE2-CG 3.54Å; F73-K151 HydrophobicContact CG-CG 4.23Å; F73-K151 HydrophobicContact CZ-CB 4.5Å; F73-K151 HydrophobicContact CZ-CG 3.74Å; K151-A155 WeakPolarHBondContact O-CB 3.48Å; K151-A155 PolarHBondContact O-N 2.87Å; K151-A155 VanDerWaalsContact O-N 3.09Å
152	A	86.8	Confident	90.8	Very high	46 Å²	46	55.7 Å²	55.7	38%	0.38	29%	0.288	S	S	.	.	H	α-helix	trans	-70.2	-51.1	178.9	0	0	0	0	0	110.4	N150 T154 A155 E156	N150-A152 VanDerWaalsContact C-N 3.35Å; N150-A152 PolarHBondContact O-N 2.85Å; N150-A152 WeakPolarHBondContact OD1-CB 3.45Å; N150-A152 PolarHBondContact OD1-N 3.29Å; A152-T154 VanDerWaalsContact C-N 3.27Å; A152-T154 PolarHBondContact O-N 3.22Å; A152-A155 WeakPolarHBondContact O-CA 3.34Å; A152-A155 WeakPolarHBondContact O-CB 3.17Å; A152-A155 PolarHBondContact O-N 3Å; A152-E156 PolarHBondContact O-N 3.29Å
153	E	88.5	Confident	90.1	Very high	124 Å²	124	56 Å²	56	58%	0.579	29%	0.29	S	S	*	.	H	α-helix	trans	-59.9	-38.2	176.3	-60.4	168.9	177.1	0	0	111.9	N150 A155 E156 K157	N150-E153 HydrophobicContact CB-CB 4.09Å; N150-E153 HydrophobicContact CB-CG 3.88Å; N150-E153 VanDerWaalsContact CB-OE2 3.25Å; N150-E153 WeakPolarHBondContact CB-OE2 3.33Å; E153-A155 VanDerWaalsContact C-N 3.3Å; E153-A155 PolarHBondContact O-N 2.84Å; E153-E156 PolarHBondContact O-N 2.72Å; E153-K157 WeakPolarHBondContact O-CB 3.4Å; E153-K157 PolarHBondContact O-N 2.9Å
154	T	88.8	Confident	89.4	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-37.5	174.8	-53.3	0	0	0	0	111.1	F73 L146 L149 N150 A152 K157 H158 V163 W166	F73-T154 HydrophobicContact CE2-CG2 4.41Å; L146-T154 HydrophobicContact CD2-CG2 4.28Å; L149-T154 WeakPolarHBondContact CB-OG1 3.44Å; N150-T154 WeakPolarHBondContact O-CB 3.48Å; N150-T154 PolarHBondContact O-N 2.73Å; N150-T154 PolarHBondContact O-OG1 3.37Å; A152-T154 VanDerWaalsContact C-N 3.27Å; A152-T154 PolarHBondContact O-N 3.22Å; T154-K157 PolarHBondContact O-N 3.42Å; T154-H158 WeakPolarHBondContact O-CB 3.18Å; T154-H158 PolarHBondContact O-CD2 2.77Å; T154-H158 PolarHBondContact O-N 2.8Å; T154-V163 HydrophobicContact CG2-CG2 3.73Å; T154-W166 HydrophobicContact CG2-CZ3 4.16Å
155	A	88.1	Confident	88.8	Confident	19 Å²	19	62.3 Å²	62.3	16%	0.157	32%	0.32	C	S	.	.	H	α-helix	trans	-70.8	-37.3	178	0	0	0	0	0	112	K151 A152 E153 K157 G159 E160 V163	K151-A155 WeakPolarHBondContact O-CB 3.48Å; K151-A155 PolarHBondContact O-N 2.87Å; K151-A155 VanDerWaalsContact O-N 3.09Å; A152-A155 WeakPolarHBondContact O-CA 3.34Å; A152-A155 WeakPolarHBondContact O-CB 3.17Å; A152-A155 PolarHBondContact O-N 3Å; E153-A155 VanDerWaalsContact C-N 3.3Å; E153-A155 PolarHBondContact O-N 2.84Å; A155-K157 VanDerWaalsContact C-N 3.33Å; A155-K157 PolarHBondContact O-N 2.92Å; A155-G159 CarbonylContact O-C 3.32Å; A155-G159 VanDerWaalsContact O-C 3.32Å; A155-G159 WeakPolarHBondContact O-CA 3.22Å; A155-G159 PolarHBondContact O-N 2.96Å; A155-E160 HydrophobicContact CB-CG 4.33Å; A155-V163 HydrophobicContact CB-CB 4.32Å; A155-V163 HydrophobicContact CB-CG2 4.07Å
156	E	85.8	Confident	88.2	Confident	165 Å²	165	62.7 Å²	62.7	77%	0.771	32%	0.315	S	S	*	.	H	α-helix	trans	-62	-40.9	172.2	-69.9	172.7	-173.2	0	0	111.7	A152 E153	A152-E156 PolarHBondContact O-N 3.29Å; E153-E156 PolarHBondContact O-N 2.72Å
157	K	85.2	Confident	87.5	Confident	166 Å²	166	66.3 Å²	66.3	72%	0.722	33%	0.328	S	S	*	.	H	α-helix	trans	-78.5	-38.4	-177.6	-174.1	176.1	177.9	-177.6	0	114.1	E153 T154 A155	E153-K157 WeakPolarHBondContact O-CB 3.4Å; E153-K157 PolarHBondContact O-N 2.9Å; T154-K157 PolarHBondContact O-N 3.42Å; A155-K157 VanDerWaalsContact C-N 3.33Å; A155-K157 PolarHBondContact O-N 2.92Å
158	H	85.6	Confident	86.6	Confident	81 Å²	81	67.5 Å²	67.5	38%	0.375	33%	0.333	S	S	.	.	H	α-helix	trans	-112.7	-4.4	-170.5	-64.4	-76.9	0	0	0	113.9	T154 Q162 W166	T154-H158 WeakPolarHBondContact O-CB 3.18Å; T154-H158 PolarHBondContact O-CD2 2.77Å; T154-H158 PolarHBondContact O-N 2.8Å; H158-Q162 VanDerWaalsContact O-CB 3.27Å; H158-Q162 WeakPolarHBondContact O-CB 3.25Å; H158-W166 HydrophobicContact CB-CH2 4.02Å; H158-W166 HydrophobicContact CB-CZ3 3.9Å; H158-W166 AromaticContact CG-CH2 3.89Å; H158-W166 AromaticContact CG-CZ3 3.97Å
159	G	86.8	Confident	86.2	Confident	34 Å²	34	67.9 Å²	67.9	35%	0.351	33%	0.334	S	S	.	.			trans	86.3	144.3	-174.5	0	0	0	0	0	112.9	A155 E161 Q162 V163	A155-G159 CarbonylContact O-C 3.32Å; A155-G159 VanDerWaalsContact O-C 3.32Å; A155-G159 WeakPolarHBondContact O-CA 3.22Å; A155-G159 PolarHBondContact O-N 2.96Å; G159-E161 VanDerWaalsContact C-N 3.35Å; G159-E161 PolarHBondContact O-N 3.25Å; G159-Q162 PolarHBondContact O-N 3Å; G159-V163 PolarHBondContact O-N 3.39Å; G159-V163 VanDerWaalsContact O-N 3.16Å
160	E	83.1	Confident	85.9	Confident	124 Å²	124	65.6 Å²	65.6	58%	0.579	32%	0.321	S	S	*	.	H	α-helix	trans	-61.2	-41	-178.3	-65.7	-167.4	159.9	0	0	112.8	A155 Q162 V163 K164	A155-E160 HydrophobicContact CB-CG 4.33Å; E160-Q162 VanDerWaalsContact C-N 3.34Å; E160-Q162 PolarHBondContact O-N 3.15Å; E160-V163 PolarHBondContact O-N 2.99Å; E160-K164 VanDerWaalsContact O-CB 3.27Å; E160-K164 WeakPolarHBondContact O-CB 3.13Å; E160-K164 PolarHBondContact O-N 2.81Å
161	E	86.4	Confident	86	Confident	124 Å²	124	68.4 Å²	68.4	58%	0.579	34%	0.336	S	S	*	.	H	α-helix	trans	-63.5	-40.4	179.8	-68.8	-55.2	133.1	0	0	111.7	G159 K164 I165	G159-E161 VanDerWaalsContact C-N 3.35Å; G159-E161 PolarHBondContact O-N 3.25Å; E161-K164 WeakPolarHBondContact O-CB 3.39Å; E161-K164 PolarHBondContact O-N 3.34Å; E161-I165 VanDerWaalsContact O-CG1 3.29Å; E161-I165 WeakPolarHBondContact O-CG1 3.24Å; E161-I165 PolarHBondContact O-N 2.81Å
162	Q	86.9	Confident	86.2	Confident	71 Å²	71	70.1 Å²	70.1	33%	0.332	35%	0.346	S	S	.	.	H	α-helix	trans	-66.8	-42.4	177.3	-172.5	58.9	51.3	0	0	111.7	H158 G159 E160 K164 I165 W166	H158-Q162 VanDerWaalsContact O-CB 3.27Å; H158-Q162 WeakPolarHBondContact O-CB 3.25Å; G159-Q162 PolarHBondContact O-N 3Å; E160-Q162 VanDerWaalsContact C-N 3.34Å; E160-Q162 PolarHBondContact O-N 3.15Å; Q162-K164 VanDerWaalsContact C-N 3.31Å; Q162-K164 PolarHBondContact O-N 3.2Å; Q162-I165 WeakPolarHBondContact O-CB 3.41Å; Q162-I165 PolarHBondContact O-N 3.3Å; Q162-W166 HydrophobicContact CG-CD2 4.17Å; Q162-W166 HydrophobicContact CG-CE3 4.19Å; Q162-W166 HydrophobicContact CG-CH2 3.63Å; Q162-W166 HydrophobicContact CG-CZ2 3.59Å; Q162-W166 HydrophobicContact CG-CZ3 3.94Å; Q162-W166 PolarHBondContact O-N 3.13Å
163	V	83.1	Confident	86.6	Confident	6 Å²	6	70.5 Å²	70.5	4%	0.036	35%	0.345	C	S	.	.	H	α-helix	trans	-66.5	-36.2	175.9	172.3	0	0	0	0	111.4	F73 T154 A155 G159 E160 W166 R167	F73-V163 HydrophobicContact CZ-CG1 4.25Å; T154-V163 HydrophobicContact CG2-CG2 3.73Å; A155-V163 HydrophobicContact CB-CB 4.32Å; A155-V163 HydrophobicContact CB-CG2 4.07Å; G159-V163 PolarHBondContact O-N 3.39Å; G159-V163 VanDerWaalsContact O-N 3.16Å; E160-V163 PolarHBondContact O-N 2.99Å; V163-W166 HydrophobicContact CG2-CE3 4.23Å; V163-W166 HydrophobicContact CG2-CZ3 4.33Å; V163-W166 PolarHBondContact O-N 3.21Å; V163-R167 HydrophobicContact CG1-CG 4.26Å; V163-R167 VanDerWaalsContact O-CB 3.28Å; V163-R167 WeakPolarHBondContact O-CB 3.3Å; V163-R167 VanDerWaalsContact O-CG 3.23Å; V163-R167 WeakPolarHBondContact O-CG 3.45Å; V163-R167 PolarHBondContact O-N 2.88Å
164	K	82.2	Confident	86.9	Confident	100 Å²	100	64.8 Å²	64.8	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-43.1	173.4	-173.5	-179.2	176.6	-172.1	0	111	E160 E161 Q162 R167 R168	E160-K164 VanDerWaalsContact O-CB 3.27Å; E160-K164 WeakPolarHBondContact O-CB 3.13Å; E160-K164 PolarHBondContact O-N 2.81Å; E161-K164 WeakPolarHBondContact O-CB 3.39Å; E161-K164 PolarHBondContact O-N 3.34Å; Q162-K164 VanDerWaalsContact C-N 3.31Å; Q162-K164 PolarHBondContact O-N 3.2Å; K164-R167 PolarHBondContact O-N 2.72Å; K164-R168 WeakPolarHBondContact O-CB 3.31Å; K164-R168 PolarHBondContact O-N 3.01Å
165	I	85.4	Confident	87.2	Confident	60 Å²	60	67 Å²	67	31%	0.308	33%	0.333	S	S	.	.	H	α-helix	trans	-57.1	-53.2	172.3	-71.4	165.5	0	0	0	110	E161 Q162 R167 R168 S169 I172	E161-I165 VanDerWaalsContact O-CG1 3.29Å; E161-I165 WeakPolarHBondContact O-CG1 3.24Å; E161-I165 PolarHBondContact O-N 2.81Å; Q162-I165 WeakPolarHBondContact O-CB 3.41Å; Q162-I165 PolarHBondContact O-N 3.3Å; I165-R167 VanDerWaalsContact C-N 3.27Å; I165-R167 PolarHBondContact O-N 2.97Å; I165-R168 PolarHBondContact O-N 2.68Å; I165-S169 WeakPolarHBondContact O-CA 3.46Å; I165-S169 WeakPolarHBondContact O-CB 3.38Å; I165-S169 PolarHBondContact O-N 3.35Å; I165-I172 HydrophobicContact CG2-CB 4.03Å; I165-I172 HydrophobicContact CG2-CD1 3.7Å; I165-I172 HydrophobicContact CG2-CG1 4.46Å; I165-I172 HydrophobicContact CG2-CG2 3.88Å
166	W	85.1	Confident	87.7	Confident	27 Å²	27	69.1 Å²	69.1	10%	0.102	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-32.7	179.6	-66.7	-35.2	0	0	0	113.6	R141 L146 T154 H158 Q162 V163 P174 P175	R141-W166 VanDerWaalsContact CZ-O 3.25Å; R141-W166 PolarHBondContact NH1-O 3.32Å; R141-W166 PolarHBondContact NH2-O 3.03Å; L146-W166 HydrophobicContact CD1-CB 3.9Å; L146-W166 HydrophobicContact CD1-CD2 3.98Å; L146-W166 HydrophobicContact CD1-CE3 3.78Å; L146-W166 HydrophobicContact CD1-CG 4.08Å; L146-W166 HydrophobicContact CD2-CE3 4.08Å; L146-W166 HydrophobicContact CD2-CZ3 4.06Å; T154-W166 HydrophobicContact CG2-CZ3 4.16Å; H158-W166 HydrophobicContact CB-CH2 4.02Å; H158-W166 HydrophobicContact CB-CZ3 3.9Å; H158-W166 AromaticContact CG-CH2 3.89Å; H158-W166 AromaticContact CG-CZ3 3.97Å; Q162-W166 HydrophobicContact CG-CD2 4.17Å; Q162-W166 HydrophobicContact CG-CE3 4.19Å; Q162-W166 HydrophobicContact CG-CH2 3.63Å; Q162-W166 HydrophobicContact CG-CZ2 3.59Å; Q162-W166 HydrophobicContact CG-CZ3 3.94Å; Q162-W166 PolarHBondContact O-N 3.13Å; V163-W166 HydrophobicContact CG2-CE3 4.23Å; V163-W166 HydrophobicContact CG2-CZ3 4.33Å; V163-W166 PolarHBondContact O-N 3.21Å; W166-P174 HydrophobicContact CG-CB 4.43Å; W166-P175 HydrophobicContact CZ2-CG 4.15Å
167	R	80.1	Confident	88.2	Confident	81 Å²	81	61.6 Å²	61.6	31%	0.306	31%	0.31	S	S	.	.	H	α-helix	trans	-78.2	-35.4	179.6	-76.8	178.3	65.6	-155.9	-3.6	113.5	F73 V163 K164 I165 Q300	F73-R167 HydrophobicContact CE1-CG 3.7Å; F73-R167 HydrophobicContact CZ-CG 3.98Å; V163-R167 HydrophobicContact CG1-CG 4.26Å; V163-R167 VanDerWaalsContact O-CB 3.28Å; V163-R167 WeakPolarHBondContact O-CB 3.3Å; V163-R167 VanDerWaalsContact O-CG 3.23Å; V163-R167 WeakPolarHBondContact O-CG 3.45Å; V163-R167 PolarHBondContact O-N 2.88Å; K164-R167 PolarHBondContact O-N 2.72Å; I165-R167 VanDerWaalsContact C-N 3.27Å; I165-R167 PolarHBondContact O-N 2.97Å; R167-Q300 PolarHBondContact NH2-O 2.79Å
168	R	79.4	Confident	88.8	Confident	28 Å²	28	58.8 Å²	58.8	11%	0.106	30%	0.303	C	S	.	.	H	α-helix	trans	-123.6	-23.9	-165.3	-65.5	-171.9	166.7	-148.1	-9.4	114.5	K164 I165 F170 M257 E258	K164-R168 WeakPolarHBondContact O-CB 3.31Å; K164-R168 PolarHBondContact O-N 3.01Å; I165-R168 PolarHBondContact O-N 2.68Å; R168-F170 PolarHBondContact O-N 3.06Å; R168-M257 WeakPolarHBondContact O-CG 3.42Å; R168-E258 IonicContact NH1-OE1 2.78Å; R168-E258 PolarHBondContact NH1-OE1 3.33Å; R168-E258 IonicContact NH1-OE2 3.43Å; R168-E258 PolarHBondContact NH1-OE2 3.32Å
169	S	86.3	Confident	89.3	Confident	17 Å²	17	63.2 Å²	63.2	12%	0.119	32%	0.321	C	S	.	.			trans	-55.2	136.6	178.4	178.4	0	0	0	0	110.7	I165 D171 I172	I165-S169 WeakPolarHBondContact O-CA 3.46Å; I165-S169 WeakPolarHBondContact O-CB 3.38Å; I165-S169 PolarHBondContact O-N 3.35Å; S169-D171 PolarHBondContact OG-OD1 2.98Å; S169-I172 WeakPolarHBondContact OG-CB 3.47Å; S169-I172 WeakPolarHBondContact OG-CG1 3.14Å; S169-I172 PolarHBondContact OG-N 3.14Å
170	F	90.3	Very high	89.8	Confident	25 Å²	25	69.1 Å²	69.1	11%	0.11	35%	0.345	C	S	.	.	S	Bend	trans	-66.6	-47.8	179.9	-179	-109.4	0	0	0	111.2	R168 L207 K208 I211 K246 D253 I256 M257	R168-F170 PolarHBondContact O-N 3.06Å; F170-L207 HydrophobicContact CD2-CB 4.4Å; F170-L207 HydrophobicContact CD2-CD2 4.09Å; F170-L207 HydrophobicContact CD2-CG 4.21Å; F170-L207 CarbonylContact O-C 3.49Å; F170-L207 PolarHBondContact O-N 2.75Å; F170-L207 VanDerWaalsContact O-N 3.13Å; F170-K208 HydrophobicContact CD1-CB 4.12Å; F170-K208 HydrophobicContact CD1-CD 4.5Å; F170-K208 HydrophobicContact CE1-CB 3.77Å; F170-K208 HydrophobicContact CE1-CD 3.97Å; F170-K208 HydrophobicContact CE1-CG 3.85Å; F170-K208 HydrophobicContact CE2-CB 4.39Å; F170-K208 HydrophobicContact CZ-CB 3.91Å; F170-K208 HydrophobicContact CZ-CG 4.07Å; F170-K208 WeakPolarHBondContact O-CB 3.47Å; F170-K208 PolarHBondContact O-N 3.24Å; F170-I211 HydrophobicContact CE2-CD1 3.83Å; F170-K246 HydrophobicContact CE2-CD 4.08Å; F170-D253 HydrophobicContact CB-CB 4.27Å; F170-D253 HydrophobicContact CD1-CB 3.94Å; F170-D253 VanDerWaalsContact CD1-CG 3.5Å; F170-D253 VanDerWaalsContact CD1-OD2 3.31Å; F170-D253 WeakPolarHBondContact CD1-OD2 3.29Å; F170-D253 HydrophobicContact CD2-CB 4.2Å; F170-D253 HydrophobicContact CE1-CB 4.33Å; F170-D253 VanDerWaalsContact CE1-CG 3.41Å; F170-D253 WeakPolarHBondContact CE1-OD2 3.39Å; F170-D253 HydrophobicContact CG-CB 3.87Å; F170-D253 WeakPolarHBondContact CZ-OD1 3.12Å; F170-I256 HydrophobicContact CD2-CG2 4.16Å; F170-I256 HydrophobicContact CE2-CG2 4.42Å; F170-M257 HydrophobicContact CB-CG 4.44Å; F170-M257 HydrophobicContact CB-SD 4.17Å
171	D	93.7	Very high	90.5	Very high	94 Å²	94	64.8 Å²	64.8	50%	0.503	32%	0.324	S	S	.	.	S	Bend	trans	-116.8	-7.8	-167	62.7	-12	0	0	0	114.6	S169 P173 K208	S169-D171 PolarHBondContact OG-OD1 2.98Å; D171-P173 VanDerWaalsContact O-CD 3.25Å; D171-P173 WeakPolarHBondContact O-CD 3.3Å; D171-K208 HydrophobicContact CB-CD 4.2Å
172	I	93.2	Very high	91	Very high	75 Å²	75	64.2 Å²	64.2	39%	0.385	33%	0.331	S	S	.	.			trans	-89.4	112	177	-58.8	170.2	0	0	0	109.5	R141 I165 S169	R141-I172 PolarHBondContact NH2-O 3.35Å; I165-I172 HydrophobicContact CG2-CB 4.03Å; I165-I172 HydrophobicContact CG2-CD1 3.7Å; I165-I172 HydrophobicContact CG2-CG1 4.46Å; I165-I172 HydrophobicContact CG2-CG2 3.88Å; S169-I172 WeakPolarHBondContact OG-CB 3.47Å; S169-I172 WeakPolarHBondContact OG-CG1 3.14Å; S169-I172 PolarHBondContact OG-N 3.14Å
173	P	94.8	Very high	91.5	Very high	54 Å²	54	63.5 Å²	63.5	35%	0.351	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-73.8	156.9	175	32.3	-35.4	0	0	0	111.1	D171	D171-P173 VanDerWaalsContact O-CD 3.25Å; D171-P173 WeakPolarHBondContact O-CD 3.3Å
174	P	94.9	Very high	92.2	Very high	3 Å²	3	64.4 Å²	64.4	2%	0.019	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-70.9	170.8	166.2	32.5	-31.6	0	0	0	110.5	Y143 L146 W166 C204 E205	Y143-P174 WeakPolarHBondContact O-CG 3.41Å; L146-P174 HydrophobicContact CD1-CB 3.61Å; L146-P174 HydrophobicContact CG-CB 3.99Å; W166-P174 HydrophobicContact CG-CB 4.43Å; P174-C204 HydrophobicContact CG-CB 3.98Å; P174-C204 PolarHBondContact O-SG 3.17Å; P174-E205 WeakPolarHBondContact CD-O 3.32Å
175	P	95.3	Very high	92.9	Very high	54 Å²	54	66.8 Å²	66.8	35%	0.351	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-51.9	140	171.3	-26.3	35.1	0	0	0	111.8	G144 G145 W166	G144-P175 CarbonylContact C-O 3.59Å; G144-P175 WeakPolarHBondContact CA-O 3.45Å; G145-P175 PolarHBondContact N-O 3.41Å; W166-P175 HydrophobicContact CZ2-CG 4.15Å
176	P	97.5	Very high	93.5	Very high	63 Å²	63	68.5 Å²	68.5	41%	0.409	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-62.7	153.6	177.6	27.6	-34.3	0	0	0	111.6	G145 D178 T203	G145-P176 PolarHBondContact N-O 3.09Å; P176-D178 PolarHBondContact O-N 3.18Å; P176-T203 WeakPolarHBondContact CB-OG1 3.28Å
177	M	97.9	Very high	94	Very high	6 Å²	6	67.4 Å²	67.4	3%	0.03	35%	0.345	C	S	.	.			trans	-78.9	113.5	170.2	-178.3	171.3	-67	0	0	110.1	G144 T147 H181 H184 I187 T203	G144-M177 VanDerWaalsContact O-CE 3.23Å; G144-M177 WeakPolarHBondContact O-CE 3.37Å; T147-M177 HydrophobicContact CG2-CE 4.02Å; T147-M177 WeakPolarHBondContact OG1-CE 3.32Å; M177-H181 WeakPolarHBondContact CE-ND1 3.32Å; M177-H181 HydrophobicContact CG-CB 3.69Å; M177-H181 HydrophobicContact SD-CB 4.5Å; M177-H184 HydrophobicContact CG-CB 4.37Å; M177-H184 HydrophobicContact SD-CB 4.21Å; M177-I187 HydrophobicContact CE-CD1 3.96Å; M177-I187 HydrophobicContact SD-CD1 4.47Å; M177-T203 WeakPolarHBondContact CB-O 3.29Å; M177-T203 PolarHBondContact N-O 3.05Å
178	D	96.4	Very high	94.7	Very high	108 Å²	108	64.5 Å²	64.5	58%	0.578	34%	0.337	S	S	*	.			trans	-74.7	161.2	174.7	-64.1	-48.4	0	0	0	112.5	P176 D180 H181 H184	P176-D178 PolarHBondContact O-N 3.18Å; D178-D180 PolarHBondContact O-N 3.35Å; D178-H181 WeakPolarHBondContact O-CB 3.29Å; D178-H181 PolarHBondContact O-N 2.91Å; D178-H181 VanDerWaalsContact O-N 3.08Å; D178-H184 WeakPolarHBondContact O-CB 3.43Å
179	K	96.3	Very high	95.5	Very high	173 Å²	173	68.8 Å²	68.8	75%	0.752	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.5	179	-69.1	-175.4	179.2	177.9	0	113.4	H181	K179-H181 VanDerWaalsContact C-N 3.28Å
180	D	96.8	Very high	96	Very high	159 Å²	159	69 Å²	69	85%	0.85	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-1.8	179.7	-57.3	-40.3	0	0	0	112.7	D178	D178-D180 PolarHBondContact O-N 3.35Å
181	H	97.9	Very high	96.3	Very high	32 Å²	32	78.3 Å²	78.3	15%	0.148	39%	0.394	C	S	.	.	S	Bend	trans	-62.5	136.7	178.7	-175	-93.6	0	0	0	110.5	T147 M177 D178 K179 Y183 H184	T147-H181 PolarHBondContact O-CE1 3.42Å; T147-H181 PolarHBondContact O-NE2 3.47Å; M177-H181 WeakPolarHBondContact CE-ND1 3.32Å; M177-H181 HydrophobicContact CG-CB 3.69Å; M177-H181 HydrophobicContact SD-CB 4.5Å; D178-H181 WeakPolarHBondContact O-CB 3.29Å; D178-H181 PolarHBondContact O-N 2.91Å; D178-H181 VanDerWaalsContact O-N 3.08Å; K179-H181 VanDerWaalsContact C-N 3.28Å; H181-Y183 AromaticContact CE1-CD2 3.67Å; H181-Y183 PolarHBondContact ND1-N 2.82Å; H181-Y183 PolarHBondContact O-N 3.45Å; H181-H184 HydrophobicContact CB-CB 4.22Å; H181-H184 WeakPolarHBondContact O-CB 3.35Å; H181-H184 PolarHBondContact O-N 2.99Å
182	P	97.6	Very high	96.5	Very high	112 Å²	112	78 Å²	78	73%	0.727	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.1	-173.6	-28.1	34.8	0	0	0	114.8
183	Y	97.7	Very high	96.7	Very high	57 Å²	57	75 Å²	75	22%	0.224	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-0.1	-179.5	-60	-68.9	0	0	0	114.6	W67 R72 F77 T147 H181 K185 I186 I187	W67-Y183 HydrophobicContact CH2-CD1 4.33Å; W67-Y183 HydrophobicContact CH2-CD2 4.22Å; W67-Y183 AromaticContact CH2-CE1 3.85Å; W67-Y183 HydrophobicContact CH2-CE1 3.85Å; W67-Y183 AromaticContact CH2-CE2 3.74Å; W67-Y183 HydrophobicContact CH2-CE2 3.74Å; W67-Y183 HydrophobicContact CH2-CG 4.48Å; W67-Y183 AromaticContact CH2-CZ 3.53Å; W67-Y183 AromaticContact CZ2-CE1 3.98Å; W67-Y183 HydrophobicContact CZ2-CE1 3.98Å; W67-Y183 HydrophobicContact CZ2-CE2 4.4Å; W67-Y183 AromaticContact CZ2-CZ 3.75Å; R72-Y183 PolarHBondContact NH2-OH 2.89Å; F77-Y183 AromaticContact CD2-CD1 3.85Å; F77-Y183 HydrophobicContact CD2-CD1 3.85Å; F77-Y183 HydrophobicContact CD2-CE1 4.09Å; F77-Y183 HydrophobicContact CD2-CG 4.48Å; F77-Y183 AromaticContact CE2-CD1 3.94Å; F77-Y183 HydrophobicContact CE2-CD1 3.94Å; F77-Y183 AromaticContact CE2-CE1 3.85Å; F77-Y183 HydrophobicContact CE2-CE1 3.85Å; T147-Y183 HydrophobicContact CG2-CD2 4.48Å; H181-Y183 AromaticContact CE1-CD2 3.67Å; H181-Y183 PolarHBondContact ND1-N 2.82Å; H181-Y183 PolarHBondContact O-N 3.45Å; Y183-K185 PolarHBondContact O-N 2.93Å; Y183-I186 HydrophobicContact CD1-CD1 3.65Å; Y183-I186 HydrophobicContact CD1-CG1 4.27Å; Y183-I186 HydrophobicContact CE1-CD1 4.4Å; Y183-I186 WeakPolarHBondContact O-CG1 3.29Å; Y183-I186 PolarHBondContact O-N 3.21Å; Y183-I187 WeakPolarHBondContact O-CB 3.33Å; Y183-I187 WeakPolarHBondContact O-CG1 3.45Å; Y183-I187 PolarHBondContact O-N 2.88Å; Y183-I187 VanDerWaalsContact O-N 3.13Å
184	H	97.7	Very high	96.7	Very high	25 Å²	25	80.3 Å²	80.3	12%	0.116	39%	0.388	C	S	.	.	H	α-helix	trans	-56.2	-54	-177.8	176.2	-92.1	0	0	0	111.7	M177 D178 H181 I186 I187 S188 E189	M177-H184 HydrophobicContact CG-CB 4.37Å; M177-H184 HydrophobicContact SD-CB 4.21Å; D178-H184 WeakPolarHBondContact O-CB 3.43Å; H181-H184 HydrophobicContact CB-CB 4.22Å; H181-H184 WeakPolarHBondContact O-CB 3.35Å; H181-H184 PolarHBondContact O-N 2.99Å; H184-I186 VanDerWaalsContact C-N 3.32Å; H184-I186 PolarHBondContact O-N 2.95Å; H184-I187 CarbonylContact O-C 3.58Å; H184-I187 PolarHBondContact O-N 3.43Å; H184-S188 PolarHBondContact CD2-OG 3.14Å; H184-S188 WeakPolarHBondContact NE2-CB 3.24Å; H184-S188 WeakPolarHBondContact O-CB 3.48Å; H184-S188 PolarHBondContact O-N 2.9Å; H184-E189 IonicContact CE1-OE1 3.43Å; H184-E189 PolarHBondContact CE1-OE1 3.33Å; H184-E189 IonicContact ND1-OE1 3.87Å; H184-E189 PolarHBondContact ND1-OE1 2.95Å
185	K	96.4	Very high	96.6	Very high	150 Å²	150	88 Å²	88	65%	0.652	42%	0.423	S	S	*	.	H	α-helix	trans	-59	-40.5	-176.5	-173.7	170.6	-174.3	176.9	0	113.1	Y183 E189	Y183-K185 PolarHBondContact O-N 2.93Å; K185-E189 WeakPolarHBondContact O-CB 3.33Å
186	I	97.3	Very high	96.6	Very high	95 Å²	95	86.9 Å²	86.9	49%	0.487	41%	0.414	S	S	.	.	H	α-helix	trans	-80.1	-20.3	-177.3	66.8	164.8	0	0	0	113.2	F77 Y183 H184	F77-I186 HydrophobicContact CD2-CD1 3.78Å; F77-I186 HydrophobicContact CE2-CD1 3.57Å; Y183-I186 HydrophobicContact CD1-CD1 3.65Å; Y183-I186 HydrophobicContact CD1-CG1 4.27Å; Y183-I186 HydrophobicContact CE1-CD1 4.4Å; Y183-I186 WeakPolarHBondContact O-CG1 3.29Å; Y183-I186 PolarHBondContact O-N 3.21Å; H184-I186 VanDerWaalsContact C-N 3.32Å; H184-I186 PolarHBondContact O-N 2.95Å
187	I	97	Very high	96.4	Very high	4 Å²	4	91.3 Å²	91.3	2%	0.021	43%	0.427	C	S	.	.	H	α-helix	trans	-97.7	-69.1	178.4	-64	171.8	0	0	0	109.9	W76 F77 T147 M177 Y183 H184 E189 S190 Y193	W76-I187 HydrophobicContact CB-CG2 3.74Å; W76-I187 HydrophobicContact CE3-CG2 4.36Å; F77-I187 HydrophobicContact CB-CD1 4.16Å; T147-I187 HydrophobicContact CG2-CD1 3.86Å; M177-I187 HydrophobicContact CE-CD1 3.96Å; M177-I187 HydrophobicContact SD-CD1 4.47Å; Y183-I187 WeakPolarHBondContact O-CB 3.33Å; Y183-I187 WeakPolarHBondContact O-CG1 3.45Å; Y183-I187 PolarHBondContact O-N 2.88Å; Y183-I187 VanDerWaalsContact O-N 3.13Å; H184-I187 CarbonylContact O-C 3.58Å; H184-I187 PolarHBondContact O-N 3.43Å; I187-E189 PolarHBondContact O-N 2.94Å; I187-S190 WeakPolarHBondContact O-CB 3.27Å; I187-S190 PolarHBondContact O-N 3.36Å; I187-S190 VanDerWaalsContact O-N 3.16Å; I187-Y193 VanDerWaalsContact O-CD2 3.23Å; I187-Y193 WeakPolarHBondContact O-CD2 3.3Å; I187-Y193 WeakPolarHBondContact O-CE2 3.49Å
188	S	94.6	Very high	96.1	Very high	20 Å²	20	97.4 Å²	97.4	14%	0.14	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-28.2	-169.7	-54.1	0	0	0	0	113.6	H184 L201	H184-S188 PolarHBondContact CD2-OG 3.14Å; H184-S188 WeakPolarHBondContact NE2-CB 3.24Å; H184-S188 WeakPolarHBondContact O-CB 3.48Å; H184-S188 PolarHBondContact O-N 2.9Å; S188-L201 WeakPolarHBondContact O-CD2 3.35Å
189	E	95.2	Very high	95.9	Very high	118 Å²	118	96 Å²	96	55%	0.551	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	9.2	176.3	-56.2	171.6	-152.1	0	0	112.3	H184 K185 I187 R191	H184-E189 IonicContact CE1-OE1 3.43Å; H184-E189 PolarHBondContact CE1-OE1 3.33Å; H184-E189 IonicContact ND1-OE1 3.87Å; H184-E189 PolarHBondContact ND1-OE1 2.95Å; K185-E189 WeakPolarHBondContact O-CB 3.33Å; I187-E189 PolarHBondContact O-N 2.94Å; E189-R191 PolarHBondContact O-N 3.45Å
190	S	97.3	Very high	95.8	Very high	23 Å²	23	90.3 Å²	90.3	16%	0.161	46%	0.457	C	S	.	.			trans	-64.2	131.9	178.7	-165.4	0	0	0	0	111	I187 R192 Y193	I187-S190 WeakPolarHBondContact O-CB 3.27Å; I187-S190 PolarHBondContact O-N 3.36Å; I187-S190 VanDerWaalsContact O-N 3.16Å; S190-R192 PolarHBondContact O-N 3.36Å; S190-R192 PolarHBondContact OG-NE 2.95Å; S190-R192 VanDerWaalsContact OG-NE 3.16Å; S190-Y193 PolarHBondContact O-N 3.04Å
191	R	97.4	Very high	95.8	Very high	219 Å²	219	85.3 Å²	85.3	83%	0.826	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-53.5	-23.6	178.2	71.7	177	-177	84.5	-1.2	114.3	E189 Y193 K194	E189-R191 PolarHBondContact O-N 3.45Å; R191-Y193 PolarHBondContact O-N 3.19Å; R191-K194 WeakPolarHBondContact O-CB 3.34Å; R191-K194 PolarHBondContact O-N 3.2Å
192	R	97	Very high	95.8	Very high	89 Å²	89	85 Å²	85	34%	0.336	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-64.6	-18.2	178.4	75.4	-175.2	74.8	-168.6	4.4	113.1	D78 V110 S190	D78-R192 IonicContact OD1-NH1 3.43Å; D78-R192 PolarHBondContact OD1-NH1 2.89Å; D78-R192 IonicContact OD2-CZ 3.14Å; D78-R192 VanDerWaalsContact OD2-CZ 3.28Å; D78-R192 IonicContact OD2-NH1 3.06Å; D78-R192 PolarHBondContact OD2-NH1 3.49Å; D78-R192 IonicContact OD2-NH2 3Å; D78-R192 PolarHBondContact OD2-NH2 2.92Å; V110-R192 HydrophobicContact CG2-CG 4.45Å; V110-R192 PolarHBondContact O-NH1 3.43Å; S190-R192 PolarHBondContact O-N 3.36Å; S190-R192 PolarHBondContact OG-NE 2.95Å; S190-R192 VanDerWaalsContact OG-NE 3.16Å
193	Y	97.4	Very high	95.8	Very high	10 Å²	10	83 Å²	83	4%	0.039	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-110.6	4.8	179.6	-52.1	-57	0	0	0	113.3	W76 V110 W136 N139 I187 S190 R191 E195 L196 L201	W76-Y193 AromaticContact CE3-CE1 3.9Å; W76-Y193 HydrophobicContact CE3-CE1 3.9Å; W76-Y193 AromaticContact CE3-CE2 3.8Å; W76-Y193 HydrophobicContact CE3-CE2 3.8Å; W76-Y193 AromaticContact CE3-CZ 3.42Å; W76-Y193 VanDerWaalsContact CE3-CZ 3.42Å; W76-Y193 HydrophobicContact CH2-CE1 4.3Å; W76-Y193 AromaticContact CZ3-CD1 3.93Å; W76-Y193 HydrophobicContact CZ3-CD1 3.93Å; W76-Y193 HydrophobicContact CZ3-CD2 4.36Å; W76-Y193 AromaticContact CZ3-CE1 3.52Å; W76-Y193 HydrophobicContact CZ3-CE1 3.52Å; W76-Y193 AromaticContact CZ3-CE2 3.98Å; W76-Y193 HydrophobicContact CZ3-CE2 3.98Å; W76-Y193 HydrophobicContact CZ3-CG 4.34Å; W76-Y193 AromaticContact CZ3-CZ 3.54Å; V110-Y193 HydrophobicContact CG2-CE1 3.66Å; W136-Y193 HydrophobicContact CB-CD1 4.19Å; W136-Y193 HydrophobicContact CB-CE1 3.92Å; N139-Y193 PolarHBondContact ND2-OH 2.81Å; N139-Y193 VanDerWaalsContact ND2-OH 3.09Å; I187-Y193 VanDerWaalsContact O-CD2 3.23Å; I187-Y193 WeakPolarHBondContact O-CD2 3.3Å; I187-Y193 WeakPolarHBondContact O-CE2 3.49Å; S190-Y193 PolarHBondContact O-N 3.04Å; R191-Y193 PolarHBondContact O-N 3.19Å; Y193-E195 PolarHBondContact O-N 2.62Å; Y193-L196 HydrophobicContact CD1-CD2 4.43Å; Y193-L196 WeakPolarHBondContact O-CB 3.35Å; Y193-L196 PolarHBondContact O-N 3.11Å; Y193-L196 VanDerWaalsContact O-N 3.15Å; Y193-L201 HydrophobicContact CD2-CD1 4.26Å; Y193-L201 HydrophobicContact CG-CD1 4.09Å
194	K	94.8	Very high	95.8	Very high	166 Å²	166	81.5 Å²	81.5	72%	0.722	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-30.7	-173	-169.9	-179.1	177.9	-172.2	0	113.6	R191 L196	R191-K194 WeakPolarHBondContact O-CB 3.34Å; R191-K194 PolarHBondContact O-N 3.2Å; K194-L196 VanDerWaalsContact C-N 3.35Å
195	E	93.4	Very high	95.8	Very high	164 Å²	164	80.5 Å²	80.5	77%	0.766	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	1.6	-177.9	-53.9	-55.4	135.3	0	0	113.3	Y193	Y193-E195 PolarHBondContact O-N 2.62Å
196	L	94.1	Very high	95.7	Very high	32 Å²	32	73.4 Å²	73.4	17%	0.168	38%	0.379	C	S	.	.	S	Bend	trans	-68.5	141.4	173.1	-88.4	60.4	0	0	0	109.4	W136 Y193 K194 E200 L201	W136-L196 HydrophobicContact CD2-CD2 3.94Å; W136-L196 HydrophobicContact CG-CD1 4.24Å; W136-L196 HydrophobicContact CG-CD2 4.1Å; W136-L196 HydrophobicContact CZ2-CD2 4.23Å; Y193-L196 HydrophobicContact CD1-CD2 4.43Å; Y193-L196 WeakPolarHBondContact O-CB 3.35Å; Y193-L196 PolarHBondContact O-N 3.11Å; Y193-L196 VanDerWaalsContact O-N 3.15Å; K194-L196 VanDerWaalsContact C-N 3.35Å; L196-E200 HydrophobicContact CB-CB 4.1Å; L196-E200 HydrophobicContact CD2-CB 4.23Å; L196-E200 HydrophobicContact CG-CB 4.19Å; L196-L201 HydrophobicContact CD2-CB 4.11Å; L196-L201 HydrophobicContact CD2-CD1 4.32Å
197	K	94.5	Very high	95.6	Very high	156 Å²	156	69 Å²	69	68%	0.678	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-67.9	157.2	174.9	-61.1	174.6	-177.9	175.1	0	110	G199 E200	K197-G199 PolarHBondContact O-N 3.15Å; K197-E200 HydrophobicContact CB-CG 4.01Å; K197-E200 PolarHBondContact N-OE2 3.34Å; K197-E200 WeakPolarHBondContact O-CB 3.37Å; K197-E200 PolarHBondContact O-N 3.23Å
198	S	91.2	Very high	95.5	Very high	134 Å²	134	74.1 Å²	74.1	94%	0.937	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	129.3	171.7	-171.6	0	0	0	0	110.2
199	G	91.6	Very high	95.7	Very high	78 Å²	78	76.5 Å²	76.5	80%	0.804	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-8.2	-177.4	0	0	0	0	0	115.9	K197	K197-G199 PolarHBondContact O-N 3.15Å
200	E	94.8	Very high	95.7	Very high	53 Å²	53	70.9 Å²	70.9	25%	0.248	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-27.1	177.1	-72.1	-171.8	138.4	0	0	113.5	W136 R137 L196 K197 P202	W136-E200 WeakPolarHBondContact CH2-O 3.38Å; W136-E200 HydrophobicContact CZ2-CB 4.09Å; R137-E200 IonicContact NH2-OE1 3.48Å; R137-E200 PolarHBondContact NH2-OE1 3.09Å; R137-E200 VanDerWaalsContact NH2-OE1 3.14Å; L196-E200 HydrophobicContact CB-CB 4.1Å; L196-E200 HydrophobicContact CD2-CB 4.23Å; L196-E200 HydrophobicContact CG-CB 4.19Å; K197-E200 HydrophobicContact CB-CG 4.01Å; K197-E200 PolarHBondContact N-OE2 3.34Å; K197-E200 WeakPolarHBondContact O-CB 3.37Å; K197-E200 PolarHBondContact O-N 3.23Å; E200-P202 WeakPolarHBondContact O-CD 3.46Å
201	L	96.8	Very high	95.7	Very high	54 Å²	54	70.4 Å²	70.4	28%	0.283	36%	0.359	S	S	.	.	S	Bend	trans	-82	108.9	178.6	179.8	62.4	0	0	0	109.8	W76 S188 Y193 L196	W76-L201 HydrophobicContact CE3-CD1 4.24Å; W76-L201 HydrophobicContact CH2-CD1 4.03Å; W76-L201 HydrophobicContact CZ3-CD1 3.38Å; S188-L201 WeakPolarHBondContact O-CD2 3.35Å; Y193-L201 HydrophobicContact CD2-CD1 4.26Å; Y193-L201 HydrophobicContact CG-CD1 4.09Å; L196-L201 HydrophobicContact CD2-CB 4.11Å; L196-L201 HydrophobicContact CD2-CD1 4.32Å
202	P	97.6	Very high	95.7	Very high	25 Å²	25	63 Å²	63	16%	0.162	35%	0.345	C	S	.	.			trans	-75.4	146	-179.4	31.4	-35.8	0	0	0	111.5	W76 H142 E200 E205	W76-P202 HydrophobicContact CH2-CG 3.79Å; W76-P202 HydrophobicContact CZ2-CG 3.66Å; H142-P202 HydrophobicContact CB-CG 4.19Å; E200-P202 WeakPolarHBondContact O-CD 3.46Å; P202-E205 HydrophobicContact CB-CG 3.68Å; P202-E205 HydrophobicContact CG-CG 3.79Å
203	T	97.6	Very high	95.7	Very high	70 Å²	70	59.6 Å²	59.6	43%	0.429	33%	0.332	S	S	.	.	S	Bend	trans	-89.1	-22.1	166.4	58	0	0	0	0	111.8	H142 G144 P176 M177	H142-T203 PolarHBondContact CE1-O 2.83Å; H142-T203 PolarHBondContact ND1-O 3.28Å; G144-T203 WeakPolarHBondContact CA-O 3.5Å; P176-T203 WeakPolarHBondContact CB-OG1 3.28Å; M177-T203 WeakPolarHBondContact CB-O 3.29Å; M177-T203 PolarHBondContact N-O 3.05Å
204	C	97.4	Very high	95.7	Very high	26 Å²	26	59.2 Å²	59.2	18%	0.176	33%	0.331	C	S	.	.	S	Bend	trans	-157.4	162.4	167	57	0	0	0	0	109.5	H142 P174	H142-C204 WeakPolarHBondContact O-CA 3.44Å; P174-C204 HydrophobicContact CG-CB 3.98Å; P174-C204 PolarHBondContact O-SG 3.17Å
205	E	97.6	Very high	95.8	Very high	4 Å²	4	53 Å²	53	2%	0.019	31%	0.306	C	S	.	.			trans	-134.7	138.5	176.2	-69.7	178.3	120.6	0	0	110.1	R141 H142 P174 P202 D209 R213	R141-E205 HydrophobicContact CG-CB 4.1Å; R141-E205 WeakPolarHBondContact CG-O 3.3Å; R141-E205 PolarHBondContact NE-O 3.06Å; R141-E205 PolarHBondContact NH2-O 3.22Å; H142-E205 HydrophobicContact CB-CB 4.18Å; H142-E205 HydrophobicContact CB-CG 3.83Å; H142-E205 PolarHBondContact N-OE2 3.41Å; H142-E205 PolarHBondContact O-N 2.93Å; P174-E205 WeakPolarHBondContact CD-O 3.32Å; P202-E205 HydrophobicContact CB-CG 3.68Å; P202-E205 HydrophobicContact CG-CG 3.79Å; E205-D209 HydrophobicContact CB-CB 4.07Å; E205-D209 HydrophobicContact CG-CB 4.25Å; E205-R213 WeakPolarHBondContact OE1-CG 3.49Å; E205-R213 IonicContact OE1-CZ 2.74Å; E205-R213 IonicContact OE1-NE 3.97Å; E205-R213 PolarHBondContact OE1-NE 3.21Å; E205-R213 IonicContact OE1-NH2 3.68Å; E205-R213 PolarHBondContact OE1-NH2 2.89Å; E205-R213 IonicContact OE2-CZ 3.67Å; E205-R213 IonicContact OE2-NE 2.8Å; E205-R213 IonicContact OE2-NH2 2.71Å; E205-R213 PolarHBondContact OE2-NH2 3.27Å
206	S	95.9	Very high	96	Very high	1 Å²	1	47 Å²	47	1%	0.007	28%	0.28	C	S	.	.			trans	-72.6	173.9	153.6	68.2	0	0	0	0	110.8	K208 D209 T210	S206-K208 VanDerWaalsContact C-N 3.28Å; S206-K208 WeakPolarHBondContact OG-CB 3.37Å; S206-K208 PolarHBondContact OG-N 3.14Å; S206-D209 VanDerWaalsContact CB-OD2 3.3Å; S206-D209 WeakPolarHBondContact CB-OD2 3.42Å; S206-D209 PolarHBondContact N-OD2 3.06Å; S206-D209 PolarHBondContact O-N 3.01Å; S206-D209 PolarHBondContact OG-N 3.14Å; S206-D209 PolarHBondContact OG-OD2 3.09Å; S206-T210 PolarHBondContact O-N 3.33Å; S206-T210 VanDerWaalsContact O-N 3.13Å; S206-T210 PolarHBondContact O-OG1 2.79Å
207	L	93.6	Very high	96.2	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-40	169.3	178.1	59.5	0	0	0	109.8	F170 D209 T210 I211 N239 I256	F170-L207 HydrophobicContact CD2-CB 4.4Å; F170-L207 HydrophobicContact CD2-CD2 4.09Å; F170-L207 HydrophobicContact CD2-CG 4.21Å; F170-L207 CarbonylContact O-C 3.49Å; F170-L207 PolarHBondContact O-N 2.75Å; F170-L207 VanDerWaalsContact O-N 3.13Å; L207-D209 VanDerWaalsContact C-N 3.34Å; L207-D209 PolarHBondContact O-N 3.39Å; L207-T210 WeakPolarHBondContact O-CB 3.48Å; L207-T210 PolarHBondContact O-N 3.12Å; L207-I211 HydrophobicContact CD1-CD1 4.2Å; L207-I211 HydrophobicContact CD1-CG1 4.27Å; L207-I211 HydrophobicContact CG-CD1 3.98Å; L207-I211 HydrophobicContact CG-CG1 4.45Å; L207-I211 WeakPolarHBondContact O-CG1 3.08Å; L207-I211 PolarHBondContact O-N 3.48Å; L207-N239 HydrophobicContact CD1-CB 3.88Å; L207-I256 HydrophobicContact CD2-CG1 4.35Å; L207-I256 HydrophobicContact CD2-CG2 4.16Å
208	K	96.1	Very high	96.3	Very high	111 Å²	111	39 Å²	39	48%	0.483	24%	0.244	S	C	.	.	H	α-helix	trans	-55.6	-45.3	174.6	-176.6	-179	179.4	179.2	0	112.1	F170 D171 S206 I211 A212	F170-K208 HydrophobicContact CD1-CB 4.12Å; F170-K208 HydrophobicContact CD1-CD 4.5Å; F170-K208 HydrophobicContact CE1-CB 3.77Å; F170-K208 HydrophobicContact CE1-CD 3.97Å; F170-K208 HydrophobicContact CE1-CG 3.85Å; F170-K208 HydrophobicContact CE2-CB 4.39Å; F170-K208 HydrophobicContact CZ-CB 3.91Å; F170-K208 HydrophobicContact CZ-CG 4.07Å; F170-K208 WeakPolarHBondContact O-CB 3.47Å; F170-K208 PolarHBondContact O-N 3.24Å; D171-K208 HydrophobicContact CB-CD 4.2Å; S206-K208 VanDerWaalsContact C-N 3.28Å; S206-K208 WeakPolarHBondContact OG-CB 3.37Å; S206-K208 PolarHBondContact OG-N 3.14Å; K208-I211 PolarHBondContact O-N 3.46Å; K208-A212 WeakPolarHBondContact O-CB 3.19Å; K208-A212 PolarHBondContact O-N 3Å
209	D	97.5	Very high	96.6	Very high	70 Å²	70	36.6 Å²	36.6	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-44.5	178.6	-57.1	-41.6	0	0	0	111.3	E205 S206 L207 I211 A212 R213	E205-D209 HydrophobicContact CB-CB 4.07Å; E205-D209 HydrophobicContact CG-CB 4.25Å; S206-D209 VanDerWaalsContact CB-OD2 3.3Å; S206-D209 WeakPolarHBondContact CB-OD2 3.42Å; S206-D209 PolarHBondContact N-OD2 3.06Å; S206-D209 PolarHBondContact O-N 3.01Å; S206-D209 PolarHBondContact OG-N 3.14Å; S206-D209 PolarHBondContact OG-OD2 3.09Å; L207-D209 VanDerWaalsContact C-N 3.34Å; L207-D209 PolarHBondContact O-N 3.39Å; D209-I211 VanDerWaalsContact C-N 3.25Å; D209-I211 PolarHBondContact O-N 3.4Å; D209-A212 WeakPolarHBondContact O-CB 3.34Å; D209-A212 PolarHBondContact O-N 3.17Å; D209-A212 VanDerWaalsContact O-N 3.11Å; D209-R213 WeakPolarHBondContact O-CG 3.42Å; D209-R213 PolarHBondContact O-N 3.5Å
210	T	97.3	Very high	97	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-54.7	-44.5	175.4	-57.2	0	0	0	0	110.6	S206 L207 R213 A214 N239	S206-T210 PolarHBondContact O-N 3.33Å; S206-T210 VanDerWaalsContact O-N 3.13Å; S206-T210 PolarHBondContact O-OG1 2.79Å; L207-T210 WeakPolarHBondContact O-CB 3.48Å; L207-T210 PolarHBondContact O-N 3.12Å; T210-R213 VanDerWaalsContact CG2-NH2 3.31Å; T210-R213 VanDerWaalsContact O-CD 3.32Å; T210-R213 WeakPolarHBondContact O-CD 3.12Å; T210-R213 WeakPolarHBondContact O-CG 3.11Å; T210-R213 PolarHBondContact O-NE 3.3Å; T210-A214 VanDerWaalsContact O-CB 3.24Å; T210-A214 WeakPolarHBondContact O-CB 3.42Å; T210-A214 PolarHBondContact O-N 3.16Å; T210-A214 VanDerWaalsContact O-N 3.12Å; T210-N239 HydrophobicContact CG2-CB 4.27Å
211	I	95.8	Very high	97.1	Very high	14 Å²	14	39.7 Å²	39.7	7%	0.072	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-46	177.3	-65.4	177.4	0	0	0	110.8	F170 L207 K208 D209 R213 A214 L215 G243 K246	F170-I211 HydrophobicContact CE2-CD1 3.83Å; L207-I211 HydrophobicContact CD1-CD1 4.2Å; L207-I211 HydrophobicContact CD1-CG1 4.27Å; L207-I211 HydrophobicContact CG-CD1 3.98Å; L207-I211 HydrophobicContact CG-CG1 4.45Å; L207-I211 WeakPolarHBondContact O-CG1 3.08Å; L207-I211 PolarHBondContact O-N 3.48Å; K208-I211 PolarHBondContact O-N 3.46Å; D209-I211 VanDerWaalsContact C-N 3.25Å; D209-I211 PolarHBondContact O-N 3.4Å; I211-R213 PolarHBondContact O-N 2.97Å; I211-A214 PolarHBondContact O-N 2.86Å; I211-L215 HydrophobicContact CG2-CD1 3.52Å; I211-L215 HydrophobicContact CG2-CG 3.76Å; I211-L215 WeakPolarHBondContact O-CG 3.48Å; I211-L215 PolarHBondContact O-N 3.24Å; I211-G243 VanDerWaalsContact CG1-CA 3.46Å; I211-K246 HydrophobicContact CD1-CD 3.73Å
212	A	97	Very high	97.2	Very high	64 Å²	64	37.2 Å²	37.2	53%	0.529	21%	0.205	S	C	.	.	H	α-helix	trans	-58.7	-34.2	-178.2	0	0	0	0	0	112.5	K208 D209 P216	K208-A212 WeakPolarHBondContact O-CB 3.19Å; K208-A212 PolarHBondContact O-N 3Å; D209-A212 WeakPolarHBondContact O-CB 3.34Å; D209-A212 PolarHBondContact O-N 3.17Å; D209-A212 VanDerWaalsContact O-N 3.11Å; A212-P216 WeakPolarHBondContact O-CD 3.44Å; A212-P216 WeakPolarHBondContact O-CG 3.37Å
213	R	97.5	Very high	97.2	Very high	16 Å²	16	36.4 Å²	36.4	6%	0.06	20%	0.2	C	C	.	.	H	α-helix	trans	-86.9	-22.1	174.3	60.2	77.1	173.1	159.4	-3.5	114.8	W136 R137 N139 E140 E205 D209 T210 I211	W136-R213 HydrophobicContact CH2-CB 3.78Å; W136-R213 HydrophobicContact CH2-CG 4.11Å; W136-R213 HydrophobicContact CZ3-CB 4.02Å; W136-R213 HydrophobicContact CZ3-CG 3.82Å; R137-R213 VanDerWaalsContact C-NH1 3.35Å; R137-R213 WeakPolarHBondContact CB-O 3.5Å; R137-R213 WeakPolarHBondContact CD-O 3.39Å; R137-R213 WeakPolarHBondContact CG-O 3.27Å; R137-R213 PolarHBondContact NH1-O 2.88Å; R137-R213 PolarHBondContact O-NH1 2.98Å; N139-R213 VanDerWaalsContact O-CZ 3.31Å; N139-R213 PolarHBondContact O-NH1 3.42Å; N139-R213 PolarHBondContact O-NH2 3.5Å; E140-R213 PolarHBondContact O-NH2 3.45Å; E205-R213 WeakPolarHBondContact OE1-CG 3.49Å; E205-R213 IonicContact OE1-CZ 2.74Å; E205-R213 IonicContact OE1-NE 3.97Å; E205-R213 PolarHBondContact OE1-NE 3.21Å; E205-R213 IonicContact OE1-NH2 3.68Å; E205-R213 PolarHBondContact OE1-NH2 2.89Å; E205-R213 IonicContact OE2-CZ 3.67Å; E205-R213 IonicContact OE2-NE 2.8Å; E205-R213 IonicContact OE2-NH2 2.71Å; E205-R213 PolarHBondContact OE2-NH2 3.27Å; D209-R213 WeakPolarHBondContact O-CG 3.42Å; D209-R213 PolarHBondContact O-N 3.5Å; T210-R213 VanDerWaalsContact CG2-NH2 3.31Å; T210-R213 VanDerWaalsContact O-CD 3.32Å; T210-R213 WeakPolarHBondContact O-CD 3.12Å; T210-R213 WeakPolarHBondContact O-CG 3.11Å; T210-R213 PolarHBondContact O-NE 3.3Å; I211-R213 PolarHBondContact O-N 2.97Å
214	A	97.4	Very high	97.2	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-82.9	-39.8	179.8	0	0	0	0	0	112.7	R137 T210 I211 F217 W218	R137-A214 WeakPolarHBondContact O-CA 3.41Å; R137-A214 WeakPolarHBondContact O-CB 3.38Å; T210-A214 VanDerWaalsContact O-CB 3.24Å; T210-A214 WeakPolarHBondContact O-CB 3.42Å; T210-A214 PolarHBondContact O-N 3.16Å; T210-A214 VanDerWaalsContact O-N 3.12Å; I211-A214 PolarHBondContact O-N 2.86Å; A214-F217 WeakPolarHBondContact O-CB 3.37Å; A214-F217 PolarHBondContact O-N 3.09Å; A214-F217 VanDerWaalsContact O-N 3.16Å; A214-W218 PolarHBondContact O-N 3.08Å; A214-W218 VanDerWaalsContact O-N 3.09Å
215	L	96.6	Very high	97.3	Very high	36 Å²	36	37.1 Å²	37.1	19%	0.188	20%	0.201	C	C	.	.	H	α-helix	trans	-63	-37.6	-177	-73.7	-177.8	0	0	0	114.9	I211 F217 W218 N219 H247	I211-L215 HydrophobicContact CG2-CD1 3.52Å; I211-L215 HydrophobicContact CG2-CG 3.76Å; I211-L215 WeakPolarHBondContact O-CG 3.48Å; I211-L215 PolarHBondContact O-N 3.24Å; L215-F217 VanDerWaalsContact C-N 3.27Å; L215-F217 PolarHBondContact O-N 3.38Å; L215-W218 WeakPolarHBondContact O-CB 3.46Å; L215-W218 PolarHBondContact O-N 3.49Å; L215-W218 VanDerWaalsContact O-N 3.14Å; L215-N219 WeakPolarHBondContact O-CB 3.34Å; L215-N219 PolarHBondContact O-N 3.28Å; L215-N219 PolarHBondContact O-ND2 2.84Å; L215-H247 HydrophobicContact CD1-CB 4.5Å; L215-H247 HydrophobicContact CD2-CB 3.56Å
216	P	97.5	Very high	97.3	Very high	37 Å²	37	37 Å²	37	24%	0.24	20%	0.2	C	C	.	.	H	α-helix	trans	-56.2	-42.7	172.3	-28.5	36.3	0	0	0	112.1	A212 W218 N219 E220	A212-P216 WeakPolarHBondContact O-CD 3.44Å; A212-P216 WeakPolarHBondContact O-CG 3.37Å; P216-W218 PolarHBondContact O-N 2.79Å; P216-N219 PolarHBondContact O-N 3.15Å; P216-E220 VanDerWaalsContact O-CB 3.24Å; P216-E220 WeakPolarHBondContact O-CB 3.4Å; P216-E220 VanDerWaalsContact O-CG 3.27Å; P216-E220 WeakPolarHBondContact O-CG 3.48Å; P216-E220 PolarHBondContact O-N 3.21Å
217	F	98.2	Very high	97.3	Very high	18 Å²	18	42.3 Å²	42.3	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-66.3	-38.6	176.6	-171.7	-105.7	0	0	0	112.6	Y107 I133 T135 R137 L138 A214 L215 V221 I222	Y107-F217 AromaticContact CD1-CE1 3.7Å; Y107-F217 HydrophobicContact CD1-CE1 3.7Å; Y107-F217 AromaticContact CD1-CZ 3.71Å; Y107-F217 HydrophobicContact CD1-CZ 3.71Å; Y107-F217 HydrophobicContact CE1-CE1 4.2Å; Y107-F217 AromaticContact CE1-CZ 3.96Å; Y107-F217 HydrophobicContact CE1-CZ 3.96Å; Y107-F217 HydrophobicContact CG-CE1 4.43Å; I133-F217 HydrophobicContact CG2-CE2 4.46Å; I133-F217 HydrophobicContact CG2-CZ 3.95Å; T135-F217 HydrophobicContact CG2-CD1 3.68Å; T135-F217 HydrophobicContact CG2-CD2 4Å; T135-F217 HydrophobicContact CG2-CE1 3.43Å; T135-F217 VanDerWaalsContact CG2-CE1 3.43Å; T135-F217 HydrophobicContact CG2-CE2 3.77Å; T135-F217 HydrophobicContact CG2-CG 3.95Å; T135-F217 HydrophobicContact CG2-CZ 3.48Å; T135-F217 VanDerWaalsContact CG2-CZ 3.48Å; R137-F217 HydrophobicContact CB-CB 3.91Å; R137-F217 HydrophobicContact CB-CG 4.35Å; R137-F217 HydrophobicContact CG-CB 4.49Å; L138-F217 HydrophobicContact CD1-CD1 4.27Å; L138-F217 HydrophobicContact CD1-CE1 3.92Å; L138-F217 HydrophobicContact CD2-CD1 4.46Å; L138-F217 HydrophobicContact CG-CD1 4.12Å; L138-F217 HydrophobicContact CG-CE1 4.25Å; A214-F217 WeakPolarHBondContact O-CB 3.37Å; A214-F217 PolarHBondContact O-N 3.09Å; A214-F217 VanDerWaalsContact O-N 3.16Å; L215-F217 VanDerWaalsContact C-N 3.27Å; L215-F217 PolarHBondContact O-N 3.38Å; F217-V221 HydrophobicContact CD2-CB 4.01Å; F217-V221 HydrophobicContact CD2-CG2 3.7Å; F217-V221 HydrophobicContact CE2-CB 3.8Å; F217-V221 HydrophobicContact CE2-CG1 3.87Å; F217-V221 HydrophobicContact CE2-CG2 3.67Å; F217-V221 HydrophobicContact CZ-CB 4.12Å; F217-V221 HydrophobicContact CZ-CG1 3.92Å; F217-V221 HydrophobicContact CZ-CG2 4.48Å; F217-V221 WeakPolarHBondContact O-CB 3.44Å; F217-V221 PolarHBondContact O-N 3.42Å; F217-I222 HydrophobicContact CD1-CD1 3.75Å; F217-I222 HydrophobicContact CD1-CG1 4.04Å; F217-I222 HydrophobicContact CE1-CD1 3.75Å; F217-I222 HydrophobicContact CE1-CG1 3.84Å; F217-I222 PolarHBondContact O-N 2.91Å
218	W	98.2	Very high	97.4	Very high	3 Å²	3	45.7 Å²	45.7	1%	0.011	25%	0.252	C	S	.	.	I	π-helix	trans	-59.1	-53.4	172.3	168.6	-93.7	0	0	0	111.3	L57 A214 L215 P216 I222 A223 I226 I234 I244 H247 L248 L275	L57-W218 HydrophobicContact CD2-CH2 3.7Å; L57-W218 HydrophobicContact CD2-CZ3 3.76Å; A214-W218 PolarHBondContact O-N 3.08Å; A214-W218 VanDerWaalsContact O-N 3.09Å; L215-W218 WeakPolarHBondContact O-CB 3.46Å; L215-W218 PolarHBondContact O-N 3.49Å; L215-W218 VanDerWaalsContact O-N 3.14Å; P216-W218 PolarHBondContact O-N 2.79Å; W218-I222 HydrophobicContact CE3-CB 4.02Å; W218-I222 HydrophobicContact CE3-CD1 4.21Å; W218-I222 HydrophobicContact CE3-CG2 3.69Å; W218-I222 HydrophobicContact CH2-CG2 4.48Å; W218-I222 HydrophobicContact CZ3-CB 4.49Å; W218-I222 HydrophobicContact CZ3-CG2 3.67Å; W218-I222 PolarHBondContact O-N 3.3Å; W218-A223 VanDerWaalsContact O-CB 3.3Å; W218-A223 WeakPolarHBondContact O-CB 3.23Å; W218-A223 PolarHBondContact O-N 3.07Å; W218-I226 HydrophobicContact CH2-CD1 3.63Å; W218-I226 HydrophobicContact CZ2-CD1 4.36Å; W218-I226 HydrophobicContact CZ3-CD1 4.06Å; W218-I234 HydrophobicContact CE3-CD1 4.41Å; W218-I234 HydrophobicContact CZ3-CD1 4.13Å; W218-I244 HydrophobicContact CD2-CG2 4.33Å; W218-I244 HydrophobicContact CE3-CD1 4.38Å; W218-I244 HydrophobicContact CE3-CG1 4.45Å; W218-I244 HydrophobicContact CE3-CG2 3.73Å; W218-I244 HydrophobicContact CH2-CG2 4.33Å; W218-I244 HydrophobicContact CZ3-CG2 3.72Å; W218-H247 AromaticContact CD1-CD2 3.65Å; W218-H247 AromaticContact CD1-NE2 3.71Å; W218-H247 AromaticContact NE1-CD2 3.35Å; W218-H247 PolarHBondContact NE1-CD2 3.46Å; W218-H247 VanDerWaalsContact NE1-CD2 3.35Å; W218-H247 AromaticContact NE1-NE2 3.39Å; W218-H247 PolarHBondContact NE1-NE2 3.49Å; W218-L248 HydrophobicContact CH2-CD1 4.26Å; W218-L248 HydrophobicContact CH2-CD2 3.86Å; W218-L248 HydrophobicContact CH2-CG 4.38Å; W218-L248 HydrophobicContact CZ2-CD2 3.52Å; W218-L248 HydrophobicContact CZ2-CG 4.28Å; W218-L275 HydrophobicContact CZ2-CD1 4.28Å
219	N	97.7	Very high	97.3	Very high	84 Å²	84	42.7 Å²	42.7	45%	0.449	25%	0.253	S	S	.	.	I	π-helix	trans	-67.2	-40.5	-175.1	-71.7	-29.9	0	0	0	113.4	L215 P216 P224	L215-N219 WeakPolarHBondContact O-CB 3.34Å; L215-N219 PolarHBondContact O-N 3.28Å; L215-N219 PolarHBondContact O-ND2 2.84Å; P216-N219 PolarHBondContact O-N 3.15Å; N219-P224 VanDerWaalsContact O-CD 3.31Å; N219-P224 WeakPolarHBondContact O-CD 3.27Å
220	E	98.2	Very high	97.3	Very high	149 Å²	149	43 Å²	43	70%	0.696	25%	0.251	S	S	*	.	I	π-helix	trans	-90	-26.5	-171.5	-64.5	168.2	-155.2	0	0	113	P216	P216-E220 VanDerWaalsContact O-CB 3.24Å; P216-E220 WeakPolarHBondContact O-CB 3.4Å; P216-E220 VanDerWaalsContact O-CG 3.27Å; P216-E220 WeakPolarHBondContact O-CG 3.48Å; P216-E220 PolarHBondContact O-N 3.21Å
221	V	98.4	Very high	97.3	Very high	47 Å²	47	45.7 Å²	45.7	29%	0.285	27%	0.265	S	S	.	.	I	π-helix	trans	-119.2	-54.3	-172.7	-173.8	0	0	0	0	112	Y107 F217 Q225	Y107-V221 HydrophobicContact CE1-CG1 3.77Å; F217-V221 HydrophobicContact CD2-CB 4.01Å; F217-V221 HydrophobicContact CD2-CG2 3.7Å; F217-V221 HydrophobicContact CE2-CB 3.8Å; F217-V221 HydrophobicContact CE2-CG1 3.87Å; F217-V221 HydrophobicContact CE2-CG2 3.67Å; F217-V221 HydrophobicContact CZ-CB 4.12Å; F217-V221 HydrophobicContact CZ-CG1 3.92Å; F217-V221 HydrophobicContact CZ-CG2 4.48Å; F217-V221 WeakPolarHBondContact O-CB 3.44Å; F217-V221 PolarHBondContact O-N 3.42Å; V221-Q225 WeakPolarHBondContact O-CG 3.47Å
222	I	98.5	Very high	97.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	26%	0.261	C	S	.	.	I	π-helix	trans	-76.3	-54.2	-171.3	-60	175.7	0	0	0	111.6	Y107 F217 W218 Q225 I226 V232 I234	Y107-I222 HydrophobicContact CD1-CG1 4.1Å; Y107-I222 HydrophobicContact CD2-CD1 4.38Å; Y107-I222 HydrophobicContact CD2-CG1 4.02Å; Y107-I222 HydrophobicContact CE1-CG1 4.06Å; Y107-I222 HydrophobicContact CE2-CB 4.45Å; Y107-I222 HydrophobicContact CE2-CG1 3.95Å; Y107-I222 HydrophobicContact CE2-CG2 4.31Å; Y107-I222 HydrophobicContact CG-CD1 4.24Å; Y107-I222 HydrophobicContact CG-CG1 4.08Å; F217-I222 HydrophobicContact CD1-CD1 3.75Å; F217-I222 HydrophobicContact CD1-CG1 4.04Å; F217-I222 HydrophobicContact CE1-CD1 3.75Å; F217-I222 HydrophobicContact CE1-CG1 3.84Å; F217-I222 PolarHBondContact O-N 2.91Å; W218-I222 HydrophobicContact CE3-CB 4.02Å; W218-I222 HydrophobicContact CE3-CD1 4.21Å; W218-I222 HydrophobicContact CE3-CG2 3.69Å; W218-I222 HydrophobicContact CH2-CG2 4.48Å; W218-I222 HydrophobicContact CZ3-CB 4.49Å; W218-I222 HydrophobicContact CZ3-CG2 3.67Å; W218-I222 PolarHBondContact O-N 3.3Å; I222-Q225 WeakPolarHBondContact O-CB 3.27Å; I222-Q225 PolarHBondContact O-N 3.16Å; I222-I226 HydrophobicContact CG2-CD1 3.88Å; I222-I226 HydrophobicContact CG2-CG1 4.34Å; I222-I226 PolarHBondContact O-N 3.33Å; I222-I226 VanDerWaalsContact O-N 3.15Å; I222-V232 HydrophobicContact CG2-CG1 4.21Å; I222-I234 HydrophobicContact CD1-CD1 3.81Å; I222-I234 HydrophobicContact CD1-CG1 4.43Å; I222-I234 HydrophobicContact CG2-CD1 4.23Å
223	A	97.9	Very high	97.5	Very high	9 Å²	9	42 Å²	42	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-55.6	-42.3	-176.6	0	0	0	0	0	113.1	W218 Q225 I226 K227 L275	W218-A223 VanDerWaalsContact O-CB 3.3Å; W218-A223 WeakPolarHBondContact O-CB 3.23Å; W218-A223 PolarHBondContact O-N 3.07Å; A223-Q225 VanDerWaalsContact C-N 3.31Å; A223-Q225 PolarHBondContact O-N 3.31Å; A223-I226 PolarHBondContact O-N 3.45Å; A223-K227 WeakPolarHBondContact O-CG 3.35Å; A223-K227 PolarHBondContact O-N 3.41Å; A223-L275 HydrophobicContact CB-CD1 3.38Å
224	P	98	Very high	97.6	Very high	57 Å²	57	41.2 Å²	41.2	37%	0.37	23%	0.234	S	C	.	.	H	α-helix	trans	-61.7	-34.6	174.2	-26.3	36.9	0	0	0	113.7	N219 A228	N219-P224 VanDerWaalsContact O-CD 3.31Å; N219-P224 WeakPolarHBondContact O-CD 3.27Å; P224-A228 WeakPolarHBondContact O-CB 3.5Å; P224-A228 PolarHBondContact O-N 2.86Å
225	Q	98.2	Very high	97.7	Very high	54 Å²	54	41.1 Å²	41.1	25%	0.252	23%	0.233	S	C	.	.	H	α-helix	trans	-67.1	-42.5	175	-62.3	-49.8	-62	0	0	111.4	V105 Y107 V221 I222 A223 A228 K230 V232	V105-Q225 HydrophobicContact CG1-CB 4.29Å; V105-Q225 HydrophobicContact CG1-CG 4.38Å; Y107-Q225 WeakPolarHBondContact OH-CG 3.4Å; V221-Q225 WeakPolarHBondContact O-CG 3.47Å; I222-Q225 WeakPolarHBondContact O-CB 3.27Å; I222-Q225 PolarHBondContact O-N 3.16Å; A223-Q225 VanDerWaalsContact C-N 3.31Å; A223-Q225 PolarHBondContact O-N 3.31Å; Q225-A228 WeakPolarHBondContact O-CB 3.28Å; Q225-A228 PolarHBondContact O-N 2.97Å; Q225-K230 HydrophobicContact CB-CB 4.4Å; Q225-K230 HydrophobicContact CB-CD 4.24Å; Q225-K230 WeakPolarHBondContact O-CB 3.32Å; Q225-K230 PolarHBondContact O-N 2.82Å; Q225-K230 VanDerWaalsContact O-N 3.14Å; Q225-K230 VanDerWaalsContact OE1-CD 3.25Å; Q225-V232 HydrophobicContact CB-CG2 4.34Å
226	I	97.5	Very high	97.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-48	177.9	-58.8	174.1	0	0	0	109.8	H55 L57 W218 I222 A223 A228 G229 V232 L271 L275	H55-I226 HydrophobicContact CB-CG2 3.4Å; H55-I226 VanDerWaalsContact CB-CG2 3.4Å; H55-I226 PolarHBondContact CE1-O 3.48Å; H55-I226 VanDerWaalsContact CE1-O 3.26Å; H55-I226 PolarHBondContact ND1-O 3.3Å; L57-I226 HydrophobicContact CB-CD1 4.47Å; L57-I226 HydrophobicContact CD1-CD1 4.34Å; W218-I226 HydrophobicContact CH2-CD1 3.63Å; W218-I226 HydrophobicContact CZ2-CD1 4.36Å; W218-I226 HydrophobicContact CZ3-CD1 4.06Å; I222-I226 HydrophobicContact CG2-CD1 3.88Å; I222-I226 HydrophobicContact CG2-CG1 4.34Å; I222-I226 PolarHBondContact O-N 3.33Å; I222-I226 VanDerWaalsContact O-N 3.15Å; A223-I226 PolarHBondContact O-N 3.45Å; I226-A228 PolarHBondContact O-N 3.28Å; I226-G229 WeakPolarHBondContact O-CA 3.46Å; I226-G229 PolarHBondContact O-N 2.78Å; I226-V232 HydrophobicContact CG1-CB 4.16Å; I226-V232 HydrophobicContact CG1-CG2 3.61Å; I226-L271 HydrophobicContact CD1-CD1 4.45Å; I226-L271 HydrophobicContact CG2-CD1 4.46Å; I226-L275 HydrophobicContact CB-CD2 4.01Å; I226-L275 HydrophobicContact CG2-CD2 3.49Å; I226-L275 VanDerWaalsContact CG2-CD2 3.49Å
227	K	95.7	Very high	97.8	Very high	114 Å²	114	37.7 Å²	37.7	50%	0.496	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-26.6	176.3	-70.9	-173	175.6	-167.4	0	113.4	A223 G229 A273 L275	A223-K227 WeakPolarHBondContact O-CG 3.35Å; A223-K227 PolarHBondContact O-N 3.41Å; K227-G229 PolarHBondContact O-N 3.33Å; K227-A273 WeakPolarHBondContact CE-O 3.35Å; K227-L275 HydrophobicContact CG-CD1 4.18Å; K227-L275 HydrophobicContact CG-CD2 4.02Å; K227-L275 HydrophobicContact CG-CG 4.14Å
228	A	95.8	Very high	97.6	Very high	74 Å²	74	37 Å²	37	61%	0.612	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	5.6	171.6	0	0	0	0	0	113.6	P224 Q225 I226	P224-A228 WeakPolarHBondContact O-CB 3.5Å; P224-A228 PolarHBondContact O-N 2.86Å; Q225-A228 WeakPolarHBondContact O-CB 3.28Å; Q225-A228 PolarHBondContact O-N 2.97Å; I226-A228 PolarHBondContact O-N 3.28Å
229	G	95.2	Very high	97.4	Very high	48 Å²	48	37.3 Å²	37.3	50%	0.495	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	9	177.2	0	0	0	0	0	114.8	I226 K227	I226-G229 WeakPolarHBondContact O-CA 3.46Å; I226-G229 PolarHBondContact O-N 2.78Å; K227-G229 PolarHBondContact O-N 3.33Å
230	K	96.9	Very high	97.3	Very high	77 Å²	77	33.3 Å²	33.3	34%	0.335	19%	0.191	S	C	.	.			trans	-77.7	138	178.3	-65.5	-168.7	-176.6	177.4	0	111.6	D104 V105 Q225	D104-K230 HydrophobicContact CB-CB 3.92Å; D104-K230 HydrophobicContact CB-CD 4.15Å; D104-K230 HydrophobicContact CB-CG 4.05Å; V105-K230 HydrophobicContact CG1-CB 4.48Å; V105-K230 HydrophobicContact CG1-CD 4.24Å; Q225-K230 HydrophobicContact CB-CB 4.4Å; Q225-K230 HydrophobicContact CB-CD 4.24Å; Q225-K230 WeakPolarHBondContact O-CB 3.32Å; Q225-K230 PolarHBondContact O-N 2.82Å; Q225-K230 VanDerWaalsContact O-N 3.14Å; Q225-K230 VanDerWaalsContact OE1-CD 3.25Å
231	N	97.6	Very high	97.2	Very high	55 Å²	55	26.2 Å²	26.2	29%	0.294	16%	0.158	S	C	.	.			trans	-78.3	119.7	167.4	-60.8	-65	0	0	0	109.1	K102 F103 D104	K102-N231 WeakPolarHBondContact O-CB 3.5Å; F103-N231 HydrophobicContact CD1-CB 4.45Å; D104-N231 PolarHBondContact N-O 3.23Å; D104-N231 WeakPolarHBondContact OD2-CB 3.25Å; D104-N231 PolarHBondContact OD2-N 3.02Å; D104-N231 PolarHBondContact OD2-ND2 3.41Å
232	V	98.6	Very high	97	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.5	-172.6	177.8	0	0	0	0	110.8	R56 L57 V58 V105 Y107 I222 Q225 I226 I234	R56-V232 PolarHBondContact O-N 3.01Å; L57-V232 HydrophobicContact CD1-CB 4.04Å; L57-V232 HydrophobicContact CD1-CG1 3.94Å; V58-V232 PolarHBondContact N-O 3.27Å; V105-V232 HydrophobicContact CG1-CG2 3.76Å; Y107-V232 HydrophobicContact CD2-CG1 3.53Å; Y107-V232 HydrophobicContact CE2-CG1 3.6Å; Y107-V232 HydrophobicContact CE2-CG2 4.5Å; I222-V232 HydrophobicContact CG2-CG1 4.21Å; Q225-V232 HydrophobicContact CB-CG2 4.34Å; I226-V232 HydrophobicContact CG1-CB 4.16Å; I226-V232 HydrophobicContact CG1-CG2 3.61Å; V232-I234 HydrophobicContact CG1-CG1 4.12Å
233	I	98.8	Very high	96.8	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	136	164.3	-172.4	168.3	0	0	0	111.6	V58 V60 I96 F103 V105 C106 Y107 L118 I121	V58-I233 HydrophobicContact CB-CB 4.45Å; V58-I233 HydrophobicContact CB-CG1 4.2Å; V58-I233 HydrophobicContact CG1-CD1 4.2Å; V58-I233 HydrophobicContact CG1-CG1 4.16Å; V58-I233 CarbonylContact O-C 3.53Å; V58-I233 VanDerWaalsContact O-CA 3.25Å; V58-I233 WeakPolarHBondContact O-CA 3.45Å; V60-I233 HydrophobicContact CG2-CD1 4.17Å; V60-I233 HydrophobicContact CG2-CG1 4.42Å; I96-I233 HydrophobicContact CD1-CD1 4.03Å; F103-I233 HydrophobicContact CB-CG2 4.22Å; F103-I233 HydrophobicContact CD1-CB 3.77Å; F103-I233 HydrophobicContact CD1-CG2 4.14Å; F103-I233 HydrophobicContact CD2-CB 4.23Å; F103-I233 HydrophobicContact CD2-CD1 4.42Å; F103-I233 HydrophobicContact CD2-CG2 4.01Å; F103-I233 HydrophobicContact CE1-CB 3.82Å; F103-I233 HydrophobicContact CE1-CD1 4.45Å; F103-I233 HydrophobicContact CE2-CB 4.25Å; F103-I233 HydrophobicContact CE2-CD1 3.82Å; F103-I233 HydrophobicContact CE2-CG2 4.43Å; F103-I233 HydrophobicContact CG-CB 3.99Å; F103-I233 HydrophobicContact CG-CG2 3.84Å; F103-I233 HydrophobicContact CZ-CB 4.06Å; F103-I233 HydrophobicContact CZ-CD1 3.84Å; F103-I233 HydrophobicContact CZ-CG1 4.37Å; V105-I233 PolarHBondContact O-N 2.92Å; C106-I233 WeakPolarHBondContact CA-O 3.43Å; C106-I233 HydrophobicContact CB-CG2 3.9Å; C106-I233 WeakPolarHBondContact SG-CG2 3.23Å; Y107-I233 PolarHBondContact N-O 3.06Å; L118-I233 HydrophobicContact CD1-CG2 4.13Å; I121-I233 HydrophobicContact CD1-CD1 4.19Å; I121-I233 HydrophobicContact CG2-CD1 3.87Å
234	I	98.9	Very high	96.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	112.1	174.7	-49	173.6	0	0	0	109.4	L57 V58 I59 V60 Y107 L138 W218 I222 V232 A236 L241 I244	L57-I234 HydrophobicContact CD1-CD1 3.79Å; L57-I234 HydrophobicContact CD1-CG1 3.96Å; V58-I234 PolarHBondContact O-N 3.45Å; I59-I234 CarbonylContact C-O 3.55Å; I59-I234 WeakPolarHBondContact CA-O 3.46Å; I59-I234 HydrophobicContact CG2-CB 4.1Å; I59-I234 HydrophobicContact CG2-CD1 4.04Å; I59-I234 HydrophobicContact CG2-CG1 4.33Å; V60-I234 PolarHBondContact N-O 3.45Å; Y107-I234 HydrophobicContact CD2-CG1 4.42Å; Y107-I234 WeakPolarHBondContact O-CA 3.48Å; L138-I234 HydrophobicContact CD1-CG2 4.02Å; L138-I234 HydrophobicContact CD2-CG2 4.38Å; W218-I234 HydrophobicContact CE3-CD1 4.41Å; W218-I234 HydrophobicContact CZ3-CD1 4.13Å; I222-I234 HydrophobicContact CD1-CD1 3.81Å; I222-I234 HydrophobicContact CD1-CG1 4.43Å; I222-I234 HydrophobicContact CG2-CD1 4.23Å; V232-I234 HydrophobicContact CG1-CG1 4.12Å; I234-A236 HydrophobicContact CG2-CB 4.15Å; I234-L241 HydrophobicContact CG2-CD2 4.08Å; I234-I244 HydrophobicContact CD1-CD1 3.95Å
235	A	98.8	Very high	96.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	110.2	170.6	0	0	0	0	0	109.7	V60 Y107 T108 L118	V60-A235 CarbonylContact O-C 3.57Å; V60-A235 WeakPolarHBondContact O-CA 3.39Å; Y107-A235 PolarHBondContact O-N 2.87Å; T108-A235 VanDerWaalsContact CA-O 3.24Å; T108-A235 WeakPolarHBondContact CA-O 3.42Å; T108-A235 VanDerWaalsContact CB-O 3.28Å; T108-A235 WeakPolarHBondContact CB-O 3.29Å; T108-A235 PolarHBondContact OG1-O 2.99Å; L118-A235 HydrophobicContact CB-CB 3.71Å; L118-A235 HydrophobicContact CD1-CB 4.23Å; L118-A235 HydrophobicContact CG-CB 4.41Å
236	A	98.7	Very high	96.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	-145.7	-173.8	0	0	0	0	0	112	V60 H62 L138 I234 L241	V60-A236 PolarHBondContact O-N 3.39Å; H62-A236 PolarHBondContact CD2-O 2.98Å; H62-A236 VanDerWaalsContact CD2-O 3.3Å; H62-A236 PolarHBondContact N-O 3.28Å; L138-A236 HydrophobicContact CB-CB 4.48Å; I234-A236 HydrophobicContact CG2-CB 4.15Å; A236-L241 HydrophobicContact CB-CD1 4.43Å; A236-L241 HydrophobicContact CB-CD2 3.85Å; A236-L241 HydrophobicContact CB-CG 3.93Å
237	H	97.9	Very high	96.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.139	C	C	.	.			trans	-122.8	171.5	-167.6	-54	-87.3	0	0	0	112.2	H62 S109 R113 L138 E140 S240 L241	H62-H237 AromaticContact CD2-CE1 3.63Å; H62-H237 AromaticContact CD2-CG 3.83Å; H62-H237 AromaticContact CD2-ND1 3.01Å; H62-H237 PolarHBondContact CD2-ND1 3.16Å; H62-H237 AromaticContact NE2-CE1 3.82Å; H62-H237 AromaticContact NE2-CG 3.98Å; H62-H237 AromaticContact NE2-ND1 3Å; H62-H237 PolarHBondContact NE2-ND1 2.94Å; S109-H237 WeakPolarHBondContact CB-NE2 3.49Å; S109-H237 PolarHBondContact OG-NE2 2.8Å; R113-H237 PolarHBondContact NE-CE1 3.37Å; R113-H237 PolarHBondContact NE-ND1 3.06Å; L138-H237 PolarHBondContact O-CD2 3.28Å; L138-H237 VanDerWaalsContact O-CD2 3.29Å; E140-H237 HydrophobicContact CB-CB 3.69Å; E140-H237 HydrophobicContact CG-CB 4.13Å; E140-H237 PolarHBondContact N-CD2 2.82Å; E140-H237 WeakPolarHBondContact OE2-CB 3.45Å; H237-S240 PolarHBondContact N-OG 3.4Å; H237-L241 VanDerWaalsContact O-CB 3.23Å; H237-L241 WeakPolarHBondContact O-CB 3.32Å; H237-L241 VanDerWaalsContact O-CG 3.22Å; H237-L241 WeakPolarHBondContact O-CG 3.4Å; H237-L241 PolarHBondContact O-N 2.92Å
238	G	94	Very high	96.2	Very high	4 Å²	4	19.2 Å²	19.2	4%	0.041	12%	0.116	C	C	.	.	H	α-helix	trans	-58.1	-56	-175.3	0	0	0	0	0	112.4	E140 R242	E140-G238 PolarHBondContact OE2-N 2.6Å; G238-R242 WeakPolarHBondContact O-CB 3.12Å; G238-R242 VanDerWaalsContact O-CG 3.24Å; G238-R242 WeakPolarHBondContact O-CG 3.41Å; G238-R242 PolarHBondContact O-N 3.16Å
239	N	93.7	Very high	96.1	Very high	9 Å²	9	19 Å²	19	5%	0.048	10%	0.102	C	C	.	.	H	α-helix	trans	-78.3	-32.8	-173.2	-60.4	-69.2	0	0	0	113.2	E140 R141 Y143 L207 T210 R242 G243	E140-N239 WeakPolarHBondContact OE1-CB 3.45Å; E140-N239 PolarHBondContact OE1-N 3.06Å; E140-N239 PolarHBondContact OE1-ND2 3.43Å; R141-N239 HydrophobicContact CB-CB 3.86Å; Y143-N239 PolarHBondContact OH-ND2 3.25Å; Y143-N239 VanDerWaalsContact OH-ND2 3.15Å; L207-N239 HydrophobicContact CD1-CB 3.88Å; T210-N239 HydrophobicContact CG2-CB 4.27Å; N239-R242 PolarHBondContact O-N 3.41Å; N239-G243 PolarHBondContact O-N 3.45Å; N239-G243 VanDerWaalsContact O-N 3.11Å
240	S	95.8	Very high	96.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.3	-40.9	175.4	51.4	0	0	0	0	112	L138 N139 H237 G243 I244	L138-S240 WeakPolarHBondContact O-CB 3.27Å; L138-S240 PolarHBondContact O-OG 2.94Å; N139-S240 VanDerWaalsContact O-CB 3.3Å; N139-S240 WeakPolarHBondContact O-CB 3.43Å; N139-S240 PolarHBondContact O-OG 3.23Å; H237-S240 PolarHBondContact N-OG 3.4Å; S240-G243 PolarHBondContact O-N 3.44Å; S240-I244 PolarHBondContact O-N 3.16Å
241	L	97.2	Very high	95.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.2	-37.5	174.4	-68.3	180	0	0	0	112.4	I59 R61 I234 A236 H237 G243 I244 V245 L261	I59-L241 HydrophobicContact CB-CD1 4.44Å; I59-L241 HydrophobicContact CB-CD2 3.95Å; I59-L241 HydrophobicContact CD1-CD2 4.39Å; I59-L241 HydrophobicContact CG2-CD2 4.3Å; R61-L241 HydrophobicContact CB-CD1 4.08Å; I234-L241 HydrophobicContact CG2-CD2 4.08Å; A236-L241 HydrophobicContact CB-CD1 4.43Å; A236-L241 HydrophobicContact CB-CD2 3.85Å; A236-L241 HydrophobicContact CB-CG 3.93Å; H237-L241 VanDerWaalsContact O-CB 3.23Å; H237-L241 WeakPolarHBondContact O-CB 3.32Å; H237-L241 VanDerWaalsContact O-CG 3.22Å; H237-L241 WeakPolarHBondContact O-CG 3.4Å; H237-L241 PolarHBondContact O-N 2.92Å; L241-G243 PolarHBondContact O-N 2.75Å; L241-I244 HydrophobicContact CD2-CD1 4.2Å; L241-I244 PolarHBondContact O-N 2.76Å; L241-I244 VanDerWaalsContact O-N 3.07Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 3.03Å; L241-L261 HydrophobicContact CB-CD1 3.43Å; L241-L261 VanDerWaalsContact CB-CD1 3.43Å; L241-L261 HydrophobicContact CD1-CD1 4.44Å
242	R	93.8	Very high	95.8	Very high	20 Å²	20	21.7 Å²	21.7	8%	0.075	11%	0.114	C	C	.	.	H	α-helix	trans	-53.8	-38.4	170	-80.4	177.8	-155.3	-153.5	-0.1	111.7	G238 N239 I244 V245 K246 I256 L259 N260 L261	G238-R242 WeakPolarHBondContact O-CB 3.12Å; G238-R242 VanDerWaalsContact O-CG 3.24Å; G238-R242 WeakPolarHBondContact O-CG 3.41Å; G238-R242 PolarHBondContact O-N 3.16Å; N239-R242 PolarHBondContact O-N 3.41Å; R242-I244 PolarHBondContact O-N 3.34Å; R242-V245 PolarHBondContact O-N 3.16Å; R242-K246 WeakPolarHBondContact O-CB 3.23Å; R242-K246 PolarHBondContact O-N 3.2Å; R242-I256 HydrophobicContact CB-CD1 3.8Å; R242-I256 HydrophobicContact CB-CG1 4.07Å; R242-I256 HydrophobicContact CG-CD1 4.12Å; R242-I256 VanDerWaalsContact O-CD1 3.26Å; R242-I256 WeakPolarHBondContact O-CD1 3.3Å; R242-L259 HydrophobicContact CG-CD2 4.38Å; R242-L259 PolarHBondContact NE-O 2.84Å; R242-L259 VanDerWaalsContact NE-O 3.08Å; R242-L259 PolarHBondContact NH1-O 2.9Å; R242-L259 PolarHBondContact NH2-O 3.38Å; R242-N260 PolarHBondContact NH2-OD1 3.49Å; R242-L261 HydrophobicContact CG-CD1 4.31Å; R242-L261 HydrophobicContact CG-CG 4.44Å
243	G	92.9	Very high	95.5	Very high	1 Å²	1	25 Å²	25	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-44.3	175	0	0	0	0	0	114.6	I211 N239 S240 L241 H247	I211-G243 VanDerWaalsContact CG1-CA 3.46Å; N239-G243 PolarHBondContact O-N 3.45Å; N239-G243 VanDerWaalsContact O-N 3.11Å; S240-G243 PolarHBondContact O-N 3.44Å; L241-G243 PolarHBondContact O-N 2.75Å; G243-H247 PolarHBondContact O-N 3.4Å
244	I	95.4	Very high	95.1	Very high	1 Å²	1	28 Å²	28	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-65.8	-46	176.2	-61.9	174.5	0	0	0	110	L138 W218 I234 S240 L241 R242 K246 H247 L248	L138-I244 HydrophobicContact CD2-CD1 4.13Å; W218-I244 HydrophobicContact CD2-CG2 4.33Å; W218-I244 HydrophobicContact CE3-CD1 4.38Å; W218-I244 HydrophobicContact CE3-CG1 4.45Å; W218-I244 HydrophobicContact CE3-CG2 3.73Å; W218-I244 HydrophobicContact CH2-CG2 4.33Å; W218-I244 HydrophobicContact CZ3-CG2 3.72Å; I234-I244 HydrophobicContact CD1-CD1 3.95Å; S240-I244 PolarHBondContact O-N 3.16Å; L241-I244 HydrophobicContact CD2-CD1 4.2Å; L241-I244 PolarHBondContact O-N 2.76Å; L241-I244 VanDerWaalsContact O-N 3.07Å; R242-I244 PolarHBondContact O-N 3.34Å; I244-K246 PolarHBondContact O-N 3.42Å; I244-H247 PolarHBondContact O-N 2.8Å; I244-L248 HydrophobicContact CG2-CD1 3.89Å; I244-L248 HydrophobicContact CG2-CG 4.28Å; I244-L248 WeakPolarHBondContact O-CG 3.5Å; I244-L248 PolarHBondContact O-N 2.71Å
245	V	96.2	Very high	94.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-45.5	178.2	174.5	0	0	0	0	111.5	I59 L241 R242 H247 L248 E249 M251 L259 L261 Y269 M281	I59-V245 HydrophobicContact CD1-CG2 3.74Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 3.03Å; R242-V245 PolarHBondContact O-N 3.16Å; V245-H247 PolarHBondContact O-N 3.44Å; V245-L248 PolarHBondContact O-N 2.85Å; V245-E249 HydrophobicContact CG1-CG 4.41Å; V245-E249 PolarHBondContact O-N 2.77Å; V245-M251 HydrophobicContact CG1-SD 3.91Å; V245-L259 HydrophobicContact CB-CD2 4.08Å; V245-L259 HydrophobicContact CG1-CD2 3.53Å; V245-L261 HydrophobicContact CG2-CD1 4.48Å; V245-Y269 WeakPolarHBondContact CG1-OH 3.41Å; V245-Y269 HydrophobicContact CG2-CE2 4.4Å; V245-Y269 WeakPolarHBondContact CG2-OH 3.35Å; V245-M281 HydrophobicContact CG1-CE 3.92Å
246	K	95	Very high	94.2	Very high	39 Å²	39	29.9 Å²	29.9	17%	0.17	17%	0.172	C	C	.	.	H	α-helix	trans	-54.1	-41.6	176.2	-168.8	-169	-166.6	-64.8	0	111.7	F170 I211 R242 I244 D250 M251 D253 I256	F170-K246 HydrophobicContact CE2-CD 4.08Å; I211-K246 HydrophobicContact CD1-CD 3.73Å; R242-K246 WeakPolarHBondContact O-CB 3.23Å; R242-K246 PolarHBondContact O-N 3.2Å; I244-K246 PolarHBondContact O-N 3.42Å; K246-D250 WeakPolarHBondContact O-CA 3.5Å; K246-D250 PolarHBondContact O-N 3.13Å; K246-D250 VanDerWaalsContact O-N 3.11Å; K246-M251 HydrophobicContact CG-CB 4.03Å; K246-M251 WeakPolarHBondContact CG-O 3.41Å; K246-M251 PolarHBondContact NZ-O 2.74Å; K246-M251 PolarHBondContact O-N 2.97Å; K246-D253 WeakPolarHBondContact CE-OD1 3.42Å; K246-D253 IonicContact NZ-OD1 2.79Å; K246-D253 PolarHBondContact NZ-OD1 3.04Å; K246-I256 HydrophobicContact CB-CB 4.39Å; K246-I256 HydrophobicContact CB-CD1 3.92Å; K246-I256 HydrophobicContact CB-CG1 3.95Å; K246-I256 HydrophobicContact CD-CB 4.32Å; K246-I256 HydrophobicContact CD-CG1 4.4Å; K246-I256 HydrophobicContact CD-CG2 4Å; K246-I256 HydrophobicContact CG-CB 4.14Å; K246-I256 HydrophobicContact CG-CG1 4.23Å; K246-I256 HydrophobicContact CG-CG2 4.35Å
247	H	94.3	Very high	93.6	Very high	71 Å²	71	32.3 Å²	32.3	33%	0.329	18%	0.184	S	C	.	.	H	α-helix	trans	-74.1	-41.8	-179.4	174.4	71.9	0	0	0	113	L215 W218 G243 I244 V245	L215-H247 HydrophobicContact CD1-CB 4.5Å; L215-H247 HydrophobicContact CD2-CB 3.56Å; W218-H247 AromaticContact CD1-CD2 3.65Å; W218-H247 AromaticContact CD1-NE2 3.71Å; W218-H247 AromaticContact NE1-CD2 3.35Å; W218-H247 PolarHBondContact NE1-CD2 3.46Å; W218-H247 VanDerWaalsContact NE1-CD2 3.35Å; W218-H247 AromaticContact NE1-NE2 3.39Å; W218-H247 PolarHBondContact NE1-NE2 3.49Å; G243-H247 PolarHBondContact O-N 3.4Å; I244-H247 PolarHBondContact O-N 2.8Å; V245-H247 PolarHBondContact O-N 3.44Å
248	L	94.6	Very high	93.1	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-48.5	177.6	-73.4	176	0	0	0	111.6	L57 W218 I244 V245 Y269 L271 L275 P277	L57-L248 HydrophobicContact CD2-CD1 3.96Å; W218-L248 HydrophobicContact CH2-CD1 4.26Å; W218-L248 HydrophobicContact CH2-CD2 3.86Å; W218-L248 HydrophobicContact CH2-CG 4.38Å; W218-L248 HydrophobicContact CZ2-CD2 3.52Å; W218-L248 HydrophobicContact CZ2-CG 4.28Å; I244-L248 HydrophobicContact CG2-CD1 3.89Å; I244-L248 HydrophobicContact CG2-CG 4.28Å; I244-L248 WeakPolarHBondContact O-CG 3.5Å; I244-L248 PolarHBondContact O-N 2.71Å; V245-L248 PolarHBondContact O-N 2.85Å; L248-Y269 HydrophobicContact CD1-CD1 4.33Å; L248-Y269 HydrophobicContact CD1-CD2 4.32Å; L248-Y269 HydrophobicContact CD1-CE1 4.32Å; L248-Y269 HydrophobicContact CD1-CE2 4.33Å; L248-Y269 HydrophobicContact CD1-CG 4.31Å; L248-L271 HydrophobicContact CD2-CD1 4.25Å; L248-L271 HydrophobicContact CD2-CD2 4.09Å; L248-L275 WeakPolarHBondContact CD2-O 3.44Å; L248-P277 HydrophobicContact CB-CG 4.12Å; L248-P277 WeakPolarHBondContact O-CD 3.17Å
249	E	94.6	Very high	92.8	Very high	69 Å²	69	39.3 Å²	39.3	32%	0.322	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	4.5	-174.9	-65.2	-164.6	175.7	0	0	114.1	V245 M251 Y269 P277 M281	V245-E249 HydrophobicContact CG1-CG 4.41Å; V245-E249 PolarHBondContact O-N 2.77Å; E249-M251 VanDerWaalsContact C-N 3.25Å; E249-M251 HydrophobicContact CB-CG 3.72Å; E249-M251 HydrophobicContact CB-SD 4.38Å; E249-M251 PolarHBondContact O-N 2.84Å; E249-Y269 HydrophobicContact CG-CE1 4.19Å; E249-Y269 PolarHBondContact OE1-OH 3.09Å; E249-P277 HydrophobicContact CG-CG 4.19Å; E249-M281 VanDerWaalsContact OE1-CE 3.23Å; E249-M281 WeakPolarHBondContact OE1-CE 3.23Å
250	D	93.4	Very high	92.4	Very high	136 Å²	136	39.9 Å²	39.9	73%	0.727	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	44.7	-177.7	-161.6	30.2	0	0	0	112.9	K246	K246-D250 WeakPolarHBondContact O-CA 3.5Å; K246-D250 PolarHBondContact O-N 3.13Å; K246-D250 VanDerWaalsContact O-N 3.11Å
251	M	93.9	Very high	92.2	Very high	32 Å²	32	40 Å²	40	16%	0.158	22%	0.22	C	C	.	.			trans	-76.5	142.8	-173.7	-58.1	179.4	76.7	0	0	111.9	V245 K246 E249 A255 I256 L259	V245-M251 HydrophobicContact CG1-SD 3.91Å; K246-M251 HydrophobicContact CG-CB 4.03Å; K246-M251 WeakPolarHBondContact CG-O 3.41Å; K246-M251 PolarHBondContact NZ-O 2.74Å; K246-M251 PolarHBondContact O-N 2.97Å; E249-M251 VanDerWaalsContact C-N 3.25Å; E249-M251 HydrophobicContact CB-CG 3.72Å; E249-M251 HydrophobicContact CB-SD 4.38Å; E249-M251 PolarHBondContact O-N 2.84Å; M251-A255 HydrophobicContact CB-CB 4.33Å; M251-A255 HydrophobicContact CE-CB 3.75Å; M251-I256 HydrophobicContact CE-CD1 4.5Å; M251-I256 HydrophobicContact SD-CD1 3.87Å; M251-L259 HydrophobicContact CE-CB 4.35Å; M251-L259 HydrophobicContact SD-CD2 4.23Å
252	S	95.1	Very high	92	Very high	69 Å²	69	40.1 Å²	40.1	48%	0.483	22%	0.221	S	C	.	.			trans	-65.4	159.5	168.2	73.2	0	0	0	0	111.8	A254 A255 I256	S252-A254 PolarHBondContact O-N 2.81Å; S252-A255 PolarHBondContact O-N 3.2Å; S252-A255 WeakPolarHBondContact OG-CB 3.22Å; S252-A255 PolarHBondContact OG-N 3Å; S252-A255 VanDerWaalsContact OG-N 3.16Å; S252-I256 PolarHBondContact O-N 3.35Å; S252-I256 VanDerWaalsContact O-N 3.1Å
253	D	92.5	Very high	92	Very high	70 Å²	70	40.3 Å²	40.3	37%	0.374	22%	0.224	S	C	.	.	H	α-helix	trans	-61.7	-35.8	177.5	-61.9	-7.8	0	0	0	110.9	F170 K246 I256 M257	F170-D253 HydrophobicContact CB-CB 4.27Å; F170-D253 HydrophobicContact CD1-CB 3.94Å; F170-D253 VanDerWaalsContact CD1-CG 3.5Å; F170-D253 VanDerWaalsContact CD1-OD2 3.31Å; F170-D253 WeakPolarHBondContact CD1-OD2 3.29Å; F170-D253 HydrophobicContact CD2-CB 4.2Å; F170-D253 HydrophobicContact CE1-CB 4.33Å; F170-D253 VanDerWaalsContact CE1-CG 3.41Å; F170-D253 WeakPolarHBondContact CE1-OD2 3.39Å; F170-D253 HydrophobicContact CG-CB 3.87Å; F170-D253 WeakPolarHBondContact CZ-OD1 3.12Å; K246-D253 WeakPolarHBondContact CE-OD1 3.42Å; K246-D253 IonicContact NZ-OD1 2.79Å; K246-D253 PolarHBondContact NZ-OD1 3.04Å; D253-I256 VanDerWaalsContact O-CG2 3.28Å; D253-I256 WeakPolarHBondContact O-CG2 3.34Å; D253-M257 VanDerWaalsContact O-CG 3.26Å; D253-M257 WeakPolarHBondContact O-CG 3.37Å; D253-M257 PolarHBondContact O-N 2.73Å
254	A	89.7	Confident	92.1	Very high	62 Å²	62	40.3 Å²	40.3	51%	0.512	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-44.7	174	0	0	0	0	0	112.7	S252 I256 M257	S252-A254 PolarHBondContact O-N 2.81Å; A254-I256 PolarHBondContact O-N 3.46Å; A254-M257 PolarHBondContact O-N 2.65Å
255	A	90.1	Very high	92.2	Very high	40 Å²	40	40.4 Å²	40.4	33%	0.331	23%	0.225	S	C	.	.	H	α-helix	trans	-66.4	-39.7	-177.8	0	0	0	0	0	112	M251 S252 M257 E258 L259	M251-A255 HydrophobicContact CB-CB 4.33Å; M251-A255 HydrophobicContact CE-CB 3.75Å; S252-A255 PolarHBondContact O-N 3.2Å; S252-A255 WeakPolarHBondContact OG-CB 3.22Å; S252-A255 PolarHBondContact OG-N 3Å; S252-A255 VanDerWaalsContact OG-N 3.16Å; A255-M257 VanDerWaalsContact C-N 3.29Å; A255-M257 PolarHBondContact O-N 3.24Å; A255-E258 PolarHBondContact O-N 2.99Å; A255-L259 PolarHBondContact O-N 2.74Å
256	I	89.9	Confident	92.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.1	-26.1	-178.9	-166	62.6	0	0	0	113.4	F170 L207 R242 K246 M251 S252 D253 A254 E258 L259	F170-I256 HydrophobicContact CD2-CG2 4.16Å; F170-I256 HydrophobicContact CE2-CG2 4.42Å; L207-I256 HydrophobicContact CD2-CG1 4.35Å; L207-I256 HydrophobicContact CD2-CG2 4.16Å; R242-I256 HydrophobicContact CB-CD1 3.8Å; R242-I256 HydrophobicContact CB-CG1 4.07Å; R242-I256 HydrophobicContact CG-CD1 4.12Å; R242-I256 VanDerWaalsContact O-CD1 3.26Å; R242-I256 WeakPolarHBondContact O-CD1 3.3Å; K246-I256 HydrophobicContact CB-CB 4.39Å; K246-I256 HydrophobicContact CB-CD1 3.92Å; K246-I256 HydrophobicContact CB-CG1 3.95Å; K246-I256 HydrophobicContact CD-CB 4.32Å; K246-I256 HydrophobicContact CD-CG1 4.4Å; K246-I256 HydrophobicContact CD-CG2 4Å; K246-I256 HydrophobicContact CG-CB 4.14Å; K246-I256 HydrophobicContact CG-CG1 4.23Å; K246-I256 HydrophobicContact CG-CG2 4.35Å; M251-I256 HydrophobicContact CE-CD1 4.5Å; M251-I256 HydrophobicContact SD-CD1 3.87Å; S252-I256 PolarHBondContact O-N 3.35Å; S252-I256 VanDerWaalsContact O-N 3.1Å; D253-I256 VanDerWaalsContact O-CG2 3.28Å; D253-I256 WeakPolarHBondContact O-CG2 3.34Å; A254-I256 PolarHBondContact O-N 3.46Å; I256-E258 VanDerWaalsContact C-N 3.26Å; I256-E258 PolarHBondContact O-N 3.12Å; I256-L259 HydrophobicContact CD1-CB 4.18Å; I256-L259 HydrophobicContact CD1-CD2 3.64Å; I256-L259 PolarHBondContact O-N 3.07Å
257	M	86.5	Confident	92.5	Very high	52 Å²	52	38.6 Å²	38.6	26%	0.256	22%	0.217	S	C	.	.	H	α-helix	trans	-66.3	-30.6	175.6	-70.1	-169.6	-69	0	0	112.3	R168 F170 D253 A254 A255	R168-M257 WeakPolarHBondContact O-CG 3.42Å; F170-M257 HydrophobicContact CB-CG 4.44Å; F170-M257 HydrophobicContact CB-SD 4.17Å; D253-M257 VanDerWaalsContact O-CG 3.26Å; D253-M257 WeakPolarHBondContact O-CG 3.37Å; D253-M257 PolarHBondContact O-N 2.73Å; A254-M257 PolarHBondContact O-N 2.65Å; A255-M257 VanDerWaalsContact C-N 3.29Å; A255-M257 PolarHBondContact O-N 3.24Å
258	E	86.4	Confident	92.6	Very high	116 Å²	116	35.6 Å²	35.6	54%	0.542	20%	0.203	S	C	.	.	H	α-helix	trans	-89.7	-20.9	179.7	-65	-51.4	136.9	0	0	113.7	R168 A255 I256 N260	R168-E258 IonicContact NH1-OE1 2.78Å; R168-E258 PolarHBondContact NH1-OE1 3.33Å; R168-E258 IonicContact NH1-OE2 3.43Å; R168-E258 PolarHBondContact NH1-OE2 3.32Å; A255-E258 PolarHBondContact O-N 2.99Å; I256-E258 VanDerWaalsContact C-N 3.26Å; I256-E258 PolarHBondContact O-N 3.12Å; E258-N260 PolarHBondContact O-N 2.94Å; E258-N260 PolarHBondContact O-ND2 3.5Å
259	L	87.6	Confident	92.8	Very high	35 Å²	35	35.4 Å²	35.4	18%	0.183	20%	0.203	C	C	.	.			trans	-64.2	124.7	173.9	-178.2	68.6	0	0	0	110.5	R242 V245 M251 A255 I256 L261 M281	R242-L259 HydrophobicContact CG-CD2 4.38Å; R242-L259 PolarHBondContact NE-O 2.84Å; R242-L259 VanDerWaalsContact NE-O 3.08Å; R242-L259 PolarHBondContact NH1-O 2.9Å; R242-L259 PolarHBondContact NH2-O 3.38Å; V245-L259 HydrophobicContact CB-CD2 4.08Å; V245-L259 HydrophobicContact CG1-CD2 3.53Å; M251-L259 HydrophobicContact CE-CB 4.35Å; M251-L259 HydrophobicContact SD-CD2 4.23Å; A255-L259 PolarHBondContact O-N 2.74Å; I256-L259 HydrophobicContact CD1-CB 4.18Å; I256-L259 HydrophobicContact CD1-CD2 3.64Å; I256-L259 PolarHBondContact O-N 3.07Å; L259-L261 HydrophobicContact CD1-CD2 4.29Å; L259-L261 HydrophobicContact CD2-CD2 4.03Å; L259-L261 HydrophobicContact CG-CD2 4.14Å; L259-M281 HydrophobicContact CD1-CE 4.43Å
260	N	85.6	Confident	92.8	Very high	20 Å²	20	33.7 Å²	33.7	11%	0.107	20%	0.195	C	C	.	.			trans	-122.9	126.6	168.4	-58.4	-84.9	0	0	0	109.5	R242 E258 V297	R242-N260 PolarHBondContact NH2-OD1 3.49Å; E258-N260 PolarHBondContact O-N 2.94Å; E258-N260 PolarHBondContact O-ND2 3.5Å; N260-V297 HydrophobicContact CB-CB 4.21Å; N260-V297 HydrophobicContact CB-CG1 3.51Å; N260-V297 HydrophobicContact CB-CG2 4.06Å; N260-V297 WeakPolarHBondContact O-CG1 3.41Å
261	L	90.8	Very high	93	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.01	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-88.9	129.2	179	-57.8	176.9	0	0	0	109.7	R61 L241 R242 V245 L259 I267	R61-L261 VanDerWaalsContact CD-O 3.3Å; R61-L261 WeakPolarHBondContact CD-O 3.45Å; R61-L261 PolarHBondContact NH1-O 3.43Å; L241-L261 HydrophobicContact CB-CD1 3.43Å; L241-L261 VanDerWaalsContact CB-CD1 3.43Å; L241-L261 HydrophobicContact CD1-CD1 4.44Å; R242-L261 HydrophobicContact CG-CD1 4.31Å; R242-L261 HydrophobicContact CG-CG 4.44Å; V245-L261 HydrophobicContact CG2-CD1 4.48Å; L259-L261 HydrophobicContact CD1-CD2 4.29Å; L259-L261 HydrophobicContact CD2-CD2 4.03Å; L259-L261 HydrophobicContact CG-CD2 4.14Å; L261-I267 HydrophobicContact CB-CD1 4.45Å; L261-I267 HydrophobicContact CD2-CD1 3.76Å
262	P	93.1	Very high	93	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.026	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-65.6	152.2	178.6	27.6	-33.3	0	0	0	111.2	R61 I265 F283 A293 M294 V297	R61-P262 WeakPolarHBondContact CB-O 3.4Å; P262-I265 HydrophobicContact CB-CB 4.29Å; P262-I265 HydrophobicContact CB-CD1 4.08Å; P262-I265 HydrophobicContact CB-CG1 4.31Å; P262-I265 HydrophobicContact CG-CB 3.93Å; P262-I265 HydrophobicContact CG-CD1 4.25Å; P262-I265 HydrophobicContact CG-CG1 4.43Å; P262-I265 HydrophobicContact CG-CG2 4.39Å; P262-F283 HydrophobicContact CG-CD1 4.09Å; P262-F283 HydrophobicContact CG-CE1 3.86Å; P262-A293 HydrophobicContact CB-CB 3.87Å; P262-M294 HydrophobicContact CB-CE 4.28Å; P262-M294 HydrophobicContact CG-CE 3.95Å; P262-V297 HydrophobicContact CB-CG2 4.14Å
263	T	94.4	Very high	92.8	Very high	24 Å²	24	25.6 Å²	25.6	15%	0.147	15%	0.148	C	C	.	.	S	Bend	trans	-79.7	138.2	175.5	47.3	0	0	0	0	110.8	R61 H62 E88 I265	R61-T263 HydrophobicContact CG-CG2 4.4Å; R61-T263 VanDerWaalsContact CZ-CG2 3.42Å; H62-T263 WeakPolarHBondContact O-CB 3.28Å; H62-T263 WeakPolarHBondContact O-CG2 3.36Å; E88-T263 PolarHBondContact OE1-OG1 3.09Å; E88-T263 VanDerWaalsContact OE2-CB 3.25Å; E88-T263 WeakPolarHBondContact OE2-CB 3.33Å; E88-T263 PolarHBondContact OE2-OG1 3.45Å; T263-I265 PolarHBondContact O-N 3.08Å
264	G	96	Very high	92.7	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.01	16%	0.162	C	C	.	.	S	Bend	trans	67.5	-1.1	173.4	0	0	0	0	0	116.7	R61 G92 P266	R61-G264 WeakPolarHBondContact O-CA 3.36Å; R61-G264 PolarHBondContact O-N 2.96Å; G92-G264 WeakPolarHBondContact CA-O 3.43Å; G264-P266 WeakPolarHBondContact O-CD 3.32Å
265	I	97.1	Very high	93	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.015	14%	0.141	C	C	.	.			trans	-92.2	121.5	176.4	-63.1	-171	0	0	0	109.5	P262 T263 F283 T289 A293	P262-I265 HydrophobicContact CB-CB 4.29Å; P262-I265 HydrophobicContact CB-CD1 4.08Å; P262-I265 HydrophobicContact CB-CG1 4.31Å; P262-I265 HydrophobicContact CG-CB 3.93Å; P262-I265 HydrophobicContact CG-CD1 4.25Å; P262-I265 HydrophobicContact CG-CG1 4.43Å; P262-I265 HydrophobicContact CG-CG2 4.39Å; T263-I265 PolarHBondContact O-N 3.08Å; I265-F283 HydrophobicContact CG2-CB 3.83Å; I265-F283 HydrophobicContact CG2-CD1 3.84Å; I265-F283 HydrophobicContact CG2-CG 4.3Å; I265-T289 HydrophobicContact CD1-CG2 4.19Å; I265-A293 HydrophobicContact CD1-CB 3.19Å; I265-A293 HydrophobicContact CG1-CB 4.31Å
266	P	98.2	Very high	93.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.5	173.2	-14.5	27.5	0	0	0	111.8	V58 V60 G92 I96 G264 F283 L284	V58-P266 HydrophobicContact CG1-CB 3.97Å; V60-P266 HydrophobicContact CG2-CB 4.06Å; V60-P266 HydrophobicContact CG2-CG 4.49Å; G92-P266 WeakPolarHBondContact O-CG 3.48Å; I96-P266 HydrophobicContact CD1-CB 3.97Å; I96-P266 HydrophobicContact CD1-CG 3.71Å; I96-P266 HydrophobicContact CG1-CB 3.92Å; I96-P266 HydrophobicContact CG1-CG 3.64Å; G264-P266 WeakPolarHBondContact O-CD 3.32Å; P266-F283 WeakPolarHBondContact O-CA 3.33Å; P266-L284 HydrophobicContact CB-CB 4.11Å; P266-L284 HydrophobicContact CB-CD1 4.05Å; P266-L284 HydrophobicContact CB-CG 4.31Å; P266-L284 HydrophobicContact CG-CB 4.21Å; P266-L284 PolarHBondContact O-N 3.43Å
267	I	97.9	Very high	93.5	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.4	178.2	-55.6	171.5	0	0	0	107.7	V58 I59 L261 Y269 M281 S282 F283	V58-I267 CarbonylContact C-O 3.59Å; V58-I267 WeakPolarHBondContact CA-O 3.48Å; I59-I267 HydrophobicContact CD1-CB 4.43Å; I59-I267 HydrophobicContact CD1-CD1 4.45Å; I59-I267 HydrophobicContact CD1-CG2 4.5Å; I59-I267 HydrophobicContact CG1-CB 3.72Å; I59-I267 HydrophobicContact CG1-CD1 4.3Å; I59-I267 HydrophobicContact CG1-CG1 4.47Å; I59-I267 HydrophobicContact CG1-CG2 4.2Å; I59-I267 PolarHBondContact N-O 3.08Å; I59-I267 PolarHBondContact O-N 3.18Å; L261-I267 HydrophobicContact CB-CD1 4.45Å; L261-I267 HydrophobicContact CD2-CD1 3.76Å; I267-Y269 HydrophobicContact CG2-CD2 4.39Å; I267-Y269 HydrophobicContact CG2-CE2 3.96Å; I267-M281 HydrophobicContact CG2-CB 3.74Å; I267-M281 HydrophobicContact CG2-CG 3.94Å; I267-M281 HydrophobicContact CG2-SD 3.75Å; I267-S282 CarbonylContact C-O 3.59Å; I267-S282 WeakPolarHBondContact CA-O 3.28Å; I267-F283 HydrophobicContact CD1-CD1 4.4Å; I267-F283 HydrophobicContact CD1-CE1 3.87Å; I267-F283 HydrophobicContact CG1-CD1 3.73Å; I267-F283 HydrophobicContact CG1-CE1 3.69Å
268	V	97.8	Very high	93.9	Very high	7 Å²	7	31 Å²	31	4%	0.042	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.4	-174.8	-172.8	0	0	0	0	109.2	L57 V58 M101 S282 L284	L57-V268 WeakPolarHBondContact O-CA 3.31Å; V58-V268 HydrophobicContact CG2-CG2 4.29Å; M101-V268 HydrophobicContact CE-CG1 4.15Å; M101-V268 HydrophobicContact CE-CG2 3.7Å; M101-V268 HydrophobicContact SD-CG2 4.31Å; V268-S282 PolarHBondContact N-O 2.86Å; V268-S282 PolarHBondContact O-N 3.24Å; V268-L284 HydrophobicContact CG2-CD1 3.72Å; V268-L284 HydrophobicContact CG2-CD2 3.83Å; V268-L284 HydrophobicContact CG2-CG 3.55Å
269	Y	97.8	Very high	94.2	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137	167.8	-78.9	-88.8	0	0	0	110.1	R56 L57 I59 V245 L248 E249 I267 L271 P277 M281	R56-Y269 WeakPolarHBondContact CA-O 3.31Å; L57-Y269 PolarHBondContact N-O 2.9Å; L57-Y269 PolarHBondContact O-N 2.9Å; I59-Y269 HydrophobicContact CD1-CE2 3.95Å; I59-Y269 HydrophobicContact CG1-CE2 4.5Å; V245-Y269 WeakPolarHBondContact CG1-OH 3.41Å; V245-Y269 HydrophobicContact CG2-CE2 4.4Å; V245-Y269 WeakPolarHBondContact CG2-OH 3.35Å; L248-Y269 HydrophobicContact CD1-CD1 4.33Å; L248-Y269 HydrophobicContact CD1-CD2 4.32Å; L248-Y269 HydrophobicContact CD1-CE1 4.32Å; L248-Y269 HydrophobicContact CD1-CE2 4.33Å; L248-Y269 HydrophobicContact CD1-CG 4.31Å; E249-Y269 HydrophobicContact CG-CE1 4.19Å; E249-Y269 PolarHBondContact OE1-OH 3.09Å; I267-Y269 HydrophobicContact CG2-CD2 4.39Å; I267-Y269 HydrophobicContact CG2-CE2 3.96Å; Y269-L271 HydrophobicContact CD1-CD2 4.13Å; Y269-L271 HydrophobicContact CG-CD2 4.33Å; Y269-P277 HydrophobicContact CD1-CB 4.06Å; Y269-P277 HydrophobicContact CD1-CG 3.82Å; Y269-P277 HydrophobicContact CE1-CB 4.33Å; Y269-P277 HydrophobicContact CE1-CG 3.89Å; Y269-M281 HydrophobicContact CD1-CB 4.38Å; Y269-M281 HydrophobicContact CD2-CB 4.49Å; Y269-M281 HydrophobicContact CE1-CB 3.83Å; Y269-M281 HydrophobicContact CE2-CB 3.94Å; Y269-M281 VanDerWaalsContact OH-CE 3.31Å; Y269-M281 WeakPolarHBondContact OH-CE 3.47Å
270	E	95.8	Very high	94.5	Very high	33 Å²	33	33.3 Å²	33.3	15%	0.154	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122	160.8	-77.1	178.3	-165.6	0	0	107.2	V54 H55 R56 P277 V278 K279	V54-E270 HydrophobicContact CG1-CB 3.65Å; V54-E270 HydrophobicContact CG1-CG 3.85Å; H55-E270 CarbonylContact O-C 3.59Å; H55-E270 WeakPolarHBondContact O-CA 3.4Å; R56-E270 HydrophobicContact CG-CG 4.21Å; R56-E270 IonicContact CZ-OE1 2.85Å; R56-E270 IonicContact NE-OE1 2.76Å; R56-E270 IonicContact NH2-OE1 2.8Å; R56-E270 PolarHBondContact NH2-OE1 3.13Å; E270-P277 WeakPolarHBondContact O-CA 3.41Å; E270-V278 HydrophobicContact CB-CG2 3.72Å; E270-V278 PolarHBondContact O-N 3.08Å; E270-K279 HydrophobicContact CB-CG 4.49Å; E270-K279 IonicContact OE1-NZ 3.44Å; E270-K279 PolarHBondContact OE1-NZ 3.22Å; E270-K279 WeakPolarHBondContact OE2-CE 3.12Å; E270-K279 IonicContact OE2-NZ 3.28Å; E270-K279 PolarHBondContact OE2-NZ 3.24Å
271	L	96.1	Very high	94.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	142	-171.7	-54.1	176.7	0	0	0	110.1	V54 H55 L57 I226 L248 Y269 L275 K276 P277	V54-L271 CarbonylContact C-O 3.56Å; V54-L271 WeakPolarHBondContact CA-O 3.42Å; H55-L271 HydrophobicContact CB-CB 4.37Å; H55-L271 PolarHBondContact N-O 3.43Å; H55-L271 PolarHBondContact O-N 2.93Å; L57-L271 HydrophobicContact CB-CD1 4.2Å; L57-L271 HydrophobicContact CD2-CD1 4.42Å; I226-L271 HydrophobicContact CD1-CD1 4.45Å; I226-L271 HydrophobicContact CG2-CD1 4.46Å; L248-L271 HydrophobicContact CD2-CD1 4.25Å; L248-L271 HydrophobicContact CD2-CD2 4.09Å; Y269-L271 HydrophobicContact CD1-CD2 4.13Å; Y269-L271 HydrophobicContact CG-CD2 4.33Å; L271-L275 HydrophobicContact CD1-CB 4.39Å; L271-L275 HydrophobicContact CD1-CD2 4.28Å; L271-K276 CarbonylContact C-O 3.55Å; L271-K276 VanDerWaalsContact CA-O 3.3Å; L271-K276 WeakPolarHBondContact CA-O 3.32Å; L271-P277 HydrophobicContact CD2-CB 4.35Å; L271-P277 HydrophobicContact CD2-CG 3.96Å
272	D	94.3	Very high	95	Very high	54 Å²	54	35.9 Å²	35.9	29%	0.289	20%	0.199	S	C	.	.			trans	-75.6	-178.2	169.4	66.9	19.5	0	0	0	112	H55 D274 L275 K276 V278	H55-D272 PolarHBondContact CD2-O 3.49Å; D272-D274 PolarHBondContact O-N 3.44Å; D272-D274 WeakPolarHBondContact OD1-CA 3.35Å; D272-D274 PolarHBondContact OD1-N 2.95Å; D272-L275 WeakPolarHBondContact O-CA 3.38Å; D272-L275 PolarHBondContact O-N 3.5Å; D272-L275 PolarHBondContact OD1-N 2.8Å; D272-L275 VanDerWaalsContact OD1-N 3.08Å; D272-K276 PolarHBondContact N-O 3.48Å; D272-K276 PolarHBondContact OD1-N 2.87Å; D272-V278 HydrophobicContact CB-CG1 3.78Å
273	A	91.3	Very high	95.1	Very high	13 Å²	13	38.5 Å²	38.5	11%	0.107	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.7	179.2	0	0	0	0	0	114.4	N50 K227 L275	N50-A273 HydrophobicContact CB-CB 4.47Å; N50-A273 VanDerWaalsContact O-CB 3.31Å; N50-A273 WeakPolarHBondContact O-CB 3.38Å; N50-A273 WeakPolarHBondContact OD1-CB 3.44Å; K227-A273 WeakPolarHBondContact CE-O 3.35Å; A273-L275 VanDerWaalsContact C-N 3.28Å
274	D	91.3	Very high	95.1	Very high	124 Å²	124	38.7 Å²	38.7	66%	0.663	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	7.2	175.4	-68.5	-44.3	0	0	0	112.4	D272 K276	D272-D274 PolarHBondContact O-N 3.44Å; D272-D274 WeakPolarHBondContact OD1-CA 3.35Å; D272-D274 PolarHBondContact OD1-N 2.95Å; D274-K276 VanDerWaalsContact C-N 3.26Å; D274-K276 PolarHBondContact O-N 3.08Å
275	L	94.9	Very high	94.9	Very high	12 Å²	12	40.4 Å²	40.4	6%	0.063	23%	0.229	C	C	.	.	S	Bend	trans	62.9	28.8	-177.2	-52.8	-177.7	0	0	0	113.6	W218 A223 I226 K227 L248 L271 D272 A273	W218-L275 HydrophobicContact CZ2-CD1 4.28Å; A223-L275 HydrophobicContact CB-CD1 3.38Å; I226-L275 HydrophobicContact CB-CD2 4.01Å; I226-L275 HydrophobicContact CG2-CD2 3.49Å; I226-L275 VanDerWaalsContact CG2-CD2 3.49Å; K227-L275 HydrophobicContact CG-CD1 4.18Å; K227-L275 HydrophobicContact CG-CD2 4.02Å; K227-L275 HydrophobicContact CG-CG 4.14Å; L248-L275 WeakPolarHBondContact CD2-O 3.44Å; L271-L275 HydrophobicContact CD1-CB 4.39Å; L271-L275 HydrophobicContact CD1-CD2 4.28Å; D272-L275 WeakPolarHBondContact O-CA 3.38Å; D272-L275 PolarHBondContact O-N 3.5Å; D272-L275 PolarHBondContact OD1-N 2.8Å; D272-L275 VanDerWaalsContact OD1-N 3.08Å; A273-L275 VanDerWaalsContact C-N 3.28Å
276	K	95.1	Very high	94.4	Very high	87 Å²	87	44 Å²	44	38%	0.378	25%	0.248	S	C	.	.			trans	-91.2	136.2	172.6	-66.4	-62.1	-171.7	175.6	0	110.7	L271 D272 D274 V278	L271-K276 CarbonylContact C-O 3.55Å; L271-K276 VanDerWaalsContact CA-O 3.3Å; L271-K276 WeakPolarHBondContact CA-O 3.32Å; D272-K276 PolarHBondContact N-O 3.48Å; D272-K276 PolarHBondContact OD1-N 2.87Å; D274-K276 VanDerWaalsContact C-N 3.26Å; D274-K276 PolarHBondContact O-N 3.08Å; K276-V278 PolarHBondContact O-N 3.43Å
277	P	95.6	Very high	93.8	Very high	37 Å²	37	52.5 Å²	52.5	24%	0.24	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-57.7	124.8	175.3	-25	34.9	0	0	0	111.8	L248 E249 Y269 E270 L271 K279	L248-P277 HydrophobicContact CB-CG 4.12Å; L248-P277 WeakPolarHBondContact O-CD 3.17Å; E249-P277 HydrophobicContact CG-CG 4.19Å; Y269-P277 HydrophobicContact CD1-CB 4.06Å; Y269-P277 HydrophobicContact CD1-CG 3.82Å; Y269-P277 HydrophobicContact CE1-CB 4.33Å; Y269-P277 HydrophobicContact CE1-CG 3.89Å; E270-P277 WeakPolarHBondContact O-CA 3.41Å; L271-P277 HydrophobicContact CD2-CB 4.35Å; L271-P277 HydrophobicContact CD2-CG 3.96Å; P277-K279 VanDerWaalsContact C-N 3.32Å
278	V	94.9	Very high	93.3	Very high	78 Å²	78	58.1 Å²	58.1	47%	0.473	31%	0.314	S	S	.	.	S	Bend	trans	-84.2	-13.3	176.4	-59	0	0	0	0	112.6	E270 D272 K276	E270-V278 HydrophobicContact CB-CG2 3.72Å; E270-V278 PolarHBondContact O-N 3.08Å; D272-V278 HydrophobicContact CB-CG1 3.78Å; K276-V278 PolarHBondContact O-N 3.43Å
279	K	93.5	Very high	92.7	Very high	86 Å²	86	59.1 Å²	59.1	37%	0.374	32%	0.32	S	S	.	.	S	Bend	trans	-153.3	164.4	176.5	69	-173.2	-171.9	-165.8	0	109.9	E270 P277	E270-K279 HydrophobicContact CB-CG 4.49Å; E270-K279 IonicContact OE1-NZ 3.44Å; E270-K279 PolarHBondContact OE1-NZ 3.22Å; E270-K279 WeakPolarHBondContact OE2-CE 3.12Å; E270-K279 IonicContact OE2-NZ 3.28Å; E270-K279 PolarHBondContact OE2-NZ 3.24Å; P277-K279 VanDerWaalsContact C-N 3.32Å
280	P	92.6	Very high	92.1	Very high	112 Å²	112	60.3 Å²	60.3	73%	0.727	33%	0.327	S	S	*	.			trans	-56	147.8	174.7	-24.6	34.9	0	0	0	112.1	S282	P280-S282 PolarHBondContact O-N 3.29Å
281	M	93.4	Very high	91.6	Very high	30 Å²	30	65.1 Å²	65.1	15%	0.148	35%	0.348	C	S	.	.			trans	-55.1	138.9	173.9	78	-179.7	92.1	0	0	110.8	V245 E249 L259 I267 Y269 F283	V245-M281 HydrophobicContact CG1-CE 3.92Å; E249-M281 VanDerWaalsContact OE1-CE 3.23Å; E249-M281 WeakPolarHBondContact OE1-CE 3.23Å; L259-M281 HydrophobicContact CD1-CE 4.43Å; I267-M281 HydrophobicContact CG2-CB 3.74Å; I267-M281 HydrophobicContact CG2-CG 3.94Å; I267-M281 HydrophobicContact CG2-SD 3.75Å; Y269-M281 HydrophobicContact CD1-CB 4.38Å; Y269-M281 HydrophobicContact CD2-CB 4.49Å; Y269-M281 HydrophobicContact CE1-CB 3.83Å; Y269-M281 HydrophobicContact CE2-CB 3.94Å; Y269-M281 VanDerWaalsContact OH-CE 3.31Å; Y269-M281 WeakPolarHBondContact OH-CE 3.47Å; M281-F283 HydrophobicContact CG-CZ 4.39Å; M281-F283 HydrophobicContact SD-CZ 4.21Å
282	S	93.8	Very high	91.2	Very high	46 Å²	46	70.8 Å²	70.8	32%	0.322	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.8	178	60	0	0	0	0	111.5	I267 V268 P280	I267-S282 CarbonylContact C-O 3.59Å; I267-S282 WeakPolarHBondContact CA-O 3.28Å; V268-S282 PolarHBondContact N-O 2.86Å; V268-S282 PolarHBondContact O-N 3.24Å; P280-S282 PolarHBondContact O-N 3.29Å
283	F	95.3	Very high	90.5	Very high	59 Å²	59	69 Å²	69	26%	0.259	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	134.8	178.6	-59	-83.1	0	0	0	110.4	P262 I265 P266 I267 M281 V290 M294	P262-F283 HydrophobicContact CG-CD1 4.09Å; P262-F283 HydrophobicContact CG-CE1 3.86Å; I265-F283 HydrophobicContact CG2-CB 3.83Å; I265-F283 HydrophobicContact CG2-CD1 3.84Å; I265-F283 HydrophobicContact CG2-CG 4.3Å; P266-F283 WeakPolarHBondContact O-CA 3.33Å; I267-F283 HydrophobicContact CD1-CD1 4.4Å; I267-F283 HydrophobicContact CD1-CE1 3.87Å; I267-F283 HydrophobicContact CG1-CD1 3.73Å; I267-F283 HydrophobicContact CG1-CE1 3.69Å; M281-F283 HydrophobicContact CG-CZ 4.39Å; M281-F283 HydrophobicContact SD-CZ 4.21Å; F283-V290 HydrophobicContact CB-CG1 3.71Å; F283-V290 HydrophobicContact CB-CG2 3.92Å; F283-V290 HydrophobicContact CD2-CG1 4.14Å; F283-V290 HydrophobicContact CG-CG1 4.06Å; F283-M294 HydrophobicContact CE1-SD 4.3Å; F283-M294 HydrophobicContact CE2-SD 3.87Å; F283-M294 HydrophobicContact CZ-CE 4.41Å; F283-M294 HydrophobicContact CZ-SD 3.74Å
284	L	94.8	Very high	89.9	Confident	28 Å²	28	71 Å²	71	15%	0.147	37%	0.373	C	S	.	.			trans	-91.4	132.7	172.6	-60	-178.7	0	0	0	111	A95 I96 A99 M101 P266 V268	A95-L284 HydrophobicContact CB-CB 3.98Å; I96-L284 HydrophobicContact CG1-CD1 4.07Å; A99-L284 HydrophobicContact CB-CD1 4.29Å; A99-L284 HydrophobicContact CB-CD2 4.38Å; M101-L284 HydrophobicContact CE-CD1 3.58Å; M101-L284 HydrophobicContact CE-CD2 3.97Å; M101-L284 HydrophobicContact CE-CG 4.32Å; M101-L284 HydrophobicContact SD-CD1 3.63Å; P266-L284 HydrophobicContact CB-CB 4.11Å; P266-L284 HydrophobicContact CB-CD1 4.05Å; P266-L284 HydrophobicContact CB-CG 4.31Å; P266-L284 HydrophobicContact CG-CB 4.21Å; P266-L284 PolarHBondContact O-N 3.43Å; V268-L284 HydrophobicContact CG2-CD1 3.72Å; V268-L284 HydrophobicContact CG2-CD2 3.83Å; V268-L284 HydrophobicContact CG2-CG 3.55Å
285	G	91.3	Very high	89.4	Confident	38 Å²	38	70.4 Å²	70.4	39%	0.392	37%	0.366	S	S	.	.	S	Bend	trans	146.7	172.4	178.9	0	0	0	0	0	110.4
286	D	87.4	Confident	88.7	Confident	79 Å²	79	72.4 Å²	72.4	42%	0.422	38%	0.384	S	S	.	.			trans	-65.3	150.3	169.8	65.9	94.1	0	0	0	110.7	E288 T289 V290	D286-E288 PolarHBondContact O-N 2.89Å; D286-E288 WeakPolarHBondContact OD1-CB 3.32Å; D286-E288 PolarHBondContact OD1-N 2.92Å; D286-T289 VanDerWaalsContact CG-OG1 3.22Å; D286-T289 PolarHBondContact O-N 3.28Å; D286-T289 WeakPolarHBondContact OD1-CB 3.33Å; D286-T289 PolarHBondContact OD1-N 3.4Å; D286-T289 PolarHBondContact OD1-OG1 3.17Å; D286-T289 VanDerWaalsContact OD1-OG1 3.11Å; D286-T289 WeakPolarHBondContact OD2-CB 3.49Å; D286-T289 PolarHBondContact OD2-OG1 3.13Å; D286-V290 PolarHBondContact O-N 3.46Å
287	E	84.9	Confident	87.5	Confident	178 Å²	178	68.9 Å²	68.9	83%	0.832	37%	0.37	S	S	*	.	H	α-helix	trans	-57.1	-36.7	-174.8	-68.1	-175.4	172.2	0	0	112.5	K291	E287-K291 WeakPolarHBondContact O-CB 3.13Å; E287-K291 PolarHBondContact O-N 3.26Å
288	E	88.2	Confident	86.3	Confident	119 Å²	119	69.9 Å²	69.9	56%	0.556	38%	0.382	S	S	*	.	H	α-helix	trans	-67.9	-45	-179.3	-170.4	-177.6	170.4	0	0	111.3	D286 K291 K292	D286-E288 PolarHBondContact O-N 2.89Å; D286-E288 WeakPolarHBondContact OD1-CB 3.32Å; D286-E288 PolarHBondContact OD1-N 2.92Å; E288-K291 PolarHBondContact O-N 3.27Å; E288-K292 HydrophobicContact CG-CD 4.26Å; E288-K292 WeakPolarHBondContact O-CB 3.42Å; E288-K292 WeakPolarHBondContact O-CG 3.38Å; E288-K292 PolarHBondContact O-N 2.78Å; E288-K292 WeakPolarHBondContact OE1-CE 3.46Å; E288-K292 IonicContact OE1-NZ 3.32Å; E288-K292 PolarHBondContact OE1-NZ 2.75Å
289	T	84.7	Confident	85.2	Confident	28 Å²	28	68.7 Å²	68.7	17%	0.172	38%	0.38	C	S	.	.	H	α-helix	trans	-59.9	-48.8	174.7	-72	0	0	0	0	111.5	R91 I265 D286 K291 K292 A293	R91-T289 VanDerWaalsContact NE-CG2 3.27Å; I265-T289 HydrophobicContact CD1-CG2 4.19Å; D286-T289 VanDerWaalsContact CG-OG1 3.22Å; D286-T289 PolarHBondContact O-N 3.28Å; D286-T289 WeakPolarHBondContact OD1-CB 3.33Å; D286-T289 PolarHBondContact OD1-N 3.4Å; D286-T289 PolarHBondContact OD1-OG1 3.17Å; D286-T289 VanDerWaalsContact OD1-OG1 3.11Å; D286-T289 WeakPolarHBondContact OD2-CB 3.49Å; D286-T289 PolarHBondContact OD2-OG1 3.13Å; T289-K291 VanDerWaalsContact C-N 3.34Å; T289-K291 PolarHBondContact O-N 3.17Å; T289-K292 PolarHBondContact O-N 2.96Å; T289-A293 VanDerWaalsContact O-CB 3.3Å; T289-A293 WeakPolarHBondContact O-CB 3.07Å; T289-A293 PolarHBondContact O-N 2.81Å
290	V	84.9	Confident	83.7	Confident	26 Å²	26	68.8 Å²	68.8	16%	0.158	38%	0.382	C	S	.	.	H	α-helix	trans	-62.1	-45.9	-179.8	174.5	0	0	0	0	110	F283 D286 A293 M294	F283-V290 HydrophobicContact CB-CG1 3.71Å; F283-V290 HydrophobicContact CB-CG2 3.92Å; F283-V290 HydrophobicContact CD2-CG1 4.14Å; F283-V290 HydrophobicContact CG-CG1 4.06Å; D286-V290 PolarHBondContact O-N 3.46Å; V290-A293 PolarHBondContact O-N 3.28Å; V290-M294 HydrophobicContact CG1-CG 4.34Å; V290-M294 WeakPolarHBondContact O-CB 3.37Å; V290-M294 WeakPolarHBondContact O-CG 3.43Å; V290-M294 PolarHBondContact O-N 3.02Å
291	K	86.4	Confident	81.6	Confident	134 Å²	134	65.3 Å²	65.3	58%	0.583	37%	0.366	S	S	*	.	H	α-helix	trans	-59.6	-51.5	177.6	-177.3	179.4	174.7	-176.3	0	112.1	E287 E288 T289 A293 M294 E295	E287-K291 WeakPolarHBondContact O-CB 3.13Å; E287-K291 PolarHBondContact O-N 3.26Å; E288-K291 PolarHBondContact O-N 3.27Å; T289-K291 VanDerWaalsContact C-N 3.34Å; T289-K291 PolarHBondContact O-N 3.17Å; K291-A293 VanDerWaalsContact C-N 3.3Å; K291-A293 PolarHBondContact O-N 3.17Å; K291-M294 PolarHBondContact O-N 3.3Å; K291-M294 VanDerWaalsContact O-N 3.14Å; K291-E295 WeakPolarHBondContact CE-OE1 3.46Å; K291-E295 WeakPolarHBondContact O-CG 3.34Å; K291-E295 PolarHBondContact O-N 2.94Å
292	K	86.3	Confident	79.4	Confident	118 Å²	118	71.4 Å²	71.4	51%	0.513	39%	0.392	S	S	.	.	H	α-helix	trans	-59.2	-41.4	178.7	-77	177.5	-177.5	169.7	0	112.1	E288 T289 M294 E295 A296	E288-K292 HydrophobicContact CG-CD 4.26Å; E288-K292 WeakPolarHBondContact O-CB 3.42Å; E288-K292 WeakPolarHBondContact O-CG 3.38Å; E288-K292 PolarHBondContact O-N 2.78Å; E288-K292 WeakPolarHBondContact OE1-CE 3.46Å; E288-K292 IonicContact OE1-NZ 3.32Å; E288-K292 PolarHBondContact OE1-NZ 2.75Å; T289-K292 PolarHBondContact O-N 2.96Å; K292-M294 VanDerWaalsContact C-N 3.34Å; K292-E295 PolarHBondContact O-N 2.87Å; K292-A296 VanDerWaalsContact O-CB 3.32Å; K292-A296 WeakPolarHBondContact O-CB 3.25Å; K292-A296 PolarHBondContact O-N 3.45Å
293	A	79.8	Confident	77	Confident	18 Å²	18	72.2 Å²	72.2	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-67.7	-36.6	178.5	0	0	0	0	0	112.1	P262 I265 T289 V290 K291 A296 V297	P262-A293 HydrophobicContact CB-CB 3.87Å; I265-A293 HydrophobicContact CD1-CB 3.19Å; I265-A293 HydrophobicContact CG1-CB 4.31Å; T289-A293 VanDerWaalsContact O-CB 3.3Å; T289-A293 WeakPolarHBondContact O-CB 3.07Å; T289-A293 PolarHBondContact O-N 2.81Å; V290-A293 PolarHBondContact O-N 3.28Å; K291-A293 VanDerWaalsContact C-N 3.3Å; K291-A293 PolarHBondContact O-N 3.17Å; A293-A296 PolarHBondContact O-N 3Å; A293-V297 VanDerWaalsContact O-CB 3.29Å; A293-V297 WeakPolarHBondContact O-CB 3.16Å; A293-V297 PolarHBondContact O-N 2.85Å
294	M	78.3	Confident	74.4	Confident	54 Å²	54	79.4 Å²	79.4	27%	0.266	43%	0.433	S	S	.	.	H	α-helix	trans	-68.2	-39.7	174.7	-65.8	-80.8	65	0	0	112.7	P262 F283 V290 K291 K292 V297 A298	P262-M294 HydrophobicContact CB-CE 4.28Å; P262-M294 HydrophobicContact CG-CE 3.95Å; F283-M294 HydrophobicContact CE1-SD 4.3Å; F283-M294 HydrophobicContact CE2-SD 3.87Å; F283-M294 HydrophobicContact CZ-CE 4.41Å; F283-M294 HydrophobicContact CZ-SD 3.74Å; V290-M294 HydrophobicContact CG1-CG 4.34Å; V290-M294 WeakPolarHBondContact O-CB 3.37Å; V290-M294 WeakPolarHBondContact O-CG 3.43Å; V290-M294 PolarHBondContact O-N 3.02Å; K291-M294 PolarHBondContact O-N 3.3Å; K291-M294 VanDerWaalsContact O-N 3.14Å; K292-M294 VanDerWaalsContact C-N 3.34Å; M294-V297 HydrophobicContact CE-CB 3.97Å; M294-V297 HydrophobicContact CE-CG1 3.69Å; M294-V297 HydrophobicContact CE-CG2 4.1Å; M294-V297 WeakPolarHBondContact O-CB 3.39Å; M294-V297 PolarHBondContact O-N 3.33Å; M294-A298 WeakPolarHBondContact O-CB 3.37Å; M294-A298 PolarHBondContact O-N 3.03Å
295	E	82.3	Confident	71.3	Confident	111 Å²	111	91.1 Å²	91.1	52%	0.519	48%	0.482	S	S	.	.	H	α-helix	trans	-63.4	-44.8	172.2	-71.4	173	-179.8	0	0	111.8	K291 K292 V297 A298 A299	K291-E295 WeakPolarHBondContact CE-OE1 3.46Å; K291-E295 WeakPolarHBondContact O-CG 3.34Å; K291-E295 PolarHBondContact O-N 2.94Å; K292-E295 PolarHBondContact O-N 2.87Å; E295-V297 VanDerWaalsContact C-N 3.33Å; E295-V297 PolarHBondContact O-N 3.17Å; E295-A298 PolarHBondContact O-N 3.25Å; E295-A299 WeakPolarHBondContact O-CB 3Å; E295-A299 PolarHBondContact O-N 3.11Å
296	A	78.6	Confident	70.3	Confident	54 Å²	54	93.8 Å²	93.8	45%	0.446	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-40.3	176.9	0	0	0	0	0	111.9	K292 A293 A299 Q300	K292-A296 VanDerWaalsContact O-CB 3.32Å; K292-A296 WeakPolarHBondContact O-CB 3.25Å; K292-A296 PolarHBondContact O-N 3.45Å; A293-A296 PolarHBondContact O-N 3Å; A296-A299 PolarHBondContact O-N 3.09Å; A296-Q300 WeakPolarHBondContact O-CG 3.46Å; A296-Q300 PolarHBondContact O-N 3.3Å; A296-Q300 VanDerWaalsContact O-N 3.16Å
297	V	71	Confident	69.4	Low	13 Å²	13	94.6 Å²	94.6	8%	0.079	49%	0.49	C	S	.	.	H	α-helix	trans	-58.1	-49.8	171.8	134.8	0	0	0	0	111.1	N260 P262 A293 M294 E295 A299 Q300	N260-V297 HydrophobicContact CB-CB 4.21Å; N260-V297 HydrophobicContact CB-CG1 3.51Å; N260-V297 HydrophobicContact CB-CG2 4.06Å; N260-V297 WeakPolarHBondContact O-CG1 3.41Å; P262-V297 HydrophobicContact CB-CG2 4.14Å; A293-V297 VanDerWaalsContact O-CB 3.29Å; A293-V297 WeakPolarHBondContact O-CB 3.16Å; A293-V297 PolarHBondContact O-N 2.85Å; M294-V297 HydrophobicContact CE-CB 3.97Å; M294-V297 HydrophobicContact CE-CG1 3.69Å; M294-V297 HydrophobicContact CE-CG2 4.1Å; M294-V297 WeakPolarHBondContact O-CB 3.39Å; M294-V297 PolarHBondContact O-N 3.33Å; E295-V297 VanDerWaalsContact C-N 3.33Å; E295-V297 PolarHBondContact O-N 3.17Å; V297-A299 PolarHBondContact O-N 3.3Å; V297-Q300 WeakPolarHBondContact O-CB 3.25Å; V297-Q300 PolarHBondContact O-N 3.23Å
298	A	69.5	Low	68.6	Low	58 Å²	58	89.9 Å²	89.9	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-33.3	-179.8	0	0	0	0	0	111.6	M294 E295	M294-A298 WeakPolarHBondContact O-CB 3.37Å; M294-A298 PolarHBondContact O-N 3.03Å; E295-A298 PolarHBondContact O-N 3.25Å
299	A	72.1	Confident	67.4	Low	54 Å²	54	88.2 Å²	88.2	45%	0.446	47%	0.466	S	S	.	.	H	α-helix	trans	-70.5	-28.1	176.3	0	0	0	0	0	113.6	E295 A296 V297 G301 K302	E295-A299 WeakPolarHBondContact O-CB 3Å; E295-A299 PolarHBondContact O-N 3.11Å; A296-A299 PolarHBondContact O-N 3.09Å; V297-A299 PolarHBondContact O-N 3.3Å; A299-G301 PolarHBondContact O-N 2.74Å; A299-G301 VanDerWaalsContact O-N 3.09Å; A299-K302 PolarHBondContact O-N 2.88Å; A299-K302 VanDerWaalsContact O-O 3.13Å
300	Q	61.3	Low	66.3	Low	88 Å²	88	92 Å²	92	41%	0.411	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.7	178	-73.8	175.9	13.8	0	0	114.1	R167 A296 V297	R167-Q300 PolarHBondContact NH2-O 2.79Å; A296-Q300 WeakPolarHBondContact O-CG 3.46Å; A296-Q300 PolarHBondContact O-N 3.3Å; A296-Q300 VanDerWaalsContact O-N 3.16Å; V297-Q300 WeakPolarHBondContact O-CB 3.25Å; V297-Q300 PolarHBondContact O-N 3.23Å
301	G	49.1	Very low	65.1	Low	38 Å²	38	96.4 Å²	96.4	39%	0.392	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-10.2	172.3	0	0	0	0	0	115.4	A299	A299-G301 PolarHBondContact O-N 2.74Å; A299-G301 VanDerWaalsContact O-N 3.09Å
302	K	48.1	Very low	63.6	Low	159 Å²	159	93.7 Å²	93.7	69%	0.691	50%	0.501	S	S	*	.	S	Bend	trans	-98.6	131.2	177.1	-62.4	-178.6	-179.2	179.1	0	107.8	A299 K304	A299-K302 PolarHBondContact O-N 2.88Å; A299-K302 VanDerWaalsContact O-O 3.13Å; K302-K304 PolarHBondContact O-N 2.77Å
303	A	43	Very low	61.8	Low	63 Å²	63	91.8 Å²	91.8	52%	0.521	50%	0.5	S	S	.	.			trans	-55.6	134.9	170.5	0	0	0	0	0	108.6	K305	A303-K305 PolarHBondContact O-N 3.34Å
304	K	40.3	Very low	60.3	Low	210 Å²	210	98 Å²	98	91%	0.913	53%	0.53	S	S	*	.			trans	-68.1	105.1	162.2	-78.8	-173.1	175.6	-176.3	0	105	K302	K302-K304 PolarHBondContact O-N 2.77Å
305	K	30.7	Very low	58.7	Low	274 Å²	274	102 Å²	102	100%	1.191	55%	0.554	S	S	*	*			trans	-61.8	0	167	-76.6	-172.1	175.6	-174.3	0	110.1	A303	A303-K305 PolarHBondContact O-N 3.34Å

Retrieved 305 of 305 residues in 200.9 ms (Link to these results)

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